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  • Bradley Melting Point Dataset

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    Miss Hermione
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    The document appears to be a table containing information about various chemical compounds, including their names, smiles notation, melting points, CAS registry numbers, and sources. There are over 100 entries listing details for compounds that generally start with "1-" and include functional groups like alkyls, alkenes, alkynes, alcohols, amines, esters, and aromatics. The source for all compounds is listed as Alfa Aesar and melting points range from around -150C to over 200C.

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    BradleyMeltingPointDataset.xlsx

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    The document appears to be a table containing information about various chemical compounds, including their names, smiles notation, melting points, CAS registry numbers, and sources. There are over 100 entries listing details for compounds that generally start with "1-" and include functional groups like alkyls, alkenes, alkynes, alcohols, amines, esters, and aromatics. The source for all compounds is listed as Alfa Aesar and melting points range from around -150C to over 200C.

    Copyright:

    © All Rights Reserved
    Download as XLSX, PDF, TXT or read online from Scribd
    Flag for inappropriate content
    Download as xlsx, pdf, or txt
    116 views952 pages

    Bradley Melting Point Dataset

    Uploaded by

    Miss Hermione
    The document appears to be a table containing information about various chemical compounds, including their names, smiles notation, melting points, CAS registry numbers, and sources. There are over 100 entries listing details for compounds that generally start with "1-" and include functional groups like alkyls, alkenes, alkynes, alcohols, amines, esters, and aromatics. The source for all compounds is listed as Alfa Aesar and melting points range from around -150C to over 200C.

    Copyright:

    © All Rights Reserved
    Download as XLSX, PDF, TXT or read online from Scribd
    Flag for inappropriate content
    Download as xlsx, pdf, or txt
    of 952

    key name smiles mpC csid link source donotuse donotusebecause

    1 2-(2,4-dinitro c1ccnc(c1)Cc2 92 64018 http://www.aAlfa Aesar


    2 2-(1-piperidinyc1ccc(c(c1)N 46 403764 http://www.aAlfa Aesar
    3 2-(1-piperazinc1cnc(nc1)N2 33 80080 http://www.aAlfa Aesar
    4 2-(1-piperazinc1ccc(c(c1)N 125 63701 http://www.aAlfa Aesar
    5 2-(1-cyclohex C1CCC(=CC1) -55 69388 http://www.aAlfa Aesar
    6 2-(1-boc-4-pi CC(C)(C)OC(= 95 25027436 http://www. Alfa Aesar
    7 2-(1-boc-4-pi CC(C)(C)OC(= 86 25027435 http://www. Alfa Aesar
    8 2-(1-boc-4-pi CC(C)(C)OC(= 58 25027429 http://www. Alfa Aesar
    9 1-trimethylsil CC#C[Si](C)(C) -69 72592 http://www.aAlfa Aesar
    10 1-tetralone c1ccc2c(c1)C 7 10273 http://www.aAlfa Aesar
    11 1-pyrenecarb c1cc2ccc3ccc( 127 202982 http://www.aAlfa Aesar
    12 1-propanol CCCO -127 1004 http://www.aAlfa Aesar
    13 1-phenylcycloc1ccc(cc1)C2( 87 72450 http://www. Alfa Aesar
    14 1-phenylcycloc1ccc(cc1)C2 60 14582 http://www.aAlfa Aesar
    15 1-phenyl-3-pyc1ccc(cc1)N2 122 6823 http://www.aAlfa Aesar
    16 1-phenyl-2-pyc1ccc(cc1)N2 66 70744 http://www.aAlfa Aesar
    17 1-phenyl-1,2- c1ccc(cc1)C(C 67 6882 http://www.aAlfa Aesar
    18 1-pentyne CCCC#C -106 11806 http://www.aAlfa Aesar
    19 1-pentadecanCCCCCCCCCCC 46 11891 http://www.aAlfa Aesar
    20 1-octylamine CCCCCCCCN -1 7851 http://www.aAlfa Aesar
    21 1-octene CCCCCCC=C -102 7833 http://www.aAlfa Aesar
    22 1-octanethiol CCCCCCCCS -49 7852 http://www.aAlfa Aesar
    23 1-octanesulfonCCCCCCCCS(=O 14 74237 http://www.aAlfa Aesar
    24 1-nonylamineCCCCCCCCCN -1 15387 http://www.aAlfa Aesar
    25 1-nitropropanCCC[N+](=O)[O -108 7615 http://www.aAlfa Aesar
    26 1-nitro-4-n-p CCCc1ccc(cc1) -14 74507 http://www.aAlfa Aesar
    27 1-nitro-4-(tr c1cc(ccc1[N+] 15 455696 http://www.aAlfa Aesar
    28 1-n-hexyl-4-[( CCCCCCc1ccc( 42 13903845 http://www. Alfa Aesar
    29 1-n-butyl-4-[ CCCCc1ccc(cc 41 13672731 http://www. Alfa Aesar
    30 1-naphthylacet
    c1ccc2c(c1)cc 130 6601 http://www.aAlfa Aesar
    31 1-naphthyl is c1ccc2c(c1)c 4 59958 http://www.aAlfa Aesar
    32 1-naphthol c1ccc2c(c1)cc 96 6739 http://www.aAlfa Aesar
    33 1-naphthoic hc1ccc2c(c1)c 167 65539 http://www.aAlfa Aesar
    34 1-naphthalde c1ccc2c(c1)cc 2 5960 http://www.aAlfa Aesar
    35 1-methylsulfoCS(=O)(=O)c1c 137 226776 http://www.aAlfa Aesar
    36 1-methylpyrrolCn1cccc1C(=O 137 73496 http://www.aAlfa Aesar
    37 1-methylpiperCN1CCCCC1 -50 11788 http://www.aAlfa Aesar
    38 1-methylisati CN1c2ccccc2C 131 15517 http://www.aAlfa Aesar
    39 1-methylisoquCc1c2ccccc2c 10 14833 http://www. Alfa Aesar
    40 2-(2,4-dichlo CC(C(=O)O)Oc1 114 8120 http://www.aAlfa Aesar
    41 2-(2,4,5-trich CC(C(=O)O)Oc1 178 6891 http://www.aAlfa Aesar
    42 2-(2,2,2-trim B(c1ccccc1NC( 270 3404039 http://www. Alfa Aesar
    43 2-(1-pyrrolyl) c1ccc(c(c1)C( 104 636237 http://www.aAlfa Aesar
    44 2-(1-pyrrolidi c1ccc(c(c1)N 111 2016589 http://www.aAlfa Aesar
    45 2-(1-piperidinc1c(sc(n1)N2 49 1221177 http://www. Alfa Aesar
    46 2-(1-piperidinc1ccc(c(c1)N 75 2512035 http://www.aAlfa Aesar
    47 2-(1-piperidinc1ccc(c(c1)C 43 2054756 http://www.aAlfa Aesar
    48 2-(1-piperazinc1ccc(c(c1)N 115 381133 http://www. Alfa Aesar
    49 2-(1-naphthyl c1ccc2c(c1)c 62 12505 http://www. Alfa Aesar
    50 2-(1,3-benzodic1cc2c(cc1C 122 2052209 http://www. Alfa Aesar
    51 1-undecyne CCCCCCCCCC# -25 67793 http://www.aAlfa Aesar
    52 1-undecene CCCCCCCCCC= -49 12635 http://www. Alfa Aesar
    53 1-undecanol CCCCCCCCCC 14 7892 http://www.aAlfa Aesar
    54 1-tritylimidaz c1ccc(cc1)C(c 222 537282 http://www.aAlfa Aesar
    55 1-trifluorometC1CC1(C(=O)O) 88 2058564 http://www.aAlfa Aesar
    56 1-tridecene CCCCCCCCCCC -23 16180 http://www.aAlfa Aesar
    57 1-thio-beta-D-CC(=O)OC[C@ 116 79653 http://www.aAlfa Aesar
    58 1-tetradeceneCCCCCCCCCCC -12 13622 http://www.aAlfa Aesar
    59 1-tetradecanoCCCCCCCCCC 39 7917 http://www.aAlfa Aesar
    60 1-tetradecaneCCCCCCCCCCC 7 58226 http://www.aAlfa Aesar
    61 1-tert-butyl-2 CC(C)(C)N1C 137 2074113 http://www.aAlfa Aesar
    62 1-pyrenebutyrc1cc2ccc3ccc( 185 69424 http://www.aAlfa Aesar
    63 1-propylamin CCCN -83 7564 http://www.aAlfa Aesar
    64 1-propanethioCCCS -113 7560 http://www.aAlfa Aesar
    65 1-piperonylpi c1cc2c(cc1C 43 85214 http://www.aAlfa Aesar
    66 1-phenylsemicc1ccc(cc1)NN 172 54963 http://www.aAlfa Aesar
    67 1-phenylpyrroc1ccc(cc1)n2c 59 11970 http://www.aAlfa Aesar
    68 1-phenylpiperc1ccc(cc1)N2 18 6829 http://www.aAlfa Aesar
    69 1-phenylisatinc1ccc(cc1)N2 141 12351 http://www.aAlfa Aesar
    70 1-phenylimidac1ccc(cc1)n2c 13 73625 http://www.aAlfa Aesar
    71 1-phenylcycloc1ccc(cc1)C2 160 59554 http://www.aAlfa Aesar
    72 1-phenylcycl c1ccc(cc1)C2 -11 12501 http://www.aAlfa Aesar
    73 1-phenyl-3-tr c1ccc(cc1)N2C 193 581557 http://www.aAlfa Aesar
    74 1-phenyl-2-prC#CC(c1ccccc 28 18989 http://www.aAlfa Aesar
    75 1-phenyl-1,2, CC(=O)C(=NO) 129 5208254 http://www.aAlfa Aesar
    76 1-pentylamin CCCCCN -55 7769 http://www.aAlfa Aesar
    77 1-pentenylborB(C=CCCC)(O) 80 2016355 http://www.aAlfa Aesar
    78 1-pentene CCCC=C -138 7713 http://www.aAlfa Aesar x clearly out of range JCB
    79 1-pentanol CCCCCO -79 6040 http://www.aAlfa Aesar
    80 1-pentanethioCCCCCS -76 7776 http://www.aAlfa Aesar
    81 1-pentadecynCCCCCCCCCCC 10 63022 http://www.aAlfa Aesar
    82 1-pentadecenCCCCCCCCCCC -4 24142 http://www. Alfa Aesar
    83 1-octyne CCCCCCC#C -60 11864 http://www.aAlfa Aesar
    84 1-octen-3-ol CCCCCC(C=C) -49 17778 http://www.aAlfa Aesar
    85 1-octanol CCCCCCCCO -16 932 http://www.aAlfa Aesar
    86 1-octadecene CCCCCCCCCCC 16 7925 http://www.aAlfa Aesar
    87 1-octadecanolCCCCCCCCCCC 58 7928 http://www.aAlfa Aesar
    88 1-octadecanetCCCCCCCCCCC 32 16913 http://www.aAlfa Aesar
    89 1-octadecanesCCCCCCCCCCC 58 59660 http://www.aAlfa Aesar
    90 1-o-acetyl-2,3CC(=O)O[C@@H 129 9148396 http://www.aAlfa Aesar
    91 1-nonyne CCCCCCCC#C -50 17880 http://www.aAlfa Aesar
    92 1-nonanol CCCCCCCCCO -7 8574 http://www.aAlfa Aesar
    93 1-nitronaphthc1ccc2c(c1)cc 57 6588 http://www.aAlfa Aesar
    94 1-n-hexylthe CCCCCCn1c(=O 81 63738 http://www.aAlfa Aesar
    95 1-n-butyl-4-[ CCCCc1ccc(cc 40 533364 http://www. Alfa Aesar
    96 1-n-butyl-4-[ CCCCc1ccc(cc 54 530485 http://www. Alfa Aesar
    97 1-naphthylacet
    c1ccc2c(c1)c 34 8277 http://www.aAlfa Aesar
    98 1-naphthylac c1ccc2c(c1)cc 177 6600 http://www.aAlfa Aesar
    99 1-naphthyl is c1ccc2c(c1)c 56 10609 http://www.aAlfa Aesar
    100 1-naphthyl ac CC(=O)Oc1ccc 45 12691 http://www.aAlfa Aesar
    101 1-naphthoyl cc1ccc2c(c1)cc 18 63334 http://www.aAlfa Aesar
    102 1-naphthoic ac1ccc2c(c1)cc 161 6586 http://www.aAlfa Aesar
    103 1-naphthalen c1ccc2c(c1)cc 61 19669 http://www.aAlfa Aesar
    104 1-naphthaleneB(c1cccc2c1cc 207 223106 http://www.aAlfa Aesar
    105 1-naphthalenec1ccc2c(c1)c 168 221937 http://www.aAlfa Aesar
    106 1-methylthio-CN/C(=C[N+](= 113 2299656 http://www.aAlfa Aesar
    107 1-methylsulfoCS(=O)(=O)n1 110 692712 http://www. Alfa Aesar
    108 1-methylpyrroCN1CCCC1 -90 8143 http://www.aAlfa Aesar
    109 1-methylpyrroCn1cccc1 -57 7031 http://www.aAlfa Aesar
    110 1-methylpiperCN1CCNCC1 -6 48024 http://www.aAlfa Aesar
    111 1-methylnaphCc1cccc2c1cc -22 6736 http://www.aAlfa Aesar
    112 1-methylindolCn1cc(c2c1cc 69 79297 http://www.aAlfa Aesar
    113 1-methylimidaCn1cncc1C=O 55 498713 http://www. Alfa Aesar
    114 1-methylimidaCn1cc(nc1)C( 242 471564 http://www. Alfa Aesar
    115 1-methylimidaz
    Cn1cnc(c1C#N 85 506965 http://www.aAlfa Aesar
    116 1-methylimidaCn1ccnc1 -6 1348 http://www.aAlfa Aesar
    117 1-methylhydaCN1CC(=O)NC 158 62430 http://www.aAlfa Aesar
    118 1-methylfluorCc1cccc-2c1C 85 14844 http://www.aAlfa Aesar
    119 1-methylcycl CC1=CCCC1 -142 12222 http://www.aAlfa Aesar
    120 1-methylcycloCC1(CCCC1)O 37 66464 http://www.aAlfa Aesar
    121 1-methylcycloCC1(CCCCC1) 26 11063 http://www.aAlfa Aesar
    122 1-methylcycloCC1(CCCCC1)C 38 63909 http://www.aAlfa Aesar
    123 1-methylbenziCn1c2ccccc2n 120 666291 http://www.aAlfa Aesar
    124 1-methylbenzCn1cnc2c1ccc 61 86565 http://www.aAlfa Aesar
    125 1-methyl-6-niCn1c2cc(ccc2c 126 73345 http://www. Alfa Aesar
    126 1-methyl-5-niCn1c2ccc(cc2c 160 246757 http://www.aAlfa Aesar
    127 1-methyl-4-(4-CN1CCN(CC1) 55 695913 http://www. Alfa Aesar
    128 1-methyl-3-tr CN1C(=O)CC(= 179 452422 http://www.aAlfa Aesar
    129 1-methyl-3-phCN1CCNC(C1)c 58 2040757 http://www. Alfa Aesar
    130 1-methyl-3-n-CCCC1=NN(C( 115 454040 http://www.aAlfa Aesar
    131 1-methyl-2-quCn1c2ccccc2c 75 11327 http://www.aAlfa Aesar
    132 1-methyl-2-pyCN1CCCC1=O -24 12814 http://www.aAlfa Aesar
    133 1-methyl-2-pyCn1ccccc1=O 31 12231 http://www.aAlfa Aesar
    134 1-methyl-2-phCn1c2ccccc2c 99 69541 http://www.aAlfa Aesar
    135 1-methyl-1h-pCn1c(ccn1)C( 224 558328 http://www. Alfa Aesar
    136 1-methyl-1h-pCn1ccc(n1)C( 154 498339 http://www. Alfa Aesar
    137 1-methyl-1h-bCn1c2ccccc2n 65 24133 http://www.aAlfa Aesar
    138 1-methoxynapCOc1cccc2c1c 5 15805 http://www.aAlfa Aesar
    139 1-methoxy-2- CC(COC)O -100 7612 http://www.aAlfa Aesar
    140 1-iodopropan CCCI -101 31029 http://www.aAlfa Aesar
    141 1-iodopentan CCCCCI -86 11830 http://www.aAlfa Aesar
    142 1-iodooctane CCCCCCCCI -46 11874 http://www.aAlfa Aesar
    143 1-iodonaphth c1ccc2c(c1)cc 4 6738 http://www.aAlfa Aesar
    144 1-iodohexaneCCCCCCI -75 12010 http://www.aAlfa Aesar
    145 1-iodohexadeCCCCCCCCCCC 22 10541 http://www.aAlfa Aesar
    146 1-iodoheptan CCCCCCCI -48 19100 http://www.aAlfa Aesar
    147 1-iodododecaCCCCCCCCCCC -3 19108 http://www.aAlfa Aesar
    148 1-iododecaneCCCCCCCCCCI -16 15480 http://www.aAlfa Aesar
    149 1-iodobutane CCCCI -103 10497 http://www.aAlfa Aesar
    150 1-iodo-4-nitr c1cc(ccc1[N+]( 175 11982 http://www.aAlfa Aesar
    151 1-iodo-3-nitr c1cc(cc(c1)I)[ 37 21106127 http://www.aAlfa Aesar
    152 1-iodo-3,5-di c1c(cc(cc1[N+] 101 205244 http://www. Alfa Aesar
    153 1-iodo-2-nitr c1ccc(c(c1)[N+ 50 62332 http://www.aAlfa Aesar
    154 1-iodo-2-met CC(C)CI -93 10116 http://www.aAlfa Aesar
    155 1-iodo-2,4-di c1cc(c(cc1[N+] 89 62930 http://www.aAlfa Aesar
    156 1-iodo-2,3,4, Cc1cc(c(c(c1C) 31 2057238 http://www.aAlfa Aesar
    157 1-indanone c1ccc2c(c1)C 40 6479 http://www.aAlfa Aesar
    158 1-indanol c1ccc2c(c1)C 52 21394 http://www.aAlfa Aesar
    159 1-hydroxymeth
    CC1(C(=O)NC( 105 60357 http://www.aAlfa Aesar
    160 1-hydroxyisoqc1ccc2c(c1)cc 214 9864 http://www. Alfa Aesar
    161 1-hydroxycyclc1ccc(cc1)C( 48 63536 http://www.aAlfa Aesar
    162 1h-pyrazole-4-c1c(cn[nH]1) 282 2283974 http://www. Alfa Aesar
    163 1h-pyrazole c1c[nH]nc1 68 1019 http://www.aAlfa Aesar
    164 1h-indene c1ccc2c(c1)C -2 6949 http://www.aAlfa Aesar
    165 1h-indazole c1ccc2c(c1)cn 148 8866 http://www.aAlfa Aesar
    166 1-hexyne CCCCC#C -132 12209 http://www.aAlfa Aesar
    167 1-hexylamine CCCCCCN -19 7811 http://www.aAlfa Aesar
    168 1-hexene CCCCC=C -140 11109 http://www.aAlfa Aesar
    169 1-hexanol CCCCCCO -52 7812 http://www.aAlfa Aesar
    170 1-hexanethiolCCCCCCS -81 7815 http://www.aAlfa Aesar
    171 1-hexadecyneCCCCCCCCCCC 15 11890 http://www.aAlfa Aesar
    172 1-hexadeceneCCCCCCCCCCC 4 11889 http://www.aAlfa Aesar
    173 1-hexadecanoCCCCCCCCCCC 49 2581 http://www.aAlfa Aesar
    174 1-hexadecanetCCCCCCCCCCC 21 17019 http://www.aAlfa Aesar
    175 1-hexadecanesCCCCCCCCCCCC 57 87515 http://www.aAlfa Aesar
    176 1-heptyne CCCCCC#C -81 11845 http://www.aAlfa Aesar
    177 1-heptylamin CCCCCCCN -23 7835 http://www.aAlfa Aesar
    178 1-heptene CCCCCC=C -119 11121 http://www.aAlfa Aesar
    179 1-heptanol CCCCCCCO -34 7837 http://www.aAlfa Aesar
    180 1-heptanethioCCCCCCCS -43 14680 http://www.aAlfa Aesar
    181 1-heptadecanCCCCCCCCCCC 54 14348 http://www.aAlfa Aesar
    182 1h-benzotriazc1ccc2c(c1)[n 98 6950 http://www.aAlfa Aesar
    183 1h-1,2,4-triaz c1ncn(n1)CC( 203 1414891 http://www. Alfa Aesar
    184 1h-1,2,3-triaz c1cnn[nH]1 24 60839 http://www.aAlfa Aesar
    185 1-formylpiperC1CCN(CC1)C -31 16486 http://www.aAlfa Aesar
    186 1-fluoro-4-ni c1cc(ccc1[N+] 23 13856885 http://www.aAlfa Aesar
    187 1-fluoronaphtc1ccc2c(c1)cc -10 9078 http://www.aAlfa Aesar
    188 1-fluoro-4-io c1cc(ccc1F)I -20 21108548 http://www.aAlfa Aesar
    189 1-fluoro-3-ni c1cc(cc(c1)F)[ 2 21168762 http://www.aAlfa Aesar
    190 1-fluoro-3-io c1cc(cc(c1)I)F -42 63890 http://www.aAlfa Aesar
    191 1-fluoro-3-io c1c(cc(cc1F)I) 78 227395 http://www. Alfa Aesar
    192 1-fluoro-3,5- Cc1cc(c(c(c1)F 56 10622393 http://www. Alfa Aesar
    193 1-fluoro-2-ni c1ccc(c(c1)[N+ -8 66528 http://www.aAlfa Aesar
    194 1-fluoro-2-io c1ccc(c(c1)F)I -42 21168731 http://www.aAlfa Aesar
    195 1-fluoro-2,4- c1cc(c(cc1[N+ 27 21106037 http://www.aAlfa Aesar
    196 1-ethynylpyreC#Cc1ccc2ccc 114 136472 http://www.aAlfa Aesar
    197 1-ethynylcycl C#CC1(CCCC1 25 78543 http://www.aAlfa Aesar
    198 1-ethynylcycl C#CC1(CCCCC 32 6277 http://www.aAlfa Aesar
    199 1-ethylpiperidCCN1CCCCC1 -20 12466 http://www.aAlfa Aesar
    200 1-ethylpipera CCN1CCNC(=O 110 97850 http://www.aAlfa Aesar
    201 1-ethyl-4-[(4 CCCc1ccc(cc1) 50 532944 http://www. Alfa Aesar
    202 1-ethyl-4-[(p- CCc1ccc(cc1)C 73 9588255 http://www. Alfa Aesar
    203 1-ethyl-4-iod CCc1ccc(cc1)I -17 21170937 http://www.aAlfa Aesar
    204 1-ethyl-4-[(4 CCCCCCc1ccc( 10 14282860 http://www. Alfa Aesar
    205 1-ethyl-4-[(4 CCc1ccc(cc1)C 35 3173032 http://www. Alfa Aesar
    206 1-ethyl-3-meth
    CCn1c(cc(n1) 139 2025303 http://www.aAlfa Aesar
    207 1-ethyl-2-phe CCn1c2ccccc2 86 75113 http://www.aAlfa Aesar
    208 1-ethoxy-2-prCCOCC(C)O -100 14552 http://www.aAlfa Aesar
    209 1-eicosanol CCCCCCCCCCC 64 11898 http://www.aAlfa Aesar
    210 1-dodecyne CCCCCCCCCCC -19 63019 http://www.aAlfa Aesar
    211 1-dodecene CCCCCCCCCCC -37 7891 http://www.aAlfa Aesar
    212 1-dodecanol CCCCCCCCCC 26 7901 http://www.aAlfa Aesar
    213 1-dodecanethiCCCCCCCCCCC -7 7903 http://www.aAlfa Aesar
    214 1-dodecanesulCCCCCCCCCCCC 41 59659 http://www.aAlfa Aesar
    215 1-dimethylamCC(CN(C)C)O -85 34412 http://www.aAlfa Aesar
    216 1-difluorometc1cc(ccc1[N+] 34 2018665 http://www.aAlfa Aesar
    217 1-dimethylamiCN(C)/C=C/[N+ 103 553501 http://www.aAlfa Aesar
    218 1-decyne CCCCCCCCC#C -44 12456 http://www.aAlfa Aesar
    219 1-decene CCCCCCCCC=C -66 12809 http://www.aAlfa Aesar
    220 1-decanol CCCCCCCCCC 6 7882 http://www.aAlfa Aesar
    221 1-decanethiolCCCCCCCCCCS -26 8577 http://www.aAlfa Aesar
    222 1-cyclopentyl CC(C)(C)C(C1 49 474624 http://www.aAlfa Aesar
    223 1-decanesulfoCCCCCCCCCCS( 32 98114 http://www.aAlfa Aesar
    224 1-cyclopentenC1CC=C(C1)C( 119 86635 http://www.aAlfa Aesar
    225 1-cyclohexyl-2C1CCC(CC1)N 13 73333 http://www.aAlfa Aesar
    226 1-cyclohexeneC1CCC(=CC1)C 32 62677 http://www.aAlfa Aesar
    227 1-cyclohexene-
    C1CCC(=CC1)C 33 78202 http://www.aAlfa Aesar
    228 1-cyanomethylC1CCN(CC1)C 25 17157 http://www.aAlfa Aesar
    229 1-cyanoacetylCc1cc(n(n1)C 120 230143 http://www.aAlfa Aesar
    230 1-cyano-1-cycC1CC1(C#N)C( 146 2015062 http://www. Alfa Aesar
    231 1-chlorophthac1ccc2c(c1)cn 111 141280 http://www. Alfa Aesar
    232 1-chlorophthac1ccc2c(c1)c( 272 2055513 http://www. Alfa Aesar
    233 1-chloropentaCCCCCCl -99 10512 http://www.aAlfa Aesar
    234 1-chlorooctanCCCCCCCCCl -58 7850 http://www.aAlfa Aesar
    235 1-chloronaphtc1ccc2c(c1)cc -8 6737 http://www.aAlfa Aesar
    236 1-chloroisoquc1ccc2c(c1)cc 34 123953 http://www.aAlfa Aesar
    237 1-chlorohexa CCCCCCCl -94 10526 http://www.aAlfa Aesar
    238 1-chlorohexa CCCCCCCCCCC 9 19747 http://www.aAlfa Aesar
    239 1-chloroethyl CC(OC(=O)Cl)C -65 454726 http://www.aAlfa Aesar
    240 1-chlorobutanCCCCCl -123 7714 http://www.aAlfa Aesar
    241 1-chloroanthrc1ccc2c(c1)C( 160 6453 http://www.aAlfa Aesar
    242 1-chloroadamC1C2CC3CC1CC 165 57728 http://www.aAlfa Aesar
    243 1-chloroacetyC1CN(NC1=O)C 146 2006819 http://www. Alfa Aesar
    244 1-chloro-4-ni c1cc(ccc1[N+] 84 21106020 http://www.aAlfa Aesar
    245 1-chloro-4-io c1cc(ccc1Cl)I 55 13868660 http://www.aAlfa Aesar
    246 1-chloro-4-fl c1cc(ccc1F)Cl -22 9228 http://www.aAlfa Aesar
    247 1-chloro-4-fl c1cc(c(cc1F)[N 38 21170961 http://www.aAlfa Aesar
    248 1-chloro-3-meCC(C)CCCl -104 7605 http://www.aAlfa Aesar
    249 1-chloro-3-ni c1cc(cc(c1)Cl) 45 21106013 http://www.aAlfa Aesar
    250 1-chloro-3,5- COc1cc(cc(c1) 34 73537 http://www.aAlfa Aesar
    251 1-chloro-3,5 c1c(cc(cc1Br)B 93 76386 http://www.aAlfa Aesar
    252 1-chloro-3,4- c1cc(c(cc1Cl)[ 23 30597 http://www.aAlfa Aesar
    253 1-chloro-2-ni c1ccc(c(c1)[N+ 33 13853953 http://www.aAlfa Aesar
    254 1-chloro-2-meCC(C)CCl -131 10114 http://www.aAlfa Aesar
    255 1-chloro-2-io c1ccc(c(c1)Cl)I 1 21171406 http://www.aAlfa Aesar
    256 1-chloro-2-fl c1ccc(c(c1)F)C -43 21111912 http://www.aAlfa Aesar
    257 1-chloro-2,4- c1cc(c(cc1[N+] 50 13868426 http://www.aAlfa Aesar
    258 1-chloro-2,4- c1cc(c(cc1F)F) -26 120718 http://www.aAlfa Aesar
    259 1-chloro-2,4- c1cc(c(c(c1F)[ 47 15347984 http://www. Alfa Aesar
    260 1-chloro-2,4- c1cc(c(cc1C(F) -59 2053633 http://www.aAlfa Aesar
    261 1-butanol CCCCO -90 258 http://www.aAlfa Aesar
    262 1-butanethiol CCCCS -116 7721 http://www.aAlfa Aesar
    263 1-bromoundeCCCCCCCCCCC -9 12221 http://www.aAlfa Aesar
    264 1-butanesulfon
    CCCCS(=O)(=O -29 67962 http://www.aAlfa Aesar
    265 1-bromotetra CCCCCCCCCCC 5 7916 http://www.aAlfa Aesar
    266 1-bromopyrenc1cc2ccc3ccc( 95 140350 http://www.aAlfa Aesar
    267 1-bromoperfl C(C(C(C(C(F)(F) 6 9489 http://www.aAlfa Aesar
    268 1-bromoprop CCCBr -110 7552 http://www.aAlfa Aesar
    269 1-bromopent CCCCCBr -95 7766 http://www.aAlfa Aesar
    270 1-bromopentaCCCCCCCCCCC 19 11888 http://www.aAlfa Aesar
    271 1-bromooctanCCCCCCCCBr -55 7848 http://www.aAlfa Aesar
    272 1-bromooctadCCCCCCCCCCC 28 7926 http://www.aAlfa Aesar
    273 1-bromonaphtc1ccc2c(c1)cc -1 6735 http://www.aAlfa Aesar
    274 1-bromohexa CCCCCCBr -85 7810 http://www.aAlfa Aesar
    275 1-bromohept CCCCCCCBr -58 11863 http://www.aAlfa Aesar
    276 1-bromohexa CCCCCCCCCCC 17 7921 http://www.aAlfa Aesar
    277 1-bromododeCCCCCCCCCCC -10 8579 http://www.aAlfa Aesar
    278 1-bromodeca CCCCCCCCCCB -30 7881 http://www.aAlfa Aesar
    279 1-bromobuta CCCCBr -112 7711 http://www.aAlfa Aesar
    280 1-bromoadamC1C2CC3CC1CC 119 71437 http://www.aAlfa Aesar
    281 1-bromo-4-terCC(C)(C)c1ccc 16 21171393 http://www.aAlfa Aesar
    282 1-bromo-4-ni c1cc(ccc1[N+] 126 21171513 http://www.aAlfa Aesar
    283 1-bromo-4-is CC(C)c1ccc(cc -12 21171514 http://www.aAlfa Aesar
    284 1-bromo-4-io c1cc(ccc1Br)I 91 11038 http://www.aAlfa Aesar
    285 1-bromo-4-fl c1ccc2c(c1)c( 35 60966 http://www.aAlfa Aesar
    286 1-bromo-4-fl c1cc(ccc1F)Br -16 13875180 http://www.aAlfa Aesar
    287 1-bromo-4-fluc1cc(c(cc1F)[N 38 2053801 http://www.aAlfa Aesar
    288 1-bromo-4-chc1cc(ccc1Cl)Br 65 7518 http://www.aAlfa Aesar
    289 1-bromo-4-chlc1cc(c(cc1Cl)[ 70 2073795 http://www.aAlfa Aesar
    290 1-bromo-3-phc1ccc(cc1)OC 10 61797 http://www.aAlfa Aesar
    291 1-bromo-3-meCC(C)CCBr -112 7603 http://www.aAlfa Aesar
    292 1-bromo-3-io c1cc(cc(c1)I)B -9 11073 http://www.aAlfa Aesar
    293 1-bromo-3-fl c1cc(cc(c1)Br) -8 13875307 http://www.aAlfa Aesar
    294 1-bromo-3-chC(CCl)CBr -59 7715 http://www.aAlfa Aesar
    295 1-bromo-3-chc1cc(cc(c1)Br) -22 13875377 http://www.aAlfa Aesar
    296 1-bromo-3,5-dCC(C)(C)c1cc(c 64 538911 http://www.aAlfa Aesar
    297 1-bromo-3,5-dc1c(cc(cc1F)Br -27 120087 http://www.aAlfa Aesar
    298 1-bromo-3,5- c1c(cc(cc1Cl)B 75 27660 http://www.aAlfa Aesar
    299 1-bromo-3,5-bc1c(cc(cc1C(F) -16 60922 http://www.aAlfa Aesar
    300 1-bromo-3,3- c1ccc(cc1)C(C 41 79689 http://www.aAlfa Aesar
    301 1-bromo-2-ni c1ccc(c(c1)[N+ 42 10864 http://www.aAlfa Aesar
    302 1-bromo-2-nac1ccc2c(c1)cc 79 10840 http://www.aAlfa Aesar
    303 1-bromo-2-meCC(C)CBr -118 6307 http://www.aAlfa Aesar
    304 1-bromo-2-meCOc1ccc2cccc 80 65692 http://www.aAlfa Aesar
    305 1-bromo-2-io c1ccc(c(c1)Br) 10 10935 http://www.aAlfa Aesar
    306 1-bromo-2-heCCCCCCCCCCC 56 15540029 http://www. Alfa Aesar
    307 1-bromo-2-fl c1ccc(c(c1)F)B -8 13875433 http://www.aAlfa Aesar
    308 1-bromo-2-fluc1cc(c(cc1I)F) 36 2007118 http://www.aAlfa Aesar
    309 1-bromo-2-et CCc1ccccc1Br -68 21111882 http://www.aAlfa Aesar
    310 1-bromo-2-chC(CBr)Cl -18 13854130 http://www.aAlfa Aesar
    311 1-bromo-2-chc1ccc(c(c1)Cl) -13 12230 http://www.aAlfa Aesar
    312 1-bromo-2-chlc1cc(c(cc1[N+] 61 31905 http://www.aAlfa Aesar
    313 1-bromo-2,5-dc1c(c(cc(c1F)B 56 2017958 http://www.aAlfa Aesar
    314 1-bromo-2,4-dc1cc(c(cc1[N+ 72 10957 http://www.aAlfa Aesar
    315 1-bromo-2,4- COc1ccc(c(c1) 25 78722 http://www.aAlfa Aesar
    316 1-bromo-2,4-dc1cc(c(cc1F)F) -4 60993 http://www.aAlfa Aesar
    317 1-bromo-2,4- c1cc(c(cc1Cl)C 27 21170125 http://www.aAlfa Aesar
    318 1-bromo-2,4,5c1c(c(cc(c1F)B -19 60918 http://www.aAlfa Aesar
    319 1-bromo-2,3- c1cc(c(c(c1)Br 58 38364 http://www.aAlfa Aesar
    320 1-bromo-2,3,5c1c(cc(c(c1Cl) 59 3584810 http://www.aAlfa Aesar
    321 1-bromo-2,3,5Cc1cc(c(c(c1C 60 66847 http://www.aAlfa Aesar
    322 1-boc-pyrrole CC(C)(C)OC(= 51 4234332 http://www. Alfa Aesar
    323 1-boc-piperazCC(C)(C)OC(= 46 126561 http://www.aAlfa Aesar
    324 1-boc-nipecotiCCOC(=O)C1CC 33 317563 http://www. Alfa Aesar
    325 1-boc-isonipecCC(C)(C)OC(= 150 348191 http://www.aAlfa Aesar
    326 1-boc-indolin CC(C)(C)OC(= 47 2897139 http://www.aAlfa Aesar
    327 1-boc-imidazoCC(C)(C)OC(= 46 454689 http://www.aAlfa Aesar
    328 1-boc-azetidinCC(C)(C)OC(= 102 2036748 http://www. Alfa Aesar
    329 1-boc-6-aminoCC(C)(C)OC(= 172 13355035 http://www. Alfa Aesar
    330 1-boc-4-piperCC(C)(C)OC(= 74 643046 http://www.aAlfa Aesar
    331 1-boc-4-piperCC(C)(C)OC(= 80 2044759 http://www. Alfa Aesar
    332 1-boc-4-hydroCC(C)(C)OC(= 63 558645 http://www.aAlfa Aesar
    333 1-boc-4-cyanoCC(C)(C)OC(= 47 1246152 http://www. Alfa Aesar
    334 1-boc-3-pyrroCC(C)(C)OC(= 36 413992 http://www. Alfa Aesar
    335 1-boc-3-piperCC(C)(C)OC(= 38 2037585 http://www.aAlfa Aesar
    336 1-boc-3-oxopiCC(C)(C)OC(= 158 2409139 http://www. Alfa Aesar
    337 1-boc-3-hydroCC(C)(C)OC(= 68 474981 http://www.aAlfa Aesar
    338 1-boc-3-hydroCC(C)(C)OC(= 40 2037561 http://www. Alfa Aesar
    339 1-boc-3-cyanoCC(C)(C)OC(= 70 8806645 http://www. Alfa Aesar
    340 1-boc-3-azeti CC(C)(C)OC(= 51 1249417 http://www. Alfa Aesar
    341 1-boc-2-piperCC(C)(C)OC(= 36 5894604 http://www.aAlfa Aesar
    342 1-boc-2-(hydroCC(C)(C)OC(=O 55 21169767 http://www. Alfa Aesar
    343 1-benzyloxycac1ccc(cc1)CO 40 558639 http://www.aAlfa Aesar
    344 1-benzyloxy- c1ccc(cc1)COc 62 122437 http://www.aAlfa Aesar
    345 1-benzyloxy-4c1ccc(cc1)COc 62 453293 http://www.aAlfa Aesar
    346 1-benzyloxy-3c1ccc(cc1)COc 51 3437035 http://www.aAlfa Aesar
    347 1-benzylimidac1ccc(cc1)Cn2 71 70309 http://www.aAlfa Aesar
    348 1-benzyl-5-phec1ccc(cc1)CN 164 145617 http://www.aAlfa Aesar
    349 1-benzyl-4-hyc1ccc(cc1)CN 62 70826 http://www.aAlfa Aesar
    350 1-benzyl-4-cy c1ccc(cc1)CN 97 72434 http://www.aAlfa Aesar
    351 1-benzyl-4-boCC(C)(C)OC(= 72 507913 http://www.aAlfa Aesar
    352 1-benzyl-3-hyc1ccc(cc1)Cn2 165 67727 http://www.aAlfa Aesar
    353 1-benzyl-1,4, c1ccc(cc1)C 85 8259620 http://www. Alfa Aesar
    354 1-benzyl-1,2,3c1ccc(cc1)Cn2 180 377795 http://www.aAlfa Aesar
    355 1-benzoylpipec1ccc(cc1)C( 49 63087 http://www.aAlfa Aesar
    356 1-benzoylnap c1ccc(cc1)C(= 76 62709 http://www.aAlfa Aesar
    357 1-benzoyl-4-pc1ccc(cc1)C( 55 81785 http://www.aAlfa Aesar
    358 1-benzhydrylpc1ccc(cc1)C( 92 63238 http://www.aAlfa Aesar
    359 1-aza-18-crowC1COCCOCCO 48 105979 http://www. Alfa Aesar
    360 1-aminopyrenc1cc2ccc3ccc( 118 14613 http://www.aAlfa Aesar
    361 1-aminoindanc1ccc2c(c1)C 2 110041 http://www.aAlfa Aesar
    362 1-aminoanthrc1ccc2c(c1)C( 254 6454 http://www.aAlfa Aesar
    363 1-amino-5-chlc1cc2c(c(c1)N 207 8024 http://www.aAlfa Aesar
    364 1-amino-4-hy c1ccc2c(c1)C( 208 8020 http://www.aAlfa Aesar
    365 1-amino-2,4- c1ccc2c(c1)C( 227 6429 http://www.aAlfa Aesar
    366 1-adamantaneC1C2CC3CC1CC 117 58119 http://www.aAlfa Aesar
    367 1-adamantaneC1C2CC3CC1CC 74 99459 http://www.aAlfa Aesar
    368 1-adamantanea
    C1C2CC3CC1CC 137 109836 http://www.aAlfa Aesar
    369 1-acetylpyrenCC(=O)c1ccc2 88 86885 http://www.aAlfa Aesar
    370 1-acetylpiperiCC(=O)N1CCC( 182 104781 http://www.aAlfa Aesar
    371 1-acetylpiperiCC(=O)N1CCC( 132 91205 http://www.aAlfa Aesar
    372 1-acetylpiperaCC(=O)N1CCN 32 75616 http://www.aAlfa Aesar
    373 1-acetylnaphtCC(=O)c1cccc 10 13074 http://www.aAlfa Aesar
    374 1-acetylisatin CC(=O)N1c2cc 142 10845 http://www.aAlfa Aesar
    375 1-acetylimida CC(=O)n1ccnc 101 16257 http://www.aAlfa Aesar
    376 1-acetyl-5-nit CC(=O)N1CCc2c 177 33601 http://www.aAlfa Aesar
    377 1-acetyl-5-br CC(=O)N1CCc2 120 630102 http://www.aAlfa Aesar
    378 1-acetyl-5-br CC(=O)N1CCc2c 197 2011202 http://www.aAlfa Aesar
    379 1-acetyl-4-(4 CC(=O)N1CCN( 183 621447 http://www.aAlfa Aesar
    380 1-acetyl-3-th CC(=O)NNC(=S 167 2005796 http://www.aAlfa Aesar
    381 1-acetyl-2-na CC(=O)c1c2cc 65 61733 http://www.aAlfa Aesar
    382 1-acetamidoaCC(=O)NC12CC 148 57727 http://www.aAlfa Aesar
    383 18-pentatriac CCCCCCCCCCC 87 10009 http://www.aAlfa Aesar
    384 18-crown-6 C1COCCOCCO 39 26563 http://www.aAlfa Aesar
    385 16-hydroxyhexC(CCCCCCCC( 99 10034 http://www.aAlfa Aesar
    386 15-hydroxypenC(CCCCCCCO) 86 70730 http://www.aAlfa Aesar
    387 14-heptacosa CCCCCCCCCCC 78 10490 http://www.aAlfa Aesar
    388 12-tricosanonCCCCCCCCCCC 67 10426 http://www.aAlfa Aesar
    389 12-hydroxystea
    CCCCCCC(CCC 75 7501 http://www.aAlfa Aesar
    390 12-aminododeC(CCCCCC(=O 186 62862 http://www.aAlfa Aesar
    391 11-heneicosanCCCCCCCCCCC 72 69364 http://www.aAlfa Aesar
    392 10-undecynoicC#CCCCCCCCC 42 28797 http://www.aAlfa Aesar
    393 10-undecenoicC=CCCCCCCCC 24 10771160 http://www.aAlfa Aesar
    394 10-undecen-1-C=CCCCCCCCC -3 7893 http://www.aAlfa Aesar
    395 10-phenyl-1-dc1ccc(cc1)CC 36 494547 http://www.aAlfa Aesar
    396 10-methylpheCN1c2ccccc2S 102 64175 http://www.aAlfa Aesar
    397 10-hydroxybenc1cc2ccc3cccn 104 10654645 http://www.aAlfa Aesar
    398 10,12-tricosadCCCCCCCCCCC 57 468916 http://www.aAlfa Aesar
    399 10,12-pentacoCCCCCCCCCCC 64 468898 http://www.aAlfa Aesar
    400 10,12-docosadC(CCCCC(=O) 111 473642 http://www.aAlfa Aesar
    401 10,11-dihydr c1ccc2c(c1)C 205 18028 http://www.aAlfa Aesar
    402 1-[3,5-bis(tri c1ccn(c1)c2cc( 42 2017857 http://www.aAlfa Aesar
    403 1-[3,5-bis(tri CC(c1cc(cc(c1) 72 4931206 http://www. Alfa Aesar
    404 1,9-nonanedioC(CCCCO)CCC 47 18685 http://www.aAlfa Aesar
    405 1,9-diphenyl- c1ccc(cc1)/C 142 4527132 http://www.aAlfa Aesar
    406 1,9-diaminon C(CCCCN)CCC 38 62738 http://www.aAlfa Aesar
    407 1,8-octanedioC(CCCCO)CCC 60 62628 http://www.aAlfa Aesar
    408 1,8-nonadiyneC#CCCCCCC#C -21 16075 http://www.aAlfa Aesar
    409 1,8-naphthali c1cc2cccc3c2 301 59862 http://www.aAlfa Aesar
    410 1,8-naphthali c1cc2cccc3c2 271 6438 http://www.aAlfa Aesar
    411 1,8-dichloroo C(CCCCCl)CCC -8 67653 http://www.aAlfa Aesar
    412 1,8-dichloroa c1cc2c(c(c1)C 202 6452 http://www.aAlfa Aesar
    413 1,8-dibromooC(CCCCBr)CCC 16 70682 http://www.aAlfa Aesar
    414 1,8-dibenzyl- c1ccc(cc1)CN 68 9351558 http://www. Alfa Aesar
    415 1,8-diazabicy C1CCC2=NCCC -70 73246 http://www.aAlfa Aesar
    416 1,8-diaminoocC(CCCCN)CCC 52 22672 http://www.aAlfa Aesar
    417 1,8-diaminon c1cc2cccc(c2c 63 61381 http://www.aAlfa Aesar
    418 1,8-cineole CC1(C2CCC(O1 1 2656 http://www.aAlfa Aesar
    419 1,8-bis(dimet CN(C)c1cccc2c 49 80012 http://www.aAlfa Aesar
    420 1,8,9-trihydr c1cc2c(c(c1)O 179 2117 http://www.aAlfa Aesar
    421 1,7-phenanthrc1cc2ccc3c(c2 79 60797 http://www.aAlfa Aesar
    422 1,7-heptanediC(CCCO)CCCO 18 11875 http://www.aAlfa Aesar
    423 1,7-dihydroxyc1cc2ccc(cc2c 182 61739 http://www. Alfa Aesar
    424 1,7-diaminoh C(CCCN)CCCN 28 62737 http://www.aAlfa Aesar
    425 1,6-hexaneditC(CCCS)CCS -21 13836 http://www.aAlfa Aesar
    426 1,6-hexanedioC(CCCO)CCO 42 13839416 http://www.aAlfa Aesar
    427 1,6-diphenoxyc1ccc(cc1)OC 82 1414972 http://www.aAlfa Aesar
    428 1,6-dimethox COc1ccc2c(c1 59 262111 http://www.aAlfa Aesar
    429 1,6-diisocyan C(CCCN=C=O) -67 12637 http://www.aAlfa Aesar
    430 1,6-dihydroxyc1cc2cc(ccc2c 138 61740 http://www.aAlfa Aesar
    431 1,6-dicyanoh C(CCCC#N)CC -3 11879 http://www.aAlfa Aesar
    432 1,6-dichloroh C(CCCCl)CCCl -13 15691 http://www.aAlfa Aesar
    433 1,6-dibromo-2c1cc2c(cc1Br) 251 67083 http://www.aAlfa Aesar
    434 1,6-dibromohC(CCCBr)CCBr -2 11862 http://www.aAlfa Aesar
    435 1,6-diaminoh C(CCCN)CCN 41 13835579 http://www.aAlfa Aesar
    436 1,6-anhydro-bC1[C@@H]2[C 182 9587432 http://www.aAlfa Aesar
    437 1,5-pentanediC(CCS)CCS -72 63421 http://www.aAlfa Aesar
    438 1,5-pentanediC(CCO)CCO -16 13839441 http://www.aAlfa Aesar
    439 1,5-pentamethC1CCc2nnnn2 60 5704 http://www.aAlfa Aesar
    440 1,5-hexadieneC=CCCC=C -141 11110 http://www.aAlfa Aesar
    441 1,5-dinitrona c1cc2c(cccc2[ 216 11310 http://www.aAlfa Aesar
    442 1,5-dimethylnCc1cccc2c1cc 80 10831 http://www.aAlfa Aesar
    443 1,5-dichlorop C(CCCl)CCCl -72 21106526 http://www.aAlfa Aesar
    444 1,5-difluoro-2c1c(c(cc(c1[N+ 74 60919 http://www.aAlfa Aesar
    445 1,5-dichloroa c1cc2c(c(c1)C 247 6455 http://www.aAlfa Aesar
    446 1,5-dichloro- c1c(c(cc(c1[N+ 101 69706 http://www.aAlfa Aesar
    447 1,5-dibromopC(CCBr)CCBr -34 7809 http://www.aAlfa Aesar
    448 1,5-diaminop C(CCN)CCN 9 13866593 http://www.aAlfa Aesar
    449 1,5-diaminon c1cc2c(cccc2N 191 15851 http://www.aAlfa Aesar
    450 1,5-bis(diphe c1ccc(cc1)P(C 47 2015213 http://www.aAlfa Aesar
    451 1,5,5-trimeth CC1(C(=O)NC( 163 73350 http://www.aAlfa Aesar
    452 1,4-piperazineC1CN(CCN1CC 65 70204 http://www. Alfa Aesar
    453 1,4-phenylenec1cc(ccc1CC# 96 62536 http://www.aAlfa Aesar
    454 1,4-phenylenec1cc(ccc1CC( 254 73776 http://www.aAlfa Aesar
    455 1,4-phenylenec1cc(ccc1N=C 131 18799 http://www.aAlfa Aesar
    456 1,4-oxazepan-C1COCCNC1= 81 5385891 http://www.aAlfa Aesar
    457 1,4-oxathiane C1CS(=O)(=O) 132 7590 http://www.aAlfa Aesar
    458 1,4-naphthoq c1ccc2c(c1)C 122 8215 http://www.aAlfa Aesar
    459 1,4-dithioerytC([C@H]([C@H 83 388475 http://www.aAlfa Aesar
    460 1,4-dithio-dl-tC([C@H]([C@@ 42 393541 http://www.aAlfa Aesar
    461 1,4-di-tert-bu CC(C)(C)c1ccc( 77 13293 http://www.aAlfa Aesar
    462 1,4-dipropion CCC(=O)Oc1cc 113 213630 http://www.aAlfa Aesar
    463 1,4-diphenylbc1ccc(cc1)C# 87 63360 http://www.aAlfa Aesar
    464 1,4-diphenyl- c1ccc(cc1)CCC 55 71732 http://www.aAlfa Aesar
    465 1,4-diphenox c1ccc(cc1)Oc2 73 454015 http://www.aAlfa Aesar
    466 1,4-dioxane-2C1C(=O)OCC( 82 58895 http://www.aAlfa Aesar
    467 1,4-dioxane-2,C1COC(C(O1) 101 86812 http://www.aAlfa Aesar
    468 1,4-dioxane C1COCCO1 12 29015 http://www.aAlfa Aesar
    469 1,4-di-o-tosyl Cc1ccc(cc1)S 90 87948 http://www. Alfa Aesar
    470 1,4-dinitrobe c1cc(ccc1[N+] 174 7211 http://www.aAlfa Aesar
    471 1,4-dimethylpCN1CCN(CC1) -1 7530 http://www.aAlfa Aesar
    472 1,4-dimethox COc1ccc(c2c1 85 74308 http://www.aAlfa Aesar
    473 1,4-dimethox COc1ccc(cc1) 56 21105878 http://www.aAlfa Aesar
    474 1,4-dimethoxyCOc1ccc(c(c1) 25 127929 http://www.aAlfa Aesar
    475 1,4-diisoprop CC(C)c1ccc(cc -17 7205 http://www.aAlfa Aesar
    476 1,4-diiodobut C(CCI)CI 6 11832 http://www.aAlfa Aesar
    477 1,4-diiodobenc1cc(ccc1I)I 130 11708 http://www.aAlfa Aesar
    478 1,4-dihydroxyc1ccc2c(c1)C( 197 6433 http://www.aAlfa Aesar
    479 1,4-diformylp C1CN(CCN1C= 128 70217 http://www.aAlfa Aesar
    480 1,4-difluoro- c1cc(c(cc1F)[N -12 61086 http://www.aAlfa Aesar
    481 1,4-difluorob c1cc(ccc1F)F -13 21108550 http://www.aAlfa Aesar
    482 1,4-difluoro- COc1cc(c(cc1F 121 2054496 http://www.aAlfa Aesar
    483 1,4-diethylbe CCc1ccc(cc1)C -43 7448 http://www.aAlfa Aesar
    484 1,4-diethoxybCCOc1ccc(cc1 70 21111774 http://www.aAlfa Aesar
    485 1,4-dicyclohe c1cc(ccc1C2C 104 63830 http://www.aAlfa Aesar
    486 1,4-dichlorob C(CCCl)CCl -38 21106032 http://www.aAlfa Aesar
    487 1,4-dichlorob c1cc(ccc1Cl)Cl 54 13866817 http://www.aAlfa Aesar
    488 1,4-dichloro- c1cc(c(cc1Cl)[ 55 21111865 http://www.aAlfa Aesar
    489 1,4-dichloro- C1CC2CCC1c3c 210 4922751 http://www.aAlfa Aesar
    490 1,4-dichloro- c1cc(c(cc1Cl)I) 21 21171496 http://www.aAlfa Aesar
    491 1,4-dichloro- c1cc(c(cc1Cl)F 4 119949 http://www.aAlfa Aesar
    492 1,4-dibromopCC(CCCBr)Br -34 71414 http://www.aAlfa Aesar
    493 1,4-dibromonc1ccc2c(c1)c( 81 59892 http://www.aAlfa Aesar
    494 1,4-dibromobC(CCBr)CBr -20 7765 http://www.aAlfa Aesar
    495 1,4-dibromobc1cc(ccc1Br)B 88 13868640 http://www.aAlfa Aesar
    496 1,4-dibromo-2c1cc(c(cc1Br)[ 84 69450 http://www.aAlfa Aesar
    497 1,4-dibromo-2c1cc(c(cc1Br)F 34 120721 http://www.aAlfa Aesar
    498 1,4-dibromo-2c1c(c(cc(c1Br) 62 60917 http://www.aAlfa Aesar
    499 1,4-dibromo- COc1cc(c(cc1B 146 201465 http://www.aAlfa Aesar
    500 1,4-dibromo-2C(C(=O)C(=O)C 118 21325 http://www.aAlfa Aesar
    501 1,4-dibenzylo c1ccc(cc1)COc 127 62525 http://www.aAlfa Aesar
    502 1,4-dibenzoyl c1ccc(cc1)C(= 163 68870 http://www.aAlfa Aesar
    503 1,4-diazabicycC1CN2CCN1C 158 8882 http://www.aAlfa Aesar
    504 1,4-diaminob C(CCN)CN 27 13837702 http://www.aAlfa Aesar
    505 1,4-diaminoa c1ccc2c(c1)C( 263 29150 http://www.aAlfa Aesar
    506 1,4-diacryloyl C=CC(=O)N1CC 93 167846 http://www.aAlfa Aesar
    507 1,4-diacetoxy CC(=O)OCCCC 13 62618 http://www.aAlfa Aesar
    508 1,4-diacetoxy CC(=O)Oc1ccc 121 64166 http://www.aAlfa Aesar
    509 1,4-diacetoxy CC(=O)OCC#C 28 66698 http://www.aAlfa Aesar
    510 1,4-cyclohexaC1CC(=O)CCC 78 11995 http://www.aAlfa Aesar
    511 1,4-cyclohexaC1C=CCC=C1 -49 11838 http://www.aAlfa Aesar
    512 1,4-butanedioC(CCO)CO 20 13835209 http://www.aAlfa Aesar
    513 1,4-bis[(trime C[Si](C)(C)C#C 120 455773 http://www.aAlfa Aesar
    514 1,4-bis(trimetC[Si](C)(C)C#C 112 121912 http://www.aAlfa Aesar
    515 1,4-bis(trifl c1cc(ccc1C(F)( -1 61262 http://www.aAlfa Aesar
    516 1,4-bis(pheny c1ccc(cc1)C#C 177 542289 http://www. Alfa Aesar
    517 1,4-bis(glycid c1cc(ccc1OC 111 56224 http://www.aAlfa Aesar
    518 1,4-bis(diphe c1ccc(cc1)P(C 134 74118 http://www.aAlfa Aesar
    519 1,4-bis(5-phe c1ccc(cc1)c2c 242 14960 http://www.aAlfa Aesar
    520 1,4-bis(4-met Cc1c(oc(n1)c2 234 68961 http://www.aAlfa Aesar
    521 1,4-bis(3-ami C1CN(CCN1CC 14 73658 http://www.aAlfa Aesar
    522 1,4-bis(2-phe c1ccc(cc1)CCc 89 19526391 http://www. Alfa Aesar
    523 1,4-bis(2-met Cc1c(cccc1)/C 182 4527500 http://www.aAlfa Aesar
    524 1,4-bis(2-hyd CC(CO)c1ccc(c 144 518080 http://www.aAlfa Aesar
    525 1,4-bis(2,2,2- c1cc(ccc1OCC( 76 644220 http://www.aAlfa Aesar
    526 1,4-bis(1-hyd C1CCC(CC1)(C 175 72128 http://www.aAlfa Aesar
    527 1,4'-bipiperid C1CCN(CC1)C 68 70964 http://www.aAlfa Aesar
    528 1,4-benzodioxc1cc2c(cc1S( 66 2056491 http://www. Alfa Aesar
    529 1,4-benzodioxc1cc2c(cc1C= 50 217240 http://www.aAlfa Aesar
    530 1,4-benzodioxc1ccc2c(c1)O 174 2059317 http://www. Alfa Aesar
    531 1,4-benzodioxc1ccc2c(c1)O 124 2017139 http://www.aAlfa Aesar
    532 1,4-benzodio c1cc2c(cc1N) 28 80444 http://www.aAlfa Aesar
    533 1,4-benzenedic1cc(ccc1S)S 97 3879447 http://www.aAlfa Aesar
    534 1,4-benzenedc1cc(ccc1CO) 119 11022 http://www.aAlfa Aesar
    535 1,4,8-tri-boc- CC(C)(C)OC(= 51 9115276 http://www. Alfa Aesar
    536 1,4,8,11-tetr CN1CCCN(CCN 35 110097 http://www.aAlfa Aesar
    537 1,4,8,11-tetr CCOC(=O)CN1 88 21242297 http://www. Alfa Aesar
    538 1,4,8,11-tetraC1CN2CCN3CC 84 299490 http://www. Alfa Aesar
    539 1,4,8,11-tetr C1CNCCNCCC 186 58489 http://www.aAlfa Aesar
    540 1,4,6,7-tetra Cc1ccc(c2c1cc 64 2283071 http://www.aAlfa Aesar
    541 1,4,5,6-tetrahC1CC(=O)NN= 197 90004 http://www.aAlfa Aesar
    542 1,4,10,13-tet C1CSCCSCCNC 130 487255 http://www.aAlfa Aesar
    543 1,3-propanesuC1COS(=O)(=O 32 13626 http://www.aAlfa Aesar
    544 1,3-propanediC(CS)CS -79 13848090 http://www.aAlfa Aesar
    545 1,3-propanediCc1ccc(cc1)S( 91 200644 http://www.aAlfa Aesar
    546 1,3-propanediC(CO)CO -26 13839553 http://www.aAlfa Aesar
    547 1,3-phenylenec1cc(cc(c1)C 34 62583 http://www.aAlfa Aesar
    548 1,3-phenylenec1cc(cc(c1)C 175 27679 http://www.aAlfa Aesar
    549 1,3-phenylenec1cc(cc(c1)N 48 29002 http://www.aAlfa Aesar
    550 1,3-dithiane C1CSCSC1 54 10019 http://www.aAlfa Aesar
    551 1,3-indanedioc1ccc2c(c1)C 130 11322 http://www.aAlfa Aesar
    552 1,3-diphenyli c1ccc(cc1)c2c 135 20348 http://www.aAlfa Aesar
    553 1,3-di-tert-bu CC(C)(C)c1cccc 10 120562 http://www.aAlfa Aesar
    554 1,3-diphenylgc1ccc(cc1)NC( 149 7313 http://www.aAlfa Aesar
    555 1,3-diphenylac1ccc(cc1)CC( 34 21105887 http://www.aAlfa Aesar
    556 1,3-diphenyl- CC(CC(=O)c1cc 70 120774 http://www.aAlfa Aesar
    557 1,3-diphenoxyc1ccc(cc1)OC 82 11641 http://www.aAlfa Aesar
    558 1,3-diphenox c1ccc(cc1)Oc2 60 69362 http://www.aAlfa Aesar
    559 1,3-diphenyl- c1ccc(cc1)C(= 78 8126 http://www.aAlfa Aesar
    560 1,3-dioxolane C1COCO1 -95 12066 http://www.aAlfa Aesar
    561 1,3-di-o-tolyl Cc1ccccc1NC( 177 7056 http://www.aAlfa Aesar
    562 1,3-dinitrobe c1cc(cc(c1)[N 89 7172 http://www.aAlfa Aesar
    563 1,3-di-n-butyl CCCCN1C(=O) 62 97639 http://www.aAlfa Aesar
    564 1,3-dimethylurCn1ccc(=O)n( 121 63310 http://www.aAlfa Aesar
    565 1,3-dimethylba
    CN1C(=O)CC(= 122 63056 http://www.aAlfa Aesar
    566 1,3-dimethyl- CNc1c(c(=O)n 203 25027445 http://www. Alfa Aesar
    567 1,3-dimethyl- CN1CCCN(C1= -23 73671 http://www.aAlfa Aesar
    568 1,3-dimethyl- CN1CCN(C1=O 8 6409 http://www.aAlfa Aesar
    569 1,3-dimethyl-2CCCn1c(cc2c1 139 24339378 http://www. Alfa Aesar
    570 1,3-dimethox COc1cccc(c1) -52 8674 http://www.aAlfa Aesar
    571 1,3-diisoprop CC(C)c1cccc(c -63 7170 http://www.aAlfa Aesar
    572 1,3-diiodopro C(CI)CI -20 11810 http://www.aAlfa Aesar
    573 1,3-diiodobenc1cc(cc(c1)I)I 36 21168837 http://www.aAlfa Aesar
    574 1,3-dihydroxyc1ccc2c(c1)cc 125 8282 http://www.aAlfa Aesar
    575 1,3-dihydroxyC1[C@@](OC[ 79 2005829 http://www.aAlfa Aesar
    576 1,3-diethoxybCCOc1cccc(c1 11 67462 http://www.aAlfa Aesar
    577 1,3-difluorob c1cc(cc(c1)F)F -59 21111806 http://www.aAlfa Aesar
    578 1,3-dichloroprC(/C=C/Cl)Cl -84 23117 http://www.aAlfa Aesar
    579 1,3-dichloroa C(C(=O)CCl)Cl 44 21106513 http://www.aAlfa Aesar
    580 1,3-dichlorob c1cc(cc(c1)Cl) -25 13857694 http://www.aAlfa Aesar
    581 1,3-dichloro- c1c(cc(cc1Cl)I) 57 68896 http://www.aAlfa Aesar
    582 1,3-dichloro- c1c(cc(cc1Cl)C 64 11567 http://www.aAlfa Aesar
    583 1,3-dichloro- c1cc(c(cc1Cl)C -23 109728 http://www.aAlfa Aesar
    584 1,3-dichloro- CC1(C(=O)N(C( 132 8057 http://www.aAlfa Aesar
    585 1,3-dichloro- c1cc(c(c(c1)Cl 172 452373 http://www.aAlfa Aesar
    586 1,3-dichloro- C(C(CCl)O)Cl -4 21106535 http://www.aAlfa Aesar
    587 1,3-dibromopC(CBr)CBr -34 7710 http://www.aAlfa Aesar
    588 1,3-dichloro- c1cc(c(c(c1)Cl) 38 121182 http://www.aAlfa Aesar
    589 1,3-dibromo-5c1c(cc(c(c1Br) 134 2006733 http://www.aAlfa Aesar
    590 1,3-dibromobc1cc(cc(c1)Br) -7 13875356 http://www.aAlfa Aesar
    591 1,3-dibromo-2CCC(CC)(CBr)C 40 95701 http://www.aAlfa Aesar
    592 1,3-dibromo- COC(CBr)(CBr 66 2015952 http://www.aAlfa Aesar
    593 1,3-dibenzoyl c1ccc(cc1)C(= 118 60108 http://www.aAlfa Aesar
    594 1,3-dibenzyl- c1ccc(cc1)CN 80 2084548 http://www.aAlfa Aesar
    595 1,3-diamino-2C(C(CN)O)N 43 55104 http://www.aAlfa Aesar
    596 1,3-diaminop C(CN)CN -12 415 http://www.aAlfa Aesar
    597 1,3-dibenzoyl c1ccc(cc1)C(= 99 69801 http://www.aAlfa Aesar
    598 1,3-diacetylb CC(=O)c1cccc( 36 21733 http://www.aAlfa Aesar
    599 1,3-diacetylin CC(=O)c1cn(c 146 78616 http://www.aAlfa Aesar
    600 1,3-di(4-pyrid c1cnccc1CCCc 55 78494 http://www.aAlfa Aesar
    601 1,3-di-2-thie c1cc(sc1)C=CC 99 88366 http://www.aAlfa Aesar
    602 1,3-cycloocta C1C/C=CC=C/ -53 264937 http://www.aAlfa Aesar
    603 1,3-cyclopent C1CC(=O)CC1 152 69875 http://www.aAlfa Aesar
    604 1,3-cyclohexaC1CC(=O)CC(= 103 10004 http://www.aAlfa Aesar
    605 1,3-bis[tris( C(CNC(CO)(CO 169 111383 http://www.aAlfa Aesar
    606 1,3-cyclohexaC1CC=CC=C1 -89 11117 http://www.aAlfa Aesar
    607 1,3-cyclohexanC1CC(CC(C1)O 30 10003 http://www.aAlfa Aesar
    608 1,3-bis(trifl c1cc(cc(c1)C(F -35 21111807 http://www.aAlfa Aesar
    609 1,3-bis[(trime C[Si](C)(C)C#C 58 125472 http://www.aAlfa Aesar
    610 1,3-bis(diphe c1ccc(cc1)P(C 61 73276 http://www.aAlfa Aesar
    611 1,3-bis(hydro C(NC(=O)NCO 126 8496 http://www.aAlfa Aesar
    612 1,3-bis(2-hyd c1cc(cc(c1)C(C 10 63127 http://www.aAlfa Aesar
    613 1,3-bis(4-pipeC1CNCCC1CCC 66 77230 http://www.aAlfa Aesar
    614 1,3-benzenedis
    c1cc(cc(c1)S( 59 86880 http://www.aAlfa Aesar
    615 1,3-benzodioxc1ccc2c(c1)O -18 13881169 http://www.aAlfa Aesar
    616 1,3,5-tri-tert CC(C)(C)c1cc(c 71 14361 http://www.aAlfa Aesar
    617 1,3-benzenedc1cc(cc(c1)CO 58 62582 http://www.aAlfa Aesar
    618 1,3,5-triphen c1ccc(cc1)c2c 173 11436 http://www.aAlfa Aesar
    619 1,3,5-tris(2-h C(CO)n1c(=O) 138 12726 http://www.aAlfa Aesar
    620 1,3,5-trimeth Cc1c(c(n(n1)C 82 643636 http://www. Alfa Aesar
    621 1,3,5-trioxaneC1OCOCO1 61 7790 http://www.aAlfa Aesar
    622 1,3,5-trimeth COc1cc(cc(c1 52 21111723 http://www.aAlfa Aesar
    623 1,3,5-trimethyCc1cc(n(n1)C) 36 13461 http://www.aAlfa Aesar
    624 1,3,5-triisop CC(C)c1cc(cc( -7 12329 http://www.aAlfa Aesar
    625 1,3,5-trimeth COc1cc(c(c(c1 152 452664 http://www.aAlfa Aesar
    626 1,3,5-trifluor c1c(cc(cc1F)F) -6 21111798 http://www.aAlfa Aesar
    627 1,3,5-trichlo c1c(cc(cc1Cl)C 64 7662 http://www.aAlfa Aesar
    628 1,3,5-triethy C#Cc1cc(cc(c1 106 122640 http://www.aAlfa Aesar
    629 1,3,5-trifluor c1c(cc(c(c1F)[ 4 60889 http://www.aAlfa Aesar
    630 1,3,5-trichlo c1c(cc(c(c1Cl)I 55 202232 http://www.aAlfa Aesar
    631 1,3,5-trichlor c1c(cc(c(c1Cl) 71 27183 http://www.aAlfa Aesar
    632 1,3,5-tribrom c1c(cc(cc1Br)B 123 11776 http://www.aAlfa Aesar
    633 1,3,5-trichlor c1(c(c(c(c(c1Cl 63 60895 http://www.aAlfa Aesar
    634 1,3,5-tribenz c1ccc(cc1)C(= 118 124594 http://www.aAlfa Aesar
    635 1,3,5-tribenzyc1ccc(cc1)CN 50 68203 http://www. Alfa Aesar
    636 1,3,5-benzenetc1c(cc(cc1C(= 36 70514 http://www.aAlfa Aesar
    637 1,3,5-benzenetc1c(cc(cc1C( 375 10665 http://www.aAlfa Aesar
    638 1,3,3-trimeth CC1(c2ccccc2 -10 8048 http://www.aAlfa Aesar
    639 1,3,5,7-cyclooC1=CC=C/C=C -5 553448 http://www.aAlfa Aesar
    640 1,2-propanediCC(CO)O -60 13835224 http://www.aAlfa Aesar
    641 1,2-propanediCC(COC(=O)C) -31 11698 http://www.aAlfa Aesar
    642 1,2-phenylenec1ccc(c(c1)C 151 22547 http://www.aAlfa Aesar
    643 1,2-phenylenec1ccc(c(c1)C 59 62395 http://www.aAlfa Aesar
    644 1,2-o-isoprop CC1(O[C@@H] 160 79123 http://www.aAlfa Aesar
    645 1,2-phenylenec1ccc2c(c1)OP 30 66839 http://www.aAlfa Aesar
    646 1,2-ethylenedC(=C/P(=O)(O 219 10454862 http://www.aAlfa Aesar
    647 1,2-octanedioCCCCCCC(CO) 31 13595 http://www.aAlfa Aesar
    648 1,2-epoxyoct CCCCCCCCCCC 33 22319 http://www.aAlfa Aesar
    649 1,2-ethanedithC(CS)S -41 13865015 http://www.aAlfa Aesar
    650 1,2-diphenox c1ccc(cc1)OC 95 7427 http://www.aAlfa Aesar
    651 1,2-diphenylec1ccc(cc1)CCc 52 7364 http://www.aAlfa Aesar
    652 1,2-dimethox COCCOC -69 13836589 http://www.aAlfa Aesar
    653 1,2-dimethyl- Cc1ncc(n1C)[N 137 2980 http://www.aAlfa Aesar
    654 1,2-dimethyli Cc1nccn1C 37 14857 http://www.aAlfa Aesar
    655 1,2-diiodoeth C(CI)I 82 11723 http://www.aAlfa Aesar
    656 1,2-dimethoxyCOc1cc(c(cc1O 133 193623 http://www.aAlfa Aesar
    657 1,2-difluorob c1ccc(c(c1)F)F -34 9325 http://www.aAlfa Aesar
    658 1,2-dihydronac1ccc2c(c1)C -8 9550 http://www.aAlfa Aesar
    659 1,2-diethylbe CCc1ccccc1CC -31 8335 http://www.aAlfa Aesar
    660 1,2-difluoro- COc1cc(c(cc1O 40 745601 http://www.aAlfa Aesar
    661 1,2-diethoxybCCOc1ccccc1 44 67466 http://www.aAlfa Aesar
    662 1,2-diethoxyeCCOCCOCC -74 13835376 http://www.aAlfa Aesar
    663 1,2-dichlorob c1ccc(c(c1)Cl) -18 13837988 http://www.aAlfa Aesar
    664 1,2-dichloroe C(CCl)Cl -35 13837650 http://www.aAlfa Aesar
    665 1,2-dichlorop CC(CCl)Cl -100 6316 http://www.aAlfa Aesar
    666 1,2-dichloro- c1cc(c(cc1I)Cl) 30 79934 http://www.aAlfa Aesar
    667 1,2-dichloro- c1cc(c(cc1[N+] 41 21106095 http://www.aAlfa Aesar
    668 1,2-dichloro- c1cc(c(c(c1)Cl 62 21106574 http://www.aAlfa Aesar
    669 1,2-dichloro- c1cc(c(cc1F)Cl -1 66649 http://www.aAlfa Aesar
    670 1,2-dibromopCC(CBr)Br -55 6305 http://www.aAlfa Aesar
    671 1,2-dichloro- c1cc(c(c(c1)I)C 35 67989 http://www.aAlfa Aesar
    672 1,2-dibromobCCC(CBr)Br -65 21171408 http://www.aAlfa Aesar
    673 1,2-dibromoe C(CBr)Br 10 7551 http://www.aAlfa Aesar
    674 1,2-dibromo-4c1c(c(cc(c1Br) 33 85671 http://www.aAlfa Aesar
    675 1,2-dibromobc1ccc(c(c1)Br) 5 13875212 http://www.aAlfa Aesar
    676 1,2-dibromo-2C(CC(CBr)(C# 50 55806 http://www.aAlfa Aesar
    677 1,2-dibromo-3c1c(cc(c(c1F)B 37 2006650 http://www.aAlfa Aesar
    678 1,2-dianilino c1ccc(cc1)NC 66 60747 http://www.aAlfa Aesar
    679 1,2-dibenzoyl c1ccc(cc1)C(= 147 64038 http://www.aAlfa Aesar
    680 1,2-dibenzoyl c1ccc(cc1)C(= 146 120096 http://www.aAlfa Aesar
    681 1,2-di(p-tolyl Cc1ccc(cc1)CC 81 10397 http://www.aAlfa Aesar
    682 1,2-diaminop CC(CN)N -37 13849260 http://www.aAlfa Aesar
    683 1,2-cyclohexaC1CCC(=O)C(= 37 12465 http://www.aAlfa Aesar
    684 1,2-di(3-inde c1ccc2c(c1)C 123 2728677 http://www. Alfa Aesar
    685 1,2-bis(pheny c1ccc(cc1)SCC 69 62527 http://www.aAlfa Aesar
    686 1,2-bis[2-(tri c1ccc(c(c1)CCc 75 2053655 http://www.aAlfa Aesar
    687 1,2-bis(pheny c1ccc(cc1)S(= 180 62258 http://www.aAlfa Aesar
    688 1,2-bis(diphe c1ccc(cc1)P(C 141 66873 http://www.aAlfa Aesar
    689 1,2-bis(meth CS(=O)(=O)Nc 213 197743 http://www.aAlfa Aesar
    690 1,2-bis(dimet CP(C)CCP(C)C 180 124423 http://www.aAlfa Aesar
    691 1,2-bis(diphe c1ccc(cc1)P(c 187 436234 http://www.aAlfa Aesar
    692 1,2-bis(carbo C(CSCC(=O)O) 110 274870 http://www.aAlfa Aesar
    693 1,2-bis(chloroC[Si](C)(CC[Si] 37 75384 http://www.aAlfa Aesar
    694 1,2-bis(dimet COP(=O)(c1cc 81 2014960 http://www.aAlfa Aesar
    695 1,2-bis(2-chl C(COCCCl)OCC -32 7879 http://www.aAlfa Aesar
    696 1,2-bis(2-nit c1ccc(c(c1)[N 169 349757 http://www.aAlfa Aesar
    697 1,2-benzisoxac1ccc2c(c1)c( 139 182761 http://www. Alfa Aesar
    698 1,2-bis(1-nap c1ccc2c(c1)cc 162 123404 http://www.aAlfa Aesar
    699 1,2-benzenedc1ccc(c(c1)CO 62 62368 http://www.aAlfa Aesar
    700 1,2-benzenedic1ccc(c(c1)S)S 23 13840080 http://www.aAlfa Aesar
    701 1,2,5-trichlo c1c(cc(c(c1Cl)C 52 14966534 http://www.aAlfa Aesar
    702 1,2,6-hexanetrC(CCO)CC(CO) -20 7535 http://www.aAlfa Aesar
    703 1,2,4-trimeth Cc1ccc(c(c1)C -44 6977 http://www.aAlfa Aesar
    704 1,2,4-triphen c1ccc(cc1)C(C 128 86109 http://www.aAlfa Aesar
    705 1,2,4-trichlo c1cc(c(cc1Cl)C 17 13862559 http://www.aAlfa Aesar
    706 1,2,4-trifluor c1c(c(cc(c1F)F -11 67565 http://www.aAlfa Aesar
    707 1,2,4-tribrom c1cc(c(cc1Br)B 42 11507 http://www.aAlfa Aesar
    708 1,2,4-trichlo c1c(c(cc(c1Cl)I 104 221527 http://www.aAlfa Aesar
    709 1,2,4-triazole c1[nH]ncn1 120 8900 http://www.aAlfa Aesar
    710 1,2,4-triazolo c1ccn2c(c1)n 234 73475 http://www.aAlfa Aesar
    711 1,2,4-triazolo c1ccn2c(c1)nn 210 589135 http://www. Alfa Aesar
    712 1,2,4-butanetrC(CO)C(CO)O -20 17287 http://www.aAlfa Aesar
    713 1,2,4-triacet CC(=O)Oc1ccc 99 62384 http://www.aAlfa Aesar
    714 1,2,4,5-tetra Cc1cc(c(cc1C) 79 6999 http://www.aAlfa Aesar
    715 1,2,4-benzenec1cc2c(cc1C( 167 10618 http://www.aAlfa Aesar
    716 1,2,4,5-tetra c1c(c(cc(c1F)F 4 21108549 http://www.aAlfa Aesar
    717 1,2,4,5-tetrak CC(C)Sc1cc(c( 77 549629 http://www.aAlfa Aesar
    718 1,2,4,5-tetra c1c(c(cc(c1Br) 178 11974 http://www.aAlfa Aesar
    719 1,2,4,5-tetra c1c(c(cc(c1Cl)C 140 21106163 http://www.aAlfa Aesar
    720 1,2,3-trichlo C(C(CCl)Cl)Cl -14 7013 http://www.aAlfa Aesar
    721 1,2,3-trimeth COc1cccc(c1O 44 21111804 http://www.aAlfa Aesar
    722 1,2,3-trichlor c1c(cc(c(c1Cl) 70 79719 http://www.aAlfa Aesar
    723 1,2,3-trichlo c1cc(c(c(c1)Cl) 54 13864445 http://www.aAlfa Aesar
    724 1,2,3-tribrom C(C(CBr)Br)Br 17 7007 http://www.aAlfa Aesar
    725 1,2,3-trichlor c1cc(c(c(c1[N+ 55 26691 http://www.aAlfa Aesar
    726 1,2,3-thiadiaz c1c(nns1)C(= 228 312024 http://www.aAlfa Aesar
    727 1,2,3-triacet CC(=O)Oc1ccc 166 10228 http://www.aAlfa Aesar
    728 1,2,3-hexanetrCCCC(C(CO)O) 66 2006570 http://www. Alfa Aesar
    729 1,2,3-thiadia c1c(nns1)C=O 85 2018914 http://www.aAlfa Aesar
    730 1,2,3,4-tetrahc1ccc2c(c1)C 14 62667 http://www.aAlfa Aesar
    731 1,2,3-benzotr c1ccc2c(c1)c( 223 6740 http://www.aAlfa Aesar
    732 1,2,3,4-tetra c1ccc2c(c1)C -36 8097 http://www.aAlfa Aesar
    733 1,2,3,4-tetra c1ccc2c(c1)c3 119 13075 http://www.aAlfa Aesar
    734 1,2,3,4-tetrahc1ccc2c(c1)C -30 6779 http://www.aAlfa Aesar
    735 1,1'-thiocarboc1ccn(c(=O)c1 165 745588 http://www. Alfa Aesar
    736 1,2,3,4-tetra c1cc(c(c(c1F)F -42 21106162 http://www.aAlfa Aesar
    737 1,1-diphenyleCC(c1ccccc1)( 80 62253 http://www.aAlfa Aesar
    738 1,1-diphenyleC=C(c1ccccc1) 6 10287 http://www.aAlfa Aesar
    739 1,1-diphenyl- C#CC(c1ccccc1 46 83929 http://www.aAlfa Aesar
    740 1,1-diphenylaCC(=O)C(c1ccc 61 63102 http://www.aAlfa Aesar
    741 1,1-cyclopropCOC(=O)C1(CC 49 11343278 http://www. Alfa Aesar
    742 1,1-dioxobenzc1ccc2c(c1)C 77 3758400 http://www.aAlfa Aesar
    743 1,1-cyclohexanC1CCC(CC1)(C 180 70440 http://www.aAlfa Aesar
    744 1,1-cyclopropaC1CC1(C(=O)O 132 62239 http://www.aAlfa Aesar
    745 1,1'-carbonyldc1cn(cn1)C(= 118 61561 http://www.aAlfa Aesar
    746 1,1'-carbonyldC1CCN(CC1)C 45 20200 http://www. Alfa Aesar
    747 1,1'-bi(2-naphc1ccc2c(c1)cc 217 11269 http://www.aAlfa Aesar
    748 1,1-bis(methylCSC(=C[N+](=O 126 75448 http://www.aAlfa Aesar
    749 1,12-dodecaneC(CCCCCCO)C 83 72056 http://www.aAlfa Aesar
    750 1,18-octadecaC(CCCCCCCCC 127 68030 http://www.aAlfa Aesar
    751 1,12-diamino C(CCCCCCN)C 70 16755 http://www.aAlfa Aesar
    752 1,12-dibromoC(CCCCCCBr)C 40 17720 http://www.aAlfa Aesar
    753 1,10-diiododeC(CCCCCI)CCC 30 77001 http://www.aAlfa Aesar
    754 1,10-phenanthc1cc2ccc3ccc 118 1278 http://www.aAlfa Aesar
    755 1,10-decanediC(CCCCCS)CCC 17 13839 http://www.aAlfa Aesar
    756 1,10-dibromoC(CCCCCBr)CC 28 192166 http://www.aAlfa Aesar
    757 1,10-decanediC(CCCCCC#N) 18 70673 http://www.aAlfa Aesar
    758 1,10-decanediC(CCCCCO)CC 73 34095 http://www.aAlfa Aesar
    759 1,1,4,4-tetra c1ccc(cc1)C(= 198 66678 http://www.aAlfa Aesar
    760 1,1':3',1''-ter B(c1cc(cc(c1) 294 11207057 http://www. Alfa Aesar
    761 1,1,3,3-tetramC[SiH](C)O[SiH -78 17619 http://www.aAlfa Aesar
    762 1,1,3-triphenyc1ccc(cc1)C#C 81 120767 http://www. Alfa Aesar
    763 1,1,2-trimeth CC1=Nc2ccc3c 117 149093 http://www.aAlfa Aesar
    764 1,1,3,3,5,5-heC[SiH](C)O[Si] -67 64083 http://www.aAlfa Aesar
    765 1,1,2,2-tetraf COC(C(F)F)(F) -107 61243 http://www.aAlfa Aesar
    766 1,1,2-trichlor C(=C(Cl)Cl)(C(F -114 61255 http://www.aAlfa Aesar
    767 1,1,1-tris(hy CC(CO)(CO)CO 190 6256 http://www.aAlfa Aesar
    768 1,1,2,2-tetra C(C(Cl)Cl)(Cl)C -43 6342 http://www.aAlfa Aesar
    769 1,1,1,3,3,3-h C(C(F)(F)F)(C( -3 12941 http://www.aAlfa Aesar
    770 1,1,1-tris(chl CC(CCl)(CCl)CC 18 120577 http://www.aAlfa Aesar
    771 1,1'-(azodicar C1CCN(CC1)C 135 65839 http://www. Alfa Aesar
    772 1,1,1,2-tetraf C(C(F)(F)F)(OC( 44 478689 http://www.aAlfa Aesar
    773 1-(trimethylsi C[Si](C)(C)n1c -42 26905 http://www.aAlfa Aesar
    774 1-(trifluoromeC1CCC(CC1)(C( 70 13812905 http://www. Alfa Aesar
    775 1-(trifluoromeC1CCC(C1)(C(= 37 21242252 http://www. Alfa Aesar
    776 1-(p-toluenesuCc1ccc(cc1)S( 101 555466 http://www. Alfa Aesar
    777 1-(trans-cinn c1ccc(cc1)/C= 130 4512938 http://www.aAlfa Aesar
    778 1-(phenylsulfoc1ccc(cc1)S(= 89 123597 http://www.aAlfa Aesar
    779 1-(p-toluenesuCc1ccc(cc1)S( 85 9131833 http://www.aAlfa Aesar
    780 1-(phenylethyc1ccc(cc1)C# 61 516171 http://www.aAlfa Aesar
    781 1-(phenylsulfoc1ccc(cc1)S(= 78 278699 http://www.aAlfa Aesar
    782 1-(pentafluor c1cn(cn1)C(=O) 56 91105 http://www.aAlfa Aesar
    783 1-(pentafluor CC(c1c(c(c(c(c 33 88752 http://www.aAlfa Aesar
    784 1-(methylsulf CS(=O)(=O)n1 89 454456 http://www.aAlfa Aesar
    785 1-(o-tolyl)pip Cc1ccccc1N2 47 83039 http://www.aAlfa Aesar
    786 1-(cyanoacetylC1CCN(C1)C( 73 76026 http://www.aAlfa Aesar
    787 1-(heptafluor c1cn(cn1)C(=O) 11 85218 http://www.aAlfa Aesar
    788 1-(chloromethc1ccc2c(c1)cc 32 6584 http://www.aAlfa Aesar
    789 1-(cyanoacetylC1CCN(CC1)C 88 76469 http://www.aAlfa Aesar
    790 1-(6-methoxy-CC(c1ccc2cc( 112 500377 http://www.aAlfa Aesar
    791 1-(boc-amino)CC(C)(C)OC(= 133 2016389 http://www.aAlfa Aesar
    792 1-(4-nitrophe c1ccc2c(c1)cc 250 13544963 http://www.aAlfa Aesar
    793 1-(4-pyridyl)p c1cnccc1N2C 139 63689 http://www.aAlfa Aesar
    794 1-(4-nitrophenc1cc(ccc1N2C 104 73122 http://www.aAlfa Aesar
    795 1-(4-nitrophenc1cc(ccc1[N+] 96 3857991 http://www.aAlfa Aesar
    796 1-(4-nitrophenc1cc(ccc1N2C 131 72658 http://www.aAlfa Aesar
    797 1-(4-nitrophenc1cc(ccc1n2c( 201 600104 http://www. Alfa Aesar
    798 1-(4-nitrophenc1cc(sc1)C=CC 169 334131 http://www.aAlfa Aesar
    799 1-(4-methoxypCCCc1ccc(cc1 61 14032575 http://www. Alfa Aesar
    800 1-(4-methoxypCOc1ccc(cc1) 66 74299 http://www.aAlfa Aesar
    801 1-(4-methoxypCOc1ccc(cc1) 97 9259536 http://www. Alfa Aesar
    802 1-(4-methoxypCCCCCc1ccc(c 47 533372 http://www. Alfa Aesar
    803 1-(4-methoxybCOc1ccc(cc1) 189 87368 http://www.aAlfa Aesar
    804 1-(4-methoxypCOc1ccc(cc1) 43 89072 http://www.aAlfa Aesar
    805 1-(4-iodophenc1ccn(c1)c2ccc 131 239679 http://www.aAlfa Aesar
    806 1-(4'-methoxy-COc1ccc(cc1) 154 21476893 http://www. Alfa Aesar
    807 1-(4-hydroxypc1cc(ccc1n2c( 170 2299139 http://www.aAlfa Aesar
    808 1-(4-fluoroph c1cc(ccc1N2C 32 67803 http://www.aAlfa Aesar
    809 1-(4-fluorophec1ccn(c1)c2cc 51 635630 http://www.aAlfa Aesar
    810 1-(4-ethoxyphCCOc1ccc(cc1 47 11422388 http://www. Alfa Aesar
    811 1-(4-ethoxyphCCCCCc1ccc(c 62 530457 http://www. Alfa Aesar
    812 1-(4-chlorophc1cc(ccc1C2(C 154 89051 http://www. Alfa Aesar
    813 1-(4-chlorophCC(C)(C)C(=O) 97 474542 http://www.aAlfa Aesar
    814 1-(4-chlorophc1cc(ccc1C2( 152 91139 http://www.aAlfa Aesar
    815 1-(4-biphenylyCC(c1ccc(cc1) 97 86818 http://www.aAlfa Aesar
    816 1-(4-bromophe
    CC(c1ccc(cc1) 37 86049 http://www.aAlfa Aesar
    817 1-(3-trifluor C#CC(COc1cccc 32 9347348 http://www.aAlfa Aesar
    818 1-(4-aminopheCC(c1ccc(cc1) 70 77344 http://www.aAlfa Aesar
    819 1-(3-methoxybCOc1cccc(c1) 190 47695 http://www.aAlfa Aesar
    820 1-(3-chlorophC#CC(COc1ccc 38 13615529 http://www.aAlfa Aesar
    821 1-(3-hydroxypC1CN(CCN1)C 50 71532 http://www. Alfa Aesar
    822 1-(3-aminopheCC(c1cccc(c1) 68 193129 http://www.aAlfa Aesar
    823 1-(3-aminoproc1cn(cn1)CCC -68 71079 http://www.aAlfa Aesar
    824 1-(3,4-dimethCc1ccc(cc1C) 63 2005973 http://www.aAlfa Aesar
    825 1-(3,5-dichlor Cc1ccc(n1c2cc( 79 8665595 http://www.aAlfa Aesar
    826 1-(2-trifluor c1ccc(c(c1)C(F 52 1318 http://www.aAlfa Aesar
    827 1-(3,4-dichlor c1cc(c(cc1N2C 63 84495 http://www.aAlfa Aesar
    828 1-(2-thenoyl)-c1cc(sc1)C(=O 43 5399 http://www.aAlfa Aesar
    829 1-(2-thiazolyl c1ccc2c(c1)c 139 21171804 http://www.aAlfa Aesar
    830 1-(2-phenylet c1ccc(cc1)CC 58 87058 http://www.aAlfa Aesar
    831 1-(2-pyridylazc1ccc2c(c1)c 140 17967090 http://www.aAlfa Aesar
    832 1-(2-phenylet c1ccc(cc1)CCc 105 19526413 http://www. Alfa Aesar
    833 1-(2-nitrophenc1ccc(c(c1)N2 77 195994 http://www.aAlfa Aesar
    834 1-(2-nitrophenc1ccc(c(c1)n2 59 454115 http://www.aAlfa Aesar
    835 1-(2-naphthoylc1ccc2cc(ccc2 74 63365 http://www.aAlfa Aesar
    836 1-(2-naphthyl CC(c1ccc2ccc 74 88713 http://www.aAlfa Aesar
    837 1-(2-methoxypCOc1ccccc1N 37 1306 http://www.aAlfa Aesar
    838 1-(2-hydroxyeC1CCN(CC1)C 16 17221 http://www.aAlfa Aesar
    839 1-(2-methoxy COCCN1CCCN 67 16815626 http://www. Alfa Aesar
    840 1-(2-hydroxyeC1CN(C(=O)N 49 69710 http://www.aAlfa Aesar
    841 1-(2-hydroxyeC1CN(CCN1)C -39 7394 http://www.aAlfa Aesar
    842 1-(2-furyl)-2- c1cc(oc1)/C=C 74 598925 http://www.aAlfa Aesar
    843 1-(2-fluoroph c1ccc(c(c1)N 46 63700 http://www.aAlfa Aesar
    844 1-(2-furoyl)pi c1cc(oc1)C(= 68 478652 http://www.aAlfa Aesar
    845 1-(2-aminophec1ccc(c(c1)N) 94 72372 http://www.aAlfa Aesar
    846 1-(2-bromoethc1cc(ccc1CCBr 69 71591 http://www.aAlfa Aesar
    847 1-(2,5-dimethCc1ccc(c(c1) 45 63713 http://www.aAlfa Aesar
    848 1-(2-aminoethC1CN(CCN1)C -19 8465 http://www.aAlfa Aesar
    849 1-(2,4-difluor c1cc(c(cc1F) 75 2016381 http://www.aAlfa Aesar
    850 1-(1-propynyl CC#CC1(CCCC 48 200616 http://www.aAlfa Aesar
    851 1-(2,4,6-triis CC(C)c1cc(c(c 111 600068 http://www.aAlfa Aesar
    852 [4-(trifluoromc1cc(ccc1C(F) 116 4496961 http://www. Alfa Aesar
    853 1-(1-methyl-4-CN1CCC(CC1) 31 492301 http://www. Alfa Aesar
    854 [4-(trifluoromc1cc(ccc1C(F) 144 13609083 http://www. Alfa Aesar
    855 (trimethylsilylC[Si](C)(C)CC 41 67902 http://www.aAlfa Aesar
    856 [2.2]paracycl c1cc2ccc1CCc 286 66818 http://www.aAlfa Aesar
    857 (S)-nicotine CN1CCC[C@H] -79 80863 http://www.aAlfa Aesar
    858 (S,s)-hydrobe c1ccc(cc1)[C 149 745457 http://www.aAlfa Aesar
    859 (S)-4-sec-butyCCC(C)[C@H] 66 8550125 http://www.aAlfa Aesar
    860 (S)-alpha-methCO[C@@](c1cc 44 5360910 http://www.aAlfa Aesar
    861 (S)-3-(boc-amiCC(C)(C)OC( 125 1246019 http://www. Alfa Aesar
    862 (S)-3-boc-thia CC(C)(C)OC(= 92 16498319 http://www. Alfa Aesar
    863 (S)-3-(boc-am CC(C)C[C@@H] 54 2042254 http://www. Alfa Aesar
    864 (S)-3-(boc-amiCC(C)(C)OC(= 142 2042378 http://www. Alfa Aesar
    865 (S)-3-(boc-amiCC(C)(C)OC(= 104 2042266 http://www. Alfa Aesar
    866 (S)-2-(boc-amiCC(C)(C)OC(= 78 5381700 http://www. Alfa Aesar
    867 (S)-2-pyrrolid C1CC(=O)N[C 160 7127 http://www.aAlfa Aesar
    868 (S)-1-boc-3-h CC(C)(C)OC( 37 1246131 http://www. Alfa Aesar
    869 (S)-2-(6-meth C[C@@H](c1cc 155 137720 http://www.aAlfa Aesar
    870 (R)-limonene CC1=CC[C@@H -74 389747 http://www.aAlfa Aesar
    871 (R)-3-(boc-amCC(C)(C)OC(= 144 5372727 http://www. Alfa Aesar
    872 (R)-3-boc-thiaCC(C)(C)OC( 92 17346169 http://www. Alfa Aesar
    873 (R)-1-boc-3-h CC(C)(C)OC(= 47 1246130 http://www. Alfa Aesar
    874 (phenylsulfonyc1ccc(cc1)S(= 112 53708 http://www.aAlfa Aesar
    875 (phenylthio)acc1ccc(cc1)SCC 64 53706 http://www.aAlfa Aesar
    876 (pentafluoropc1ccc(cc1)P(c2 71 265587 http://www.aAlfa Aesar
    877 (phenylsulfonc1ccc(cc1)S(= 156 1414960 http://www.aAlfa Aesar
    878 (methylamino)CNCC(OC)OC -73 21159479 http://www.aAlfa Aesar
    879 (methylthio)acCSCC(=O)O 14 68076 http://www.aAlfa Aesar
    880 (e)-alpha-metC/C(=Cc1ccccc 81 1266121 http://www.aAlfa Aesar
    881 (methoxymethCOCP(=O)(c1cc 117 70579 http://www.aAlfa Aesar
    882 (e)-3-dimethyCN(C)/C=C/C( 131 4520289 http://www. Alfa Aesar
    883 (e)-alpha-(4-c c1ccc(cc1)/C= 116 643361 http://www.aAlfa Aesar
    884 (benzylthio)acc1ccc(cc1)CS 62 60259 http://www.aAlfa Aesar
    885 (chloromethylC1CC1CCl -91 72268 http://www.aAlfa Aesar
    886 (4-tert-butylp CC(C)(C)c1ccc 69 20508810 http://www. Alfa Aesar
    887 (5-mercapto-1,C(C(=O)O)Sc1n 167 1363182 http://www.aAlfa Aesar
    888 (4-fluorophenyc1cc(ccc1F)S 34 505346 http://www.aAlfa Aesar
    889 (4-imidazolyl) c1c(nc[nH]1) 137 497324 http://www. Alfa Aesar
    890 (4-fluorophenyc1cc(ccc1F)SC 78 643329 http://www.aAlfa Aesar
    891 (4-chloropheny
    c1cc(ccc1SCC( 106 50091 http://www.aAlfa Aesar
    892 (4-chloropheny
    c1cc(ccc1SCC# 80 2058630 http://www.aAlfa Aesar
    893 (4-chloropheny
    c1cc(ccc1S(=O 171 642983 http://www.aAlfa Aesar
    894 (4-bromobutoc1ccc(cc1)OC 42 64147 http://www.aAlfa Aesar
    895 (4-chlorophenc1cc(ccc1OCC( 19 70168 http://www.aAlfa Aesar
    896 (3S,4R)-4-(4- CN1CC[C@H]([ 96 2015974 http://www. Alfa Aesar
    897 (3R-cis)-tetra C1C[C@H]2C(= 110 9119906 http://www. Alfa Aesar
    898 (3-chloropropCO[Si](CCCCl) -50 56230 http://www.aAlfa Aesar
    899 (3,4-dimethoxCOc1ccc(cc1O 102 633075 http://www.aAlfa Aesar
    900 (3-bromo-2,4,Cc1cc(c(c(c1 194 48922 http://www.aAlfa Aesar
    901 (2S,5s)-2,5-heC[C@@H](CC[ 53 5323234 http://www.aAlfa Aesar
    902 (2-hydroxyethC(CO)NN -70 7726 http://www.aAlfa Aesar
    903 (2-carboxyphec1ccc(c(c1)C 217 404243 http://www.aAlfa Aesar
    904 (2h)1,4-benzoc1ccc2c(c1)N 177 20108 http://www.aAlfa Aesar
    905 (2-aminoethoxC(COCC(=O)O 178 9346048 http://www. Alfa Aesar
    906 (2-bromoethyc1ccc(cc1)CCB -56 7383 http://www.aAlfa Aesar
    907 (1S,4S)-2-boc-CC(C)(C)OC( 75 9696050 http://www.aAlfa Aesar
    908 (1S,2R)-1-phenC[C@H]([C@H] 45 8118095 http://www. Alfa Aesar
    909 (1S,2R)-10,2- CC1([C@@H]2 183 746406 http://www.aAlfa Aesar
    910 (1S)-camphorsCC1([C@@H]2 227 628271 http://www.aAlfa Aesar
    911 (1S)-camphor C[C@]12CC[C@ 199 16737174 http://www.aAlfa Aesar
    912 (1S)-camphor-CC1([C@@H]2C 66 80176 http://www.aAlfa Aesar
    913 (1S)-camphor C[C@]12CC[C 178 392267 http://www.aAlfa Aesar
    914 (1S)-camphaniC[C@@]12CC[ 66 148847 http://www.aAlfa Aesar
    915 (1R,3S)-camphC[C@]1(CC[C@ 186 91985 http://www.aAlfa Aesar
    916 (1S)-camphaniCC1(C2(CCC1( 200 102572 http://www.aAlfa Aesar
    917 (1R,2s)-10,2- CC1([C@H]2C 181 628224 http://www.aAlfa Aesar
    918 (1R)-camphorC[C@@]12CC[ 200 10505800 http://www.aAlfa Aesar
    919 (1R)-endo-fenC[C@@]12CC[ 41 5365080 http://www.aAlfa Aesar
    920 (1R)-camphor-CC1([C@H]2CC 200 4696797 http://www.aAlfa Aesar
    921 (1R)-camphor-CC1([C@H]2CC 66 7992146 http://www.aAlfa Aesar
    922 (1R)-camphorC[C@@]12CC[ 178 139902 http://www.aAlfa Aesar
    923 (1-bromoethyCC(c1ccccc1)B -65 21159570 http://www.aAlfa Aesar
    924 2-(bromomethc1ccc2cc(ccc2 53 63503 http://www.aAlfa Aesar
    925 (1,2-dibromoec1ccc(cc1)C(C 72 6878 http://www.aAlfa Aesar
    926 2-(2,6-dimethCC1(COC(=N1) 69 4323324 http://www.aAlfa Aesar
    927 2-(2-aminoethC(COCCO)N -11 12989 http://www.aAlfa Aesar
    928 2-(2-aminophec1ccc(c(c1)c2 214 72160 http://www.aAlfa Aesar
    929 2-(2-carboxyvB(c1ccccc1/C 171 4826758 http://www.aAlfa Aesar
    930 2-(2-chloro-4 CC(=O)C(C#N) 79 11213378 http://www. Alfa Aesar
    931 2-(2-chlorophc1ccc(c(c1)OC 40 2017474 http://www. Alfa Aesar
    932 2-(2-chlorophc1ccc(c(c1)c2 234 69561 http://www.aAlfa Aesar
    933 2-(2-ethoxyphCCOc1ccccc1 42 5373759 http://www.aAlfa Aesar
    934 2-(2-furyl)-1, c1ccc(cc1)N2 130 593203 http://www. Alfa Aesar
    935 2-(2-furyl)pip c1cc(oc1)C2C 87 14404384 http://www. Alfa Aesar
    936 2-(2-hydroxyec1ccnc(c1)CC -8 7392 http://www.aAlfa Aesar
    937 2-(2-hydroxypc1ccc(c(c1)c2 132 10181821 http://www.aAlfa Aesar
    938 2-(2-methoxypCOc1ccccc1c2 100 67218 http://www.aAlfa Aesar
    939 2-(2-methoxypCOc1ccccc1C 80 14234235 http://www. Alfa Aesar
    940 2-(2-methyl-1B(c1ccccc1C2 111 4320265 http://www. Alfa Aesar
    941 2-(2-naphthoxc1ccc2cc(ccc 74 6864 http://www.aAlfa Aesar
    942 2-(2-naphthyl c1ccc2cc(ccc 102 2052276 http://www. Alfa Aesar
    943 2-(2-n-butoxyCCCCOCCOCCO -32 29028 http://www.aAlfa Aesar
    944 2-(2-pyridyl) c1ccc2c(c1)[n 223 63985 http://www.aAlfa Aesar
    945 2-(2-thienyl)pc1cc(sc1)C2C 83 2052165 http://www. Alfa Aesar
    946 2-(2-thienyl)pc1ccnc(c1)c2c 63 69287 http://www.aAlfa Aesar
    947 2-(3,4-dimethCOc1ccc(cc1O 46 73918 http://www. Alfa Aesar
    948 2-(3,4-dimethCOc1ccc(cc1O 11 8114 http://www.aAlfa Aesar
    949 2-(3-chloro-4-c1ccc2c(c1)cc( 172 2018239 http://www.aAlfa Aesar
    950 2-(3-chlorophCC(C(=O)O)Oc1 115 7261 http://www.aAlfa Aesar
    951 2-(3-pyridyl) c1ccc2c(c1)[n 257 216780 http://www. Alfa Aesar
    952 2-(3-thienyl)pc1cscc1C2CN 98 14404274 http://www. Alfa Aesar
    953 2-(4-aminophec1cc(ccc1C(C(F 150 502282 http://www.aAlfa Aesar
    954 2-(4-aminophec1cc(ccc1CCO 109 60266 http://www.aAlfa Aesar
    955 2-(4-aminophec1cc(ccc1CCN 30 65727 http://www.aAlfa Aesar
    956 2-(4-benzylox c1ccc(cc1)COc 86 2285031 http://www.aAlfa Aesar
    957 2-(4-biphenylyCC(C)(c1ccc(c 92 106031 http://www.aAlfa Aesar
    958 2-(4-biphenylyCC(C)(C)c1ccc 137 76483 http://www.aAlfa Aesar
    959 2-(4-biphenyl c1ccc(cc1)c2c 52 26245 http://www. Alfa Aesar
    960 2-(4-bromophe
    c1ccc2c(c1)cc 148 548590 http://www.aAlfa Aesar
    961 2-(4-bromophe
    c1ccc(cc1)c2n 170 80246 http://www.aAlfa Aesar
    962 2-(4-chloro-2 Cc1cc(ccc1OC 150 131733 http://www.aAlfa Aesar
    963 2-(4-chloro-3-c1ccc(c(c1)C( 200 59932 http://www.aAlfa Aesar
    964 2-(4-chlorobe c1ccc(c(c1)C( 150 59934 http://www.aAlfa Aesar
    965 2-(4-chlorobenc1ccnc(c1)Cc2 8 70433 http://www.aAlfa Aesar
    966 2-(4-chlorophc1cc(ccc1OCC 30 15118 http://www.aAlfa Aesar
    967 2-(4-chloropheCC(C)(C(=O)O) 120 2695 http://www.aAlfa Aesar
    968 2-(4-chlorophec1cc(c(nc1)Oc 158 529788 http://www.aAlfa Aesar
    969 2-(4-chlorophc1ccc2c(c1)cc( 206 191197 http://www.aAlfa Aesar
    970 2-(4-chlorophec1cc(c(c(c1)Sc 70 2018938 http://www.aAlfa Aesar
    971 2-(4-chlorophc1ccc(c(c1)C= 73 2058873 http://www.aAlfa Aesar
    972 2-(4-chlorophec1cc(c(nc1)Sc 220 633080 http://www.aAlfa Aesar
    973 2-(4-cyanopheCCCCCC1COC(O 57 473021 http://www.aAlfa Aesar
    974 2-(4-cyanopheCCCC1COC(OC1 58 151275 http://www.aAlfa Aesar
    975 2-(4-ethoxyphCCOc1ccc(cc1 42 81010 http://www.aAlfa Aesar
    976 2-(4-ethylphe CCCc1cnc(nc1) 42 13672779 http://www. Alfa Aesar
    977 2-(4-fluorophec1cc(c(nc1)Oc 184 526015 http://www.aAlfa Aesar
    978 2-(4-fluorophec1ccc2c(c1)cc 189 120388 http://www.aAlfa Aesar
    979 2-(4-hydroxypc1cc(ccc1CCO 91 9964 http://www.aAlfa Aesar
    980 2-(4-hydroxypCC(c1ccc(cc1) 131 92601 http://www.aAlfa Aesar
    981 2-(4-methoxy COc1ccc(cc1)C 73 70208 http://www.aAlfa Aesar
    982 2-(4-methoxypCOc1ccc(cc1) 28 62906 http://www.aAlfa Aesar
    983 2-(4-morpholin
    c1cc(c(cc1C(F 127 120390 http://www.aAlfa Aesar
    984 2-(4-morpholin
    c1ccc(c(c1)N 97 642911 http://www.aAlfa Aesar
    985 2-(4-n-hexylo CCCCCCCCc1cn 60 525021 http://www.aAlfa Aesar
    986 2-(4-pyridyl) c1ccc2c(c1)[n 219 216779 http://www. Alfa Aesar
    987 2-(4-tert-butyCC(C)(C)c1ccc 33 71729 http://www.aAlfa Aesar
    988 2-(4-toluoyl)bCc1ccc(cc1)C( 138 59933 http://www.aAlfa Aesar
    989 2(5h)-furanonC1C=CC(=O)O 4 9917 http://www.aAlfa Aesar
    990 2-(5-isoxazol Cc1ccc(c(c1)c 176 19809861 http://www. Alfa Aesar
    991 2-(5-isoxazolyc1ccc(c(c1)c2 185 10580356 http://www. Alfa Aesar
    992 2-(5-nitro-2-pc1cc(ncc1[N+ 113 511069 http://www.aAlfa Aesar
    993 2-(8-chloro-1-c1cc2cccc(c2c 156 60555 http://www.aAlfa Aesar
    994 2-(allylthio)ni C=CCSc1c(ccc 147 1415117 http://www.aAlfa Aesar
    995 2-(aminomethy
    c1ccnc(c1)CN -20 18383 http://www.aAlfa Aesar
    996 2-(boc-amino)CC(C)(C)OC(= 173 21242568 http://www. Alfa Aesar
    997 2-(boc-amino)B(c1ccccc1NC 124 2053649 http://www. Alfa Aesar
    998 2-(boc-amino)CC(C)(C)OC(= 93 9381411 http://www. Alfa Aesar
    999 2-(bromoacetyc1ccc2cc(ccc2 83 62394 http://www.aAlfa Aesar
    1000 2-(bromoacetyc1cc(sc1)C(=O 31 2056690 http://www. Alfa Aesar
    1001 2-(bromomethy
    c1ccc(c(c1)CB 72 80868 http://www.aAlfa Aesar
    1002 2-(bromomethc1ccc2c(c1)nc 48 2056577 http://www. Alfa Aesar
    1003 2-(carboxymetc1ccc(c(c1)C 189 62668 http://www.aAlfa Aesar
    1004 2-(carboxymetc1ccc(c(c1)C( 218 8338 http://www.aAlfa Aesar
    1005 2-(diethylami CCN(CC)CCO -70 13842001 http://www.aAlfa Aesar
    1006 2-(difluoromec1ccc(c(c1)C( 99 1554084 http://www.aAlfa Aesar
    1007 2-(dimethylamCN(C)CCO -60 13854944 http://www.aAlfa Aesar
    1008 2-(dimethylamCN(C)CCOC(= -60 16195 http://www.aAlfa Aesar
    1009 2-(dimethylamCC(=C)C(=O)O -30 16879 http://www.aAlfa Aesar
    1010 2-(diphenylphc1ccc(cc1)P(c 178 78496 http://www.aAlfa Aesar
    1011 2-(di-tert-bu CC(C)(C)P(c1c 116 2016678 http://www. Alfa Aesar
    1012 2-(di-tert-bu Cc1ccccc1c2cc 92 2016679 http://www. Alfa Aesar
    1013 2-(ethoxycarbB(c1ccccc1C( 132 2053823 http://www. Alfa Aesar
    1014 2-(ethoxycarbCCOC(=O)c1c 29 455879 http://www.aAlfa Aesar
    1015 2-(ethylaminoCCNCCO -9 7781 http://www.aAlfa Aesar
    1016 2-(ethylsulfonCCS(=O)(=O)C 38 10109 http://www.aAlfa Aesar
    1017 2-(ethylthio)eCCSCCO -100 21159459 http://www.aAlfa Aesar
    1018 2-(ethylthio)niCCSc1c(cccn1 185 514410 http://www.aAlfa Aesar
    1019 2-(ethylthio)nCCSc1c(cccn1) 51 2054930 http://www.aAlfa Aesar
    1020 2-(methacryloCC(=C)C(=O)O 91 1724445 http://www. Alfa Aesar
    1021 2-(methacryloCC(=C)C(=O)OC 71 11258656 http://www. Alfa Aesar
    1022 2-(methoxycarB(c1ccccc1C( 69 2053912 http://www.aAlfa Aesar
    1023 2-(methoxycaCOC(=O)c1ccc 124 38804 http://www.aAlfa Aesar
    1024 2-(methoxycarCOC(=O)c1cc 47 453137 http://www.aAlfa Aesar
    1025 2-(methylaminCNCCO -5 13836021 http://www.aAlfa Aesar
    1026 2-(methylaminCNc1ccccn1 15 19516 http://www.aAlfa Aesar
    1027 2'-(methylsulfCC(=O)Nc1ccc 145 721719 http://www. Alfa Aesar
    1028 2-(methylsulfoCS(=O)(=O)c1 139 250543 http://www. Alfa Aesar
    1029 2-(methylsulf CS(=O)(=O)CC 29 76528 http://www.aAlfa Aesar
    1030 2-(methylsulf CS(=O)(=O)c1c 48 617313 http://www.aAlfa Aesar
    1031 2-(methylthioB(c1ccccc1SC) 160 2053959 http://www.aAlfa Aesar
    1032 2-(methylthioCSc1[nH]c2cc 204 22009 http://www.aAlfa Aesar
    1033 2-(methylthioCSc1ccccc1C( 167 18374 http://www.aAlfa Aesar
    1034 2-(methylthio)CSc1ccccc1C# 36 122386 http://www.aAlfa Aesar
    1035 2-(methylthioCSc1ccc2cccc 63 122614 http://www.aAlfa Aesar
    1036 2-(methylthio)CSc1c(cccn1) 217 230436 http://www.aAlfa Aesar
    1037 2-(methylthio)CSc1c(cccn1)C 94 2054913 http://www.aAlfa Aesar
    1038 2-(methylthio)CSc1nc2ccncc 80 8416635 http://www. Alfa Aesar
    1039 2-(methylthioCSc1cnccn1 44 453496 http://www.aAlfa Aesar
    1040 2-(n-boc-methCc1cc(cnc1NCC 99 25027438 http://www. Alfa Aesar
    1041 2-(n-hexyloxy CCCCCCOCCO -42 7878 http://www.aAlfa Aesar
    1042 2-(nitromethylC1CSC(=C[N+] 142 3061358 http://www.aAlfa Aesar
    1043 2-(n-propylth CCCSc1c(cccn 147 2054931 http://www.aAlfa Aesar
    1044 2-(n-propylthiCCCSc1c(cccn 161 2054922 http://www.aAlfa Aesar
    1045 2-(phenylsulf c1ccc(cc1)S(= 123 250525 http://www.aAlfa Aesar
    1046 2-(phthalimid c1ccc2c(c1)C( 158 272940 http://www. Alfa Aesar
    1047 2-(p-hydroxypc1ccc(c(c1)C( 206 21106123 http://www.aAlfa Aesar
    1048 2-(p-toluenes Cc1ccc(cc1)S 52 80942 http://www.aAlfa Aesar
    1049 2-(p-tolyloxy Cc1ccc(cc1)O 55 1216697 http://www. Alfa Aesar
    1050 2-(trifluorom c1ccc(c(c1)C( 154 2057489 http://www.aAlfa Aesar
    1051 2-(trifluorom B(c1ccccc1OC( 119 2057491 http://www.aAlfa Aesar
    1052 2-(trifluorom c1ccc(c(c1)OC 189 2057495 http://www.aAlfa Aesar
    1053 2-(trifluorom c1ccc(c(c1)OC( 31 2057502 http://www.aAlfa Aesar
    1054 2-(trifluorom c1ccc(c(c1)C( 79 2057510 http://www.aAlfa Aesar
    1055 2-(trifluoromec1ccc(c(c1)CC 55 2057597 http://www.aAlfa Aesar
    1056 2'-(trifluorom CC(=O)Nc1cccc 96 60974 http://www.aAlfa Aesar
    1057 2'-(trifluoro CC(=O)c1ccccc 16 78562 http://www.aAlfa Aesar
    1058 2-(trifluoromeC=C(C(=O)O)C( 50 510851 http://www.aAlfa Aesar
    1059 2-(trifluoromec1ccc(c(c1)C(F -34 6656 http://www.aAlfa Aesar
    1060 2-(trifluorom c1ccc(c(c1)C=O -40 109689 http://www.aAlfa Aesar
    1061 2-(trifluorom c1ccc(c(c1)C(= 163 61078 http://www.aAlfa Aesar
    1062 2-(trifluorom B(c1ccccc1C(F 109 2016139 http://www.aAlfa Aesar
    1063 2-(trifluorom c1ccc(c(c1)C(F 182 2058284 http://www.aAlfa Aesar
    1064 2-(trifluoromec1ccc(c(c1)C(F 23 120383 http://www.aAlfa Aesar
    1065 2-(trifluoromec1ccc(c(c1)C(= 109 9515 http://www.aAlfa Aesar
    1066 2-(trifluoromec1ccc(c(c1)C#N 18 61287 http://www.aAlfa Aesar
    1067 2-(trifluorom c1ccc(cc1)C(= 60 62963 http://www.aAlfa Aesar
    1068 2-(trifluoromec1ccc(c(c1)C(= -22 60883 http://www.aAlfa Aesar
    1069 2-(trifluoromec1ccc(c(c1)CO) 4 60985 http://www.aAlfa Aesar
    1070 2-(trifluorom c1ccc(c(c1)CBr 29 109679 http://www.aAlfa Aesar
    1071 2-(trifluoromec1ccc(c(c1)/C 202 628106 http://www.aAlfa Aesar
    1072 2-(trifluoromec1cc(c(nc1)C( 186 2057825 http://www. Alfa Aesar
    1073 2-(trifluorom c1ccc(c(c1)C(F 46 61273 http://www.aAlfa Aesar
    1074 2-(trifluorom c1ccc2c(c1)Nc 189 6815 http://www.aAlfa Aesar
    1075 2-(trifluoromec1ccc(c(c1)CC 100 516898 http://www.aAlfa Aesar
    1076 2-(trifluoromec1ccc(c(c1)CC 30 68907 http://www.aAlfa Aesar
    1077 2-(trifluorom c1ccc(c(c1)C(F 60 454270 http://www.aAlfa Aesar
    1078 2-(trimethylsi C[Si](C)(C)C# 42 456090 http://www.aAlfa Aesar
    1079 2,1,3-benzothc1ccc2c(c1)ns 43 60826 http://www.aAlfa Aesar
    1080 2,2,2-tribrom C(C(Br)(Br)Br) 79 6160 http://www.aAlfa Aesar
    1081 2,2,2-trichlor CCOC(C(Cl)(Cl 50 21242792 http://www.aAlfa Aesar
    1082 2,2,2-trichlo C(=O)(C(Cl)(Cl 142 55091 http://www.aAlfa Aesar
    1083 2,2,2-trichlor C(C(Cl)(Cl)Cl) 18 7961 http://www.aAlfa Aesar
    1084 2,2,2-trichlor C(C(Cl)(Cl)Cl) 1 78534 http://www.aAlfa Aesar
    1085 2,2,2-trifluor C(=O)(C(F)(F)F 73 61036 http://www.aAlfa Aesar
    1086 2,2,2-trifluo c1ccc(cc1)C(=O -40 9521 http://www.aAlfa Aesar
    1087 2,2,2-trifluor C(C(F)(F)F)O -44 21106169 http://www.aAlfa Aesar
    1088 2,2,2-trifluor Cc1ccc(cc1)S( 40 61259 http://www.aAlfa Aesar
    1089 2,2,2-trifluor C(C(F)(F)F)OS( -70 81272 http://www.aAlfa Aesar
    1090 2,2,2-trifluor C(C(F)(F)F)OC( -65 61205 http://www.aAlfa Aesar
    1091 2,2,2-trifluor c1ccnc(c1)CNC 75 3370911 http://www. Alfa Aesar
    1092 2,2,2-trimeth CC(C)(C)C(=O) 155 12417 http://www.aAlfa Aesar
    1093 2,2,2-trimeth S=C(N)C(C)(C) 115 2296271 http://www. Alfa Aesar
    1094 2,2,3,3,3-pen C(=O)(C(C(F)(F 95 61041 http://www.aAlfa Aesar
    1095 2,2,3,3,4,4,5, C(C(C(C(C(CO)( 69 119957 http://www.aAlfa Aesar
    1096 2,2,3,3,4,4-heC(C(C(C(CO)(F) 78 61148 http://www.aAlfa Aesar
    1097 2,2,3,3-tetraf C(C(C(CO)(F)F) 84 120045 http://www.aAlfa Aesar
    1098 2,2',4,4'-tet c1cc(c(cc1O)O 201 8253 http://www.aAlfa Aesar
    1099 2,2,4'-tribro c1cc(ccc1C(=O 93 24014 http://www. Alfa Aesar
    1100 2,2',4'-trich c1cc(c(cc1Cl)C 54 19076 http://www.aAlfa Aesar
    1101 2,2,4-trimethyCC(C)C(C(C)(C 52 8602 http://www.aAlfa Aesar
    1102 2,2,4-trimeth CC(C)C(C(C)(C -50 6245 http://www.aAlfa Aesar
    1103 2,2,4-trimeth CC(C)CC(C)(C) -107 10445 http://www.aAlfa Aesar
    1104 2,2,5,5-tetra CC1(C=C(C(N1 181 79616 http://www.aAlfa Aesar
    1105 2,2',5,5'-tetr Cc1ccc(c(c1)c 50 121468 http://www.aAlfa Aesar
    1106 2,2,6,6-tetramCC1(CCCC(N1) -59 12493 http://www.aAlfa Aesar
    1107 2,2,6-trimethyCC1=CC(=O)OC 7 71687 http://www.aAlfa Aesar
    1108 2,2':5',2''-te c1cc(sc1)c2cc 92 58578 http://www.aAlfa Aesar
    1109 2,2':6',2''-ter c1ccnc(c1)c2c 91 64012 http://www.aAlfa Aesar
    1110 2,2'-bipyridin c1ccnc(c1)c2c 70 13867714 http://www.aAlfa Aesar
    1111 2,2'-bipyrimidc1cnc(nc1)c2n 114 110040 http://www.aAlfa Aesar
    1112 2,2'-biquinoli c1ccc2c(c1)cc 195 8105 http://www.aAlfa Aesar
    1113 2,2-bis(4-met COc1ccc(cc1)C 48 5379430 http://www.aAlfa Aesar
    1114 2,2'-bis(diphe c1ccc(cc1)P(c 283 551072 http://www. Alfa Aesar
    1115 2,2'-bis(diph c1ccc(cc1)P(c 213 2016682 http://www. Alfa Aesar
    1116 2,2-bis(hydroxC(CO)N(CCO)C 104 73505 http://www.aAlfa Aesar
    1117 2,2-bis(hydro CC(CO)(CO)C( 189 70865 http://www.aAlfa Aesar
    1118 2,2'-bithioph c1cc(sc1)c2cc 32 61428 http://www.aAlfa Aesar
    1119 2,2-dibromo-4c1cc(ccc1C(=O 37 2063398 http://www.aAlfa Aesar
    1120 2,2'-dibromobc1ccc(c(c1)c2 80 74932 http://www.aAlfa Aesar
    1121 2,2-dichloro-1COC(C(Cl)Cl)(F -36 3973 http://www.aAlfa Aesar
    1122 2,2'-dichloro- c1cc(c(nc1)Cl 119 21242477 http://www. Alfa Aesar
    1123 2,2'-dichloro- c1cnc(cc1c2cc 242 4344547 http://www. Alfa Aesar
    1124 2,2-dichloroa C(C(=O)N)(Cl)C 99 12173 http://www.aAlfa Aesar
    1125 2,2-dichloroa c1ccc(cc1)C(=O 21 21169500 http://www.aAlfa Aesar
    1126 2,2'-dichlorobc1ccc(c(c1)C( 134 80378 http://www.aAlfa Aesar
    1127 2,2'-dichlorobec1ccc(c(c1)C( 162 291473 http://www.aAlfa Aesar
    1128 2,2'-dichloro c1ccc(c(c1)C( 52 307962 http://www.aAlfa Aesar
    1129 2,2-difluoro-1c1cc(c2c(c1)O 204 2054476 http://www.aAlfa Aesar
    1130 2,2-difluoro-1c1cc2c(cc1C(= 156 529182 http://www.aAlfa Aesar
    1131 2,2-difluoroa c1ccc(cc1)C(= 49 240442 http://www. Alfa Aesar
    1132 2,2-difluorobuCCC(C(=O)O)(F 8 2942753 http://www. Alfa Aesar
    1133 2,2-difluorocyC1C(C1(F)F)C 58 2062967 http://www. Alfa Aesar
    1134 2,2-difluoroetC(C(F)F)O -28 119963 http://www.aAlfa Aesar
    1135 2,2-difluoroprCC(C(=O)O)(F) 43 2062969 http://www. Alfa Aesar
    1136 2,2-difluorosuC(C(=O)O)C(C( 142 62785 http://www.aAlfa Aesar
    1137 2,2'-dihydrox COc1ccc(c(c1 135 8252 http://www.aAlfa Aesar
    1138 2,2'-dihydrox c1ccc(c(c1)c2 109 14959 http://www.aAlfa Aesar
    1139 2,2'-dimethoxCOc1ccccc1c2 154 531832 http://www.aAlfa Aesar
    1140 2,2-dimethox CC(C)(OC)OC -47 21106033 http://www.aAlfa Aesar
    1141 2,2-dimethyl- CC(C)(CO)CO 128 13835293 http://www.aAlfa Aesar
    1142 2,2-dimethyl- CCC(C(C)(C)C) -5 18717 http://www.aAlfa Aesar
    1143 2,2-dimethylbCCC(C)(C)C -100 6163 http://www.aAlfa Aesar
    1144 2,2-dimethylbu
    CCC(C)(C)C(= -14 11193 http://www.aAlfa Aesar
    1145 2,2-dimethylglCC(C)(CCC(=O 84 12160 http://www.aAlfa Aesar
    1146 2,2-dimethylgCC(C)(CCC(=O 37 19970814 http://www.aAlfa Aesar
    1147 2,2-dimethylsuCC(C)(CC(=O) 141 11209 http://www.aAlfa Aesar
    1148 2,2-di-n-butyl CCCCC(CCCC) 40 3295209 http://www.aAlfa Aesar
    1149 2,2'-dinitrobi c1ccc(c(c1)c2 126 68055 http://www.aAlfa Aesar
    1150 2,2-di-n-prop CCCC(CCC)C(= 125 64264 http://www.aAlfa Aesar
    1151 2,2-diphenylac1ccc(cc1)C(c 166 70789 http://www.aAlfa Aesar
    1152 2,2'-dipyridyl c1ccnc(c1)SSc 58 58603 http://www.aAlfa Aesar
    1153 2,2'-ethylenebC1CSC(SC1)CC 134 76427 http://www.aAlfa Aesar
    1154 2,2'-furil c1cc(oc1)C(=O 164 61427 http://www.aAlfa Aesar
    1155 2,2'-furil diox c1coc(c1)/C( 165 16735820 http://www.aAlfa Aesar
    1156 2,2'-furoin c1cc(oc1)C(C( 138 10629 http://www.aAlfa Aesar
    1157 2,2'-methylenc1cc(c(cc1Cl) 174 2929 http://www.aAlfa Aesar
    1158 2,2'-thenil c1cc(sc1)C(=O 83 241956 http://www.aAlfa Aesar
    1159 2,2'-thiobisa C(C(=O)N)SCC 174 24941 http://www.aAlfa Aesar
    1160 2,2'-thiodieth C(CSCCO)O -16 13881956 http://www.aAlfa Aesar
    1161 2',3,3'-trichlo c1cc(c(nc1)c2c 169 21241263 http://www.aAlfa Aesar
    1162 2,3,3-trimeth CC1=Nc2c3ccc 71 10593444 http://www. Alfa Aesar
    1163 2,3,3-trimethyCC1=Nc2ccccc 7 14685 http://www.aAlfa Aesar
    1164 2,3,4,5,6-pentCOc1c(c(c(c(c1 -38 21171396 http://www.aAlfa Aesar
    1165 2,3,4,5,6-pen c1(c(c(c(c(c1F 148 62751 http://www.aAlfa Aesar
    1166 2,3,4,5,6-pen B(c1c(c(c(c(c1 253 2056249 http://www.aAlfa Aesar
    1167 2,3,4,5,6-pen c1ccc(cc1)C(=O 38 66396 http://www.aAlfa Aesar
    1168 2,3,4,5,6-pentC(c1c(c(c(c(c1 34 9535 http://www.aAlfa Aesar
    1169 2,3,4,5,6-pen C(c1c(c(c(c(c1 19 67069 http://www.aAlfa Aesar
    1170 2,3,4,5,6-pen c1ccc(cc1)c2c( 112 263316 http://www.aAlfa Aesar
    1171 2,3,4,5,6-pentC(=C/C(=O)O)c1 153 1406871 http://www.aAlfa Aesar
    1172 2,3,4,5,6-pen C(C(=O)O)Oc1c 109 76390 http://www.aAlfa Aesar
    1173 2,3,4,5,6-pentC(c1c(c(c(c(c1 109 62757 http://www.aAlfa Aesar
    1174 2,3,4,5,6-pen Cc1c(c(c(c(c1F -30 21168888 http://www.aAlfa Aesar
    1175 2',3',4',5',6 Cc1c(c(c(c(c1 86 67439 http://www.aAlfa Aesar
    1176 2,3,4,5,6-pe Cc1c(c(c(c(c1 138 453381 http://www.aAlfa Aesar
    1177 2,3,4,5,6-pen Cc1c(c(c(c(c1 159 1042581 http://www.aAlfa Aesar
    1178 2,3,4,5,6-pen Cc1c(c(c(c(c1C 83 61399 http://www.aAlfa Aesar
    1179 2,3,4,5-tetra c1c(c(c(c(c1F) 133 2056894 http://www.aAlfa Aesar
    1180 2,3,4,5-tetra B(c1cc(c(c(c1F 253 2063416 http://www.aAlfa Aesar
    1181 2,3,4,5-tetraf c1c(c(c(c(c1F) 86 262711 http://www.aAlfa Aesar
    1182 2,3,4,5-tetra c1ccc2c(c1)C 98 2052200 http://www. Alfa Aesar
    1183 2,3,4,5-tetra Cc1c(c([nH]c1 105 63661 http://www.aAlfa Aesar
    1184 2,3,4,6-tetra B(c1c(cc(c(c1F 127 2063417 http://www.aAlfa Aesar
    1185 2,3,4,6-tetra c1ccc(cc1)CO 151 9905972 http://www. Alfa Aesar
    1186 2,3,4,6-tetra c1ccc(cc1)CO 153 9115737 http://www. Alfa Aesar
    1187 2,3,4-tribrom c1c(c(c(s1)Br) 44 69058 http://www.aAlfa Aesar
    1188 2,3',4'-trich c1cc(c(cc1C(=O 44 279787 http://www.aAlfa Aesar
    1189 2',3',4'-trich CC(=O)c1ccc(c( 62 24343 http://www.aAlfa Aesar
    1190 2,3,4-trichlor c1cc(c(c(c1S(= 63 33863 http://www.aAlfa Aesar
    1191 2,3,4-trichlor c1cc(c(c(c1N=C 70 128424 http://www.aAlfa Aesar
    1192 2,3,4-trifluo c1cc(c(c(c1C( 128 516857 http://www.aAlfa Aesar
    1193 2,3,4-trifluor B(c1ccc(c(c1F 203 2063423 http://www.aAlfa Aesar
    1194 2,3,4-trifluor c1cc(c(c(c1C( 141 267773 http://www.aAlfa Aesar
    1195 2,3,4-trifluor c1cc(c(c(c1O)F 32 109789 http://www.aAlfa Aesar
    1196 2',3',4'-trih CC(=O)c1ccc( 171 10256 http://www.aAlfa Aesar
    1197 2,3,4-trihydr c1cc(c(c(c1C 161 67616 http://www.aAlfa Aesar
    1198 2,3,4-trihydr c1ccc(cc1)C(= 141 64001 http://www.aAlfa Aesar
    1199 2,3,4-trimeth COc1ccc(c(c1 40 67561 http://www.aAlfa Aesar
    1200 2,3,4-trimeth B(c1ccc(c(c1 77 2053997 http://www.aAlfa Aesar
    1201 2,3,4-trimeth COc1ccc(c(c1 101 10833 http://www.aAlfa Aesar
    1202 2,3,4-trimeth COc1ccc(c(c1 56 527068 http://www.aAlfa Aesar
    1203 2,3,4-trimeth CC(C)C(C)C(C) -110 10795 http://www.aAlfa Aesar
    1204 2,3,4-tri-o-b c1ccc(cc1)C 69 5894904 http://www.aAlfa Aesar
    1205 2,3,4-tri-o-be c1ccc(cc1)C 78 25027430 http://www.aAlfa Aesar
    1206 2,3,5,6-tetrac c1c(c(nc(c1Cl) 91 16096 http://www.aAlfa Aesar
    1207 2,3,5,6-tetraf c1c(c(c(c(c1F) 31 21112533 http://www.aAlfa Aesar
    1208 2,3,5,6-tetra B(c1c(c(cc(c1F 143 2063418 http://www.aAlfa Aesar
    1209 2,3,5,6-tetraf c1c(c(c(c(c1F) 34 262708 http://www.aAlfa Aesar
    1210 2,3,5,6-tetraf c1c(c(c(c(c1F) 36 2015787 http://www.aAlfa Aesar
    1211 2,3,5,6-tetra c1(c(c(c(c(c1F 169 63065 http://www.aAlfa Aesar
    1212 2,3,5,6-tetraf c1c(c(c(c(c1F) 29 63054 http://www.aAlfa Aesar
    1213 2,3,5,6-tetra c1c(c(c(c(c1F) 89 62756 http://www.aAlfa Aesar
    1214 2,3,5,6-tetraf C(CC(=O)O)c1c 152 21242199 http://www. Alfa Aesar
    1215 2',3',5',6'-t Cc1cc(c(c(c1C 75 221431 http://www.aAlfa Aesar
    1216 2,3,5,6-tetra Cc1cc(c(c(c1C 99 126817 http://www.aAlfa Aesar
    1217 2,3,5,6-tetramCc1cc(c(c(c1C 112 5378365 http://www.aAlfa Aesar
    1218 2,3,5,6-tetramCc1cc(c(c(c1C 70 73945 http://www.aAlfa Aesar
    1219 2,3,5,6-tetra Cc1c(nc(c(n1) 85 13658 http://www.aAlfa Aesar
    1220 2,3,5-tribrom c1c(c(sc1Br)Br 27 69057 http://www.aAlfa Aesar
    1221 2,3,5-trichlo B(c1cc(cc(c1Cl 245 4281837 http://www.aAlfa Aesar
    1222 2,3,5-trichlor c1c(c(sc1Cl)Cl -16 109974 http://www.aAlfa Aesar
    1223 2,3,5-trifluor c1c(c(c(c(n1)F 110 2062980 http://www.aAlfa Aesar
    1224 2,3,5-triiodobc1c(cc(c(c1C(= 221 6682 http://www.aAlfa Aesar
    1225 2,3,5-trimeth Cc1cc(c(c(c1) 94 12244 http://www.aAlfa Aesar
    1226 2,3,6-trifluo c1cc(c(c(c1F) 117 516855 http://www.aAlfa Aesar
    1227 2,3,6-trifluor c1cc(c(c(c1F) 131 453633 http://www.aAlfa Aesar
    1228 2,3,6-trifluor c1cc(c(c(c1F)C 46 128345 http://www.aAlfa Aesar
    1229 2,3,6-trifluor c1cc(c(c(c1F)O 34 451937 http://www.aAlfa Aesar
    1230 2,3,6-trifluor c1c(c(c(nc1F) 120 2062981 http://www.aAlfa Aesar
    1231 2,3,6-trimethyCc1ccc2c(c1)n 93 78665 http://www.aAlfa Aesar
    1232 2,3-bis(triflu c1cc(c(nc1)C(F -2 512765 http://www.aAlfa Aesar
    1233 2,3-butanedioCC(=O)C(=O)C -3 630 http://www.aAlfa Aesar
    1234 2,3-butanedi CC(=NO)C(=O) 76 4911363 http://www.aAlfa Aesar
    1235 2,3-diaminon c1ccc2cc(c(cc 195 63067 http://www.aAlfa Aesar
    1236 2,3-diaminopyc1cc(c(nc1)N) 112 9562 http://www.aAlfa Aesar
    1237 2,3-diaminotoCc1cccc(c1N) 58 16633 http://www.aAlfa Aesar
    1238 2,3-dibromo-1C(C(C(CO)Br)B 85 15233 http://www.aAlfa Aesar
    1239 2,3-dibromo- COc1cc(c(c(c1 215 453983 http://www.aAlfa Aesar
    1240 2,3-dibromo-6c1cc(nc(c1Br)B 70 21242350 http://www. Alfa Aesar
    1241 2,3'-dibromo c1cc(cc(c1)Br 51 453214 http://www.aAlfa Aesar
    1242 2,3-dibromobuCC(C(C(=O)O)B 86 86082 http://www.aAlfa Aesar
    1243 2,3-dibromopC(C(C(=O)N)Br 133 77387 http://www.aAlfa Aesar
    1244 2,3-dibromopyc1cc(c(nc1)Br) 59 713810 http://www.aAlfa Aesar
    1245 2,3-dichloro- C=C(CCl)Cl -83 6317 http://www.aAlfa Aesar
    1246 2,3-dichloro- C(#N)C1=C(C( 215 6517 http://www.aAlfa Aesar
    1247 2,3-dichloro-6c1cc(c(c(c1F)C 135 3089427 http://www. Alfa Aesar
    1248 2,3-dichloroanc1cc(c(c(c1)Cl 22 21111810 http://www.aAlfa Aesar
    1249 2,3-dichloroanCOc1cccc(c1Cl 32 15310 http://www.aAlfa Aesar
    1250 2,3-dichlorob c1cc(c(c(c1)Cl 63 32881 http://www.aAlfa Aesar
    1251 2,3-dichlorob c1cc(c(c(c1)Cl 167 2017637 http://www.aAlfa Aesar
    1252 2,3-dichlorob B(c1cccc(c1Cl 238 2016405 http://www.aAlfa Aesar
    1253 2,3-dichlorob c1cc(c(c(c1)Cl 220 6617846 http://www. Alfa Aesar
    1254 2,3-dichlorob c1cc(c(c(c1)Cl 60 2015978 http://www.aAlfa Aesar
    1255 2,3-dichlorobec1cc(c(c(c1)Cl 168 5562 http://www.aAlfa Aesar
    1256 2,3-dichlorobec1cc(c(c(c1)Cl 63 643679 http://www.aAlfa Aesar
    1257 2,3-dichlorobec1cc(c(c(c1)Cl 30 16948 http://www.aAlfa Aesar
    1258 2,3-dichlorop c1cc(c(c(c1)Cl 59 10857 http://www.aAlfa Aesar
    1259 2,3-dichlorop c1cc(c(c(c1)C 174 17101 http://www.aAlfa Aesar
    1260 2,3-dichlorophc1cc(c(c(c1)Cl 134 2016346 http://www. Alfa Aesar
    1261 2,3-dichloropyc1cc(c(nc1)Cl) 67 16094 http://www.aAlfa Aesar
    1262 2,3-dichloropyB(c1ccnc(c1Cl 137 2720021 http://www. Alfa Aesar
    1263 2,3-dichloroq c1ccc2c(c1)nc( 153 15796 http://www.aAlfa Aesar
    1264 2,3-dichlorothc1c(c(sc1S(=O) 56 452467 http://www.aAlfa Aesar
    1265 2,3-dichlorot Cc1cccc(c1Cl)C 4 31931 http://www.aAlfa Aesar
    1266 2',3'-dideoxycc1cn(c(=O)nc 218 22498 http://www.aAlfa Aesar
    1267 2,3-difluoro- c1cc(c(c(c1C= 142 16130202 http://www. Alfa Aesar
    1268 2,3-difluoro-4c1cc(c(c(c1C( 207 2059542 http://www. Alfa Aesar
    1269 2,3-difluoro-4c1cc(c(c(c1C# 147 2018629 http://www. Alfa Aesar
    1270 2,3-difluoro- COc1ccc(c(c1F 39 3025905 http://www. Alfa Aesar
    1271 2,3-difluoro- COc1ccc(c(c1F 223 2847041 http://www. Alfa Aesar
    1272 2,3-difluoro- COc1ccc(c(c1F 84 14493634 http://www. Alfa Aesar
    1273 2,3-difluoro- COc1ccc(c(c1F 34 3044197 http://www. Alfa Aesar
    1274 2,3-difluoro- COc1ccc(c(c1F 105 2054528 http://www. Alfa Aesar
    1275 2,3-difluoro- Cc1ccc(c(c1F) 160 2054547 http://www.aAlfa Aesar
    1276 2,3-difluoro-4Cc1ccc(c(c1F) 200 2054549 http://www.aAlfa Aesar
    1277 2,3-difluoro-4Cc1ccc(c(c1F) 44 10684099 http://www. Alfa Aesar
    1278 2,3-difluoro- Cc1ccc(c(c1F) 37 2054559 http://www. Alfa Aesar
    1279 2,3-difluoro-5c1c(cc(c(c1C( 182 21885657 http://www. Alfa Aesar
    1280 2,3-difluoro- COc1ccc(c(c1C 59 2054520 http://www. Alfa Aesar
    1281 2,3-difluoro- COc1ccc(c(c1C 128 3086274 http://www. Alfa Aesar
    1282 2,3-difluoro- COc1ccc(c(c1C 81 3067474 http://www. Alfa Aesar
    1283 2,3-difluoro- COc1ccc(c(c1C 47 4175830 http://www. Alfa Aesar
    1284 2,3-difluoro- COc1ccc(c(c1O 46 2519239 http://www. Alfa Aesar
    1285 2,3-difluoro-6c1cc(c(c(c1[N+ 61 2015517 http://www.aAlfa Aesar
    1286 2,3-difluorob c1cc(c(c(c1)F 116 123798 http://www.aAlfa Aesar
    1287 2,3-difluorobec1cc(c(c(c1)F 162 328957 http://www.aAlfa Aesar
    1288 2,3-difluoroci c1cc(c(c(c1)F 200 4643113 http://www.aAlfa Aesar
    1289 2,3-difluoromac1cc(c(c(c1)F 112 511698 http://www.aAlfa Aesar
    1290 2,3-difluorop c1cc(c(c(c1)F) 36 73005 http://www.aAlfa Aesar
    1291 2,3-difluorophc1cc(c(c(c1)F 118 454248 http://www.aAlfa Aesar
    1292 2,3-dihydro-1 c1cc2cccc3c2 99 180689 http://www.aAlfa Aesar
    1293 2,3-dihydro-5 c1ccc2c(c1)C 30 183207 http://www.aAlfa Aesar
    1294 2,3-dihydro-6 Cc1ccc2c(c1) 130 3719708 http://www. Alfa Aesar
    1295 2,3-dihydro-6 c1ccc(cc1)c2c 123 292295 http://www. Alfa Aesar
    1296 2,3-dihydrobec1ccc2c(c1)C -21 21106522 http://www.aAlfa Aesar
    1297 2,3-dihydroxyc1cc(c(c(c1)O 108 81781 http://www.aAlfa Aesar
    1298 2,3-dihydroxyc1cc(c(c(c1)O 206 18 http://www.aAlfa Aesar
    1299 2',3-dihydrox c1ccc2c(c1)c( 203 400932 http://www. Alfa Aesar
    1300 2,3-dihydroxyc1ccc2cc(c(cc 164 6824 http://www.aAlfa Aesar
    1301 2,3-dimethoxyCC1=CC(=O)C( 59 62289 http://www.aAlfa Aesar
    1302 2,3-dimethox COc1cccc(c1O 52 59950 http://www.aAlfa Aesar
    1303 2,3-dimethox COc1cccc(c1 99 85978 http://www.aAlfa Aesar
    1304 2,3-dimethoxyB(c1cccc(c1O 69 4329515 http://www.aAlfa Aesar
    1305 2,3-dimethoxyCOc1cccc(c1O 123 14470 http://www.aAlfa Aesar
    1306 2,3-dimethoxyCOc1cccc(c1O 46 20548 http://www.aAlfa Aesar
    1307 2,3-dimethoxyCOc1cccc(c1O 81 4528658 http://www.aAlfa Aesar
    1308 2,3-dimethyl- CC(=C)C(=C)C -76 10124 http://www.aAlfa Aesar
    1309 2,3-dimethyl- CC(C)C(=C)C -157 10775 http://www.aAlfa Aesar
    1310 2,3-dimethyl-4Cc1c([n+](ccc 93 130666 http://www.aAlfa Aesar
    1311 2,3-dimethyl-5Cc1c([nH]c2c1 189 80180 http://www.aAlfa Aesar
    1312 2,3-dimethyl-6Cc1ccc(c(c1C) 117 519116 http://www.aAlfa Aesar
    1313 2,3-dimethylan
    Cc1cccc(c1C)N 3 13840647 http://www.aAlfa Aesar
    1314 2,3-dimethylaCc1cccc(c1C) 29 21159742 http://www.aAlfa Aesar
    1315 2,3-dimethyl Cc1cccc(c1C) 157 2079700 http://www.aAlfa Aesar
    1316 2,3-dimethylbB(c1cccc(c1C) 175 2053813 http://www.aAlfa Aesar
    1317 2,3-dimethylbCc1cccc(c1C) 145 11289 http://www.aAlfa Aesar
    1318 2,3-dimethylbCc1cccc(c1C) 24 72095 http://www.aAlfa Aesar
    1319 2,3-dimethylbCc1cccc(c1C)C 2 2079621 http://www. Alfa Aesar
    1320 2,3-dimethylbCC(C)C(C)C -129 6340 http://www.aAlfa Aesar
    1321 2,3-dimethyli Cc1c([nH]c2c1 106 6786 http://www.aAlfa Aesar
    1322 2,3-dimethylnCc1cc2ccccc2 105 10908 http://www.aAlfa Aesar
    1323 2,3-dimethylpCc1cccc(c1C) 72 13839151 http://www.aAlfa Aesar
    1324 2,3-dimethylpCc1cccc(c1C) 186 68719 http://www.aAlfa Aesar
    1325 2,3-dimethylpCc1c(nccn1)C -12 20843 http://www.aAlfa Aesar
    1326 2,3-dimethylqCc1c(nc2cccc 105 16036 http://www.aAlfa Aesar
    1327 2,3-diphenyl- c1ccc(cc1)c2c 120 58568 http://www.aAlfa Aesar
    1328 2,3-diphenylpc1ccc(cc1)c2c 121 213276 http://www.aAlfa Aesar
    1329 2,3-diphenylqc1ccc(cc1)c2c 126 66909 http://www.aAlfa Aesar
    1330 2,3-hexanedi CCCC(=O)C(=O -30 18563 http://www.aAlfa Aesar
    1331 2',3'-isopropy CC1([C@]2([ 166 19969382 http://www.aAlfa Aesar
    1332 2,3-lutidine Cc1cccnc1C -17 10940 http://www.aAlfa Aesar
    1333 2,3-o-isopropyCC1(O[C@@H] 47 686679 http://www.aAlfa Aesar
    1334 2,3-o-isopropyCC1(O[C@H]( 47 686677 http://www.aAlfa Aesar
    1335 2,3-pentaned CCC(=O)C(=O) -52 11254 http://www.aAlfa Aesar
    1336 2',4,4'-trihyd c1cc(ccc1/C= 186 553829 http://www. Alfa Aesar
    1337 2,4,4'-trime COc1ccc(cc1) 72 222782 http://www.aAlfa Aesar
    1338 2,4,4-trimeth CC(=C)CC(C)(C -94 7580 http://www.aAlfa Aesar
    1339 2,4,4-trimeth CC(=CC(C)(C)C -106 7581 http://www.aAlfa Aesar
    1340 2,4,5-tribrom Cc1cc(c(cc1Br 114 121524 http://www.aAlfa Aesar
    1341 2,4,5-trichlor c1c(c(cc(c1Cl) 94 21111772 http://www.aAlfa Aesar
    1342 2,4,5-trichlo c1c(c(cc(c1Cl) 189 1042584 http://www. Alfa Aesar
    1343 2,4,5-trichlor c1c(c(cc(c1Cl) 69 25665 http://www.aAlfa Aesar
    1344 2,4,5-trichlor c1c(c(cc(c1Cl) 45 110005 http://www.aAlfa Aesar
    1345 2,4,5-trifluoroc1c(c(cc(c1F)F 61 85675 http://www.aAlfa Aesar
    1346 2,4,5-trifluor B(c1cc(c(cc1F 100 2063276 http://www. Alfa Aesar
    1347 2,4,5-trifluor c1c(c(cc(c1F) 98 454604 http://www.aAlfa Aesar
    1348 2,4,5-trifluor c1c(c(cc(c1F) 186 4647464 http://www.aAlfa Aesar
    1349 2,4,5-trifluor c1c(c(cc(c1F)F 41 109768 http://www.aAlfa Aesar
    1350 2,4,5-trifluor c1c(c(cc(c1F) 123 2058216 http://www. Alfa Aesar
    1351 2,4,5-trimeth COc1cc(c(cc1 113 19331 http://www.aAlfa Aesar
    1352 2,4,5-trimeth COc1cc(c(cc1 144 9856 http://www.aAlfa Aesar
    1353 2',4',5'-trim Cc1cc(c(cc1C) 10 21159574 http://www.aAlfa Aesar
    1354 2,4,5-trimeth Cc1cc(c(cc1C) 72 9911 http://www. Alfa Aesar
    1355 2,4,5-triphenyc1ccc(cc1)c2c 276 9815 http://www.aAlfa Aesar
    1356 2,4,6,8-tetramC[Si]1(O[Si](O -43 68224 http://www.aAlfa Aesar
    1357 2,4,6,8-tetramC[SiH]1O[SiH] -69 67937 http://www.aAlfa Aesar
    1358 2,4,6-collidineCc1cc(nc(c1)C -43 21106174 http://www.aAlfa Aesar
    1359 2,4,6-tri(2-pyrc1ccnc(c1)c2n 250 69682 http://www.aAlfa Aesar
    1360 2,4,6-triamin c1c(nc(nc1N) 250 13263 http://www.aAlfa Aesar
    1361 2,4,6-tribrom Cc1c(cc(c(c1B 82 19526 http://www.aAlfa Aesar
    1362 2,4,6-tribromoc1c(cc(c(c1Br) 120 21106171 http://www.aAlfa Aesar
    1363 2,4,6-tribrom c1c(cc(c(c1Br) 89 1438 http://www.aAlfa Aesar
    1364 2,4,6-tribromoc1c(c(c(c(c1Br 115 16179 http://www.aAlfa Aesar
    1365 2,4,6-tribrom Cc1c(cc(cc1Br 69 31264 http://www.aAlfa Aesar
    1366 2,4,6-trichlor c1c(cc(c(c1Cl) 77 11961 http://www.aAlfa Aesar
    1367 2,4,6-trichlo c1c(cc(c(c1Cl) 180 1064939 http://www. Alfa Aesar
    1368 2,4,6-trichlor c1c(cc(c(c1Cl) 46 454754 http://www.aAlfa Aesar
    1369 2,4,6-trichlor c1c(cc(c(c1Cl) 163 5561 http://www.aAlfa Aesar
    1370 2,4,6-trichlor c1c(cc(c(c1Cl) 81 455502 http://www.aAlfa Aesar
    1371 2,4,6-trichlor c1c(cc(c(c1Cl) 66 21106172 http://www.aAlfa Aesar
    1372 2,4,6-trichlor c1c(cc(c(c1Cl) 74 109996 http://www.aAlfa Aesar
    1373 2,4,6-trichlo c1c(cc(c(c1Cl) 142 71559 http://www.aAlfa Aesar
    1374 2,4,6-trichlor c1c(nc(nc1Cl)C 23 69792 http://www.aAlfa Aesar
    1375 2,4,6-trifluoroc1c(cc(c(c1F)N 35 61084 http://www.aAlfa Aesar
    1376 2,4,6-trifluo c1c(cc(c(c1F) 66 455208 http://www.aAlfa Aesar
    1377 2,4,6-trifluor B(c1c(cc(cc1F 235 2059563 http://www.aAlfa Aesar
    1378 2,4,6-trifluor c1c(cc(c(c1F) 141 453910 http://www.aAlfa Aesar
    1379 2,4,6-trifluor c1c(cc(c(c1F) 57 644241 http://www.aAlfa Aesar
    1380 2,4,6-trifluor c1c(cc(c(c1F)O 50 453554 http://www.aAlfa Aesar
    1381 2,4,6-trifluor c1c(cc(c(c1F) 111 2058217 http://www.aAlfa Aesar
    1382 2,4,6-trifluor c1c(cc(c(c1F) 99 14421860 http://www. Alfa Aesar
    1383 2,4,6-triiodopc1c(cc(c(c1I)O) 158 11369 http://www.aAlfa Aesar
    1384 2',4',6'-triis CC(C)c1cc(c(c 87 67769 http://www.aAlfa Aesar
    1385 2,4,6-triisop CC(C)c1cc(c(c 115 643374 http://www.aAlfa Aesar
    1386 2,4,6-triisopr CC(C)c1cc(c(c 42 329877 http://www.aAlfa Aesar
    1387 2,4,6-triisopr CC(C)c1cc(c(c 96 73115 http://www.aAlfa Aesar
    1388 2,4,6-triisopr CC(C)c1cc(c(c 186 86855 http://www.aAlfa Aesar
    1389 2,4,6-triisopr CC(C)c1cc(c(c 80 83680 http://www.aAlfa Aesar
    1390 2',4',6'-trim CC(=O)c1c(cc 103 109709 http://www.aAlfa Aesar
    1391 2,4,6-trimeth COc1cc(c(c(c 121 63211 http://www.aAlfa Aesar
    1392 2,4,6-trimeth COc1cc(c(c(c 142 68248 http://www.aAlfa Aesar
    1393 2,4,6-trimeth Cc1c(cc(cc1O 28 75960 http://www.aAlfa Aesar
    1394 2,4,6-trimethyCc1cc(c(c(c1) -5 21111773 http://www.aAlfa Aesar
    1395 2,4,6-trimeth B(c1c(cc(cc1C 124 257815 http://www.aAlfa Aesar
    1396 2,4,6-trimethyCc1cc(c(c(c1) 154 9779 http://www.aAlfa Aesar
    1397 2,4,6-trimethyCc1cc(c(c(c1) 53 121308 http://www.aAlfa Aesar
    1398 2,4,6-trimethyCc1cc(c(c(c1) 87 18973 http://www.aAlfa Aesar
    1399 2,4,6-trimethyCc1cc(c(c(c1)C 40 66722 http://www.aAlfa Aesar
    1400 2,4,6-trimeth Cc1cc(c(c(c1) 47 266870 http://www.aAlfa Aesar
    1401 2,4,6-trimeth Cc1cc(c(c(c1) 72 10248 http://www.aAlfa Aesar
    1402 2,4,6-trimeth Cc1cc(c(c(c1) 45 517437 http://www.aAlfa Aesar
    1403 2,4,6-trimeth Cc1cc(c(c(c1) 62 122274 http://www.aAlfa Aesar
    1404 2,4,6-triphenyc1ccc(cc1)c2n 235 9883 http://www. Alfa Aesar
    1405 2,4,6-triphenyc1ccc(cc1)c2c 124 546619 http://www.aAlfa Aesar
    1406 2,4,6-tris(ally C=CCOc1nc(n 27 7274 http://www.aAlfa Aesar
    1407 2,4,6-tri-tert- CC(C)(C)c1cc(c 146 63581 http://www.aAlfa Aesar
    1408 2,4'-bipyridin c1ccnc(c1)c2c 61 61763 http://www. Alfa Aesar
    1409 2,4-bis(chlor Cc1cc(c(c(c1CC 106 120802 http://www.aAlfa Aesar
    1410 2,4-bis(triflu c1cc(c(cc1C(F) 109 125053 http://www.aAlfa Aesar
    1411 2,4-di(tert-pe CCC(C)(C)c1cc 126 75265 http://www.aAlfa Aesar
    1412 2,4-diamino-5c1cc2c(c(c1)F 247 401739 http://www.aAlfa Aesar
    1413 2,4-diamino-6-Cc1ccc(cc1)c2 242 27464 http://www. Alfa Aesar
    1414 2,4-diamino-6-c1cc(cc(c1)C( 209 2062365 http://www. Alfa Aesar
    1415 2,4-diamino-6-CCCCCCCCCCCc 120 68192 http://www.aAlfa Aesar
    1416 2,4-diaminoquc1ccc2c(c1)c( 256 58597 http://www.aAlfa Aesar
    1417 2,4-diaminotoCc1ccc(cc1N) 99 6991 http://www.aAlfa Aesar
    1418 2,4-dianilino- c1ccc(cc1)Nc 195 682572 http://www.aAlfa Aesar
    1419 2,4-dibenzylo B(c1cnc(nc1O 90 2017201 http://www. Alfa Aesar
    1420 2,4-dibromo-6-
    c1c(cc(c(c1C(F 42 644276 http://www.aAlfa Aesar
    1421 2,4-dibromo-6c1c(cc(c(c1F)N 63 2018421 http://www.aAlfa Aesar
    1422 2,4-dibromo-6c1c(cc(c(c1F)O 32 2054389 http://www.aAlfa Aesar
    1423 2,4-dibromo-6c1c(cc(c(c1[N+ 130 63201 http://www.aAlfa Aesar
    1424 2,4'-dibromo c1cc(ccc1C(=O 110 7174 http://www.aAlfa Aesar
    1425 2,4-dibromoanc1cc(c(cc1Br) 80 11509 http://www.aAlfa Aesar
    1426 2,4-dibromoanCOc1ccc(cc1Br 62 25152 http://www.aAlfa Aesar
    1427 2,4-dibromobec1cc(c(cc1Br) 84 2019008 http://www.aAlfa Aesar
    1428 2,4-dibromomCc1cc(c(c(c1Br 60 21107500 http://www.aAlfa Aesar
    1429 2,4-dibromopc1cc(c(cc1Br) 37 11510 http://www.aAlfa Aesar
    1430 2,4-dibromophc1cc(c(cc1Br) 151 74347 http://www.aAlfa Aesar
    1431 2,4-dibromophc1cc(c(cc1Br) 83 3838711 http://www.aAlfa Aesar
    1432 2,4-dibromopyc1cnc(cc1Br)B 39 713812 http://www.aAlfa Aesar
    1433 2,4-dichloro- c1cc(ccc1[N+] 70 15010 http://www.aAlfa Aesar
    1434 2,4-dichloro- c1cc(c(cc1Cl)C 31 21106035 http://www.aAlfa Aesar
    1435 2,4-dichloro- Cc1cc(c(c(c1Cl 96 8302 http://www.aAlfa Aesar
    1436 2,4-dichloro-3c1c(c(c(c(c1[N 76 85190 http://www.aAlfa Aesar
    1437 2,4-dichloro-3CCc1c(cc(c(c1C 50 5383295 http://www.aAlfa Aesar
    1438 2,4-dichloro-3c1cc(c(c(c1O)C 87 15118866 http://www. Alfa Aesar
    1439 2',4'-dichlor CC(=O)c1cc(c(c 35 635087 http://www.aAlfa Aesar
    1440 2,4-dichloro- c1c(c(cc(c1F)C 159 2054420 http://www.aAlfa Aesar
    1441 2,4-dichloro-5c1c(c(cc(c1F)C 141 599623 http://www.aAlfa Aesar
    1442 2,4-dichloro-5c1c(c(cc(c1F)C 46 2062898 http://www. Alfa Aesar
    1443 2,4-dichloro-5CC(C)Oc1cc(c( 42 149047 http://www.aAlfa Aesar
    1444 2,4-dichloro- Cc1cc(c(cc1Cl) 72 107065 http://www.aAlfa Aesar
    1445 2,4-dichloro-5c1c(c(cc(c1[N+ 55 539768 http://www.aAlfa Aesar
    1446 2,4-dichloro-5c1c(c(cc(c1O)C 100 157991 http://www.aAlfa Aesar
    1447 2,4-dichloro-5c1c(c(nc(n1)Cl 30 454693 http://www. Alfa Aesar
    1448 2,4-dichloro- COc1cc2c(cc1O 177 453869 http://www.aAlfa Aesar
    1449 2,4-dichloro-6c1c(cc(c(c1Cl) 80 5894296 http://www.aAlfa Aesar
    1450 2,4-dichloro-6Cc1cc(cc(c1N)C 44 1064943 http://www.aAlfa Aesar
    1451 2,4-dichloro-6Cc1cc(cc(c1C# 80 2079679 http://www.aAlfa Aesar
    1452 2,4-dichloro- Cc1cc(cc(c1CN 54 2079685 http://www.aAlfa Aesar
    1453 2,4-dichloro- Cc1cc(nc(n1)Cl 46 71784 http://www.aAlfa Aesar
    1454 2,4-dichloro-6c1c(cc(c(c1[N+ 101 68398 http://www.aAlfa Aesar
    1455 2',4'-dichloro CC(=O)Nc1ccc( 147 73502 http://www.aAlfa Aesar
    1456 2,4'-dichloro c1cc(ccc1C(=O 101 21170959 http://www.aAlfa Aesar
    1457 2',4'-dichlor CC(=O)c1ccc(c 33 21106529 http://www.aAlfa Aesar
    1458 2,4-dichloroanc1cc(c(cc1Cl)C 61 13860817 http://www.aAlfa Aesar
    1459 2,4-dichloroanCOc1ccc(cc1Cl 26 10648 http://www.aAlfa Aesar
    1460 2,4-dichlorob c1cc(c(cc1Cl) 71 12830 http://www.aAlfa Aesar
    1461 2,4-dichlorob c1cc(c(cc1Cl) 192 68081 http://www.aAlfa Aesar
    1462 2,4-dichlorob B(c1ccc(cc1Cl 244 2016403 http://www.aAlfa Aesar
    1463 2,4-dichlorob c1cc(c(cc1Cl)C 54 177064 http://www.aAlfa Aesar
    1464 2,4-dichlorob c1cc(c(cc1Cl) 169 122214 http://www.aAlfa Aesar
    1465 2,4-dichlorobec1cc(c(cc1Cl) 162 5583 http://www.aAlfa Aesar
    1466 2,4-dichlorobec1cc(c(cc1Cl) 59 73123 http://www.aAlfa Aesar
    1467 2,4'-dichloro c1ccc(c(c1)C(= 65 59928 http://www.aAlfa Aesar
    1468 2,4-dichlorobec1cc(c(cc1Cl)C -26 9071 http://www.aAlfa Aesar
    1469 2,4-dichlorobec1cc(c(cc1Cl)C 18 60012 http://www.aAlfa Aesar
    1470 2,4-dichlorobec1cc(c(cc1Cl)C 59 14918 http://www.aAlfa Aesar
    1471 2,4-dichlorobec1cc(c(cc1Cl)C -3 6942 http://www.aAlfa Aesar
    1472 2',4'-dichloro CC(=O)N(C)c1c 87 2016949 http://www.aAlfa Aesar
    1473 2,4-dichlorop c1cc(c(cc1Cl)C 42 8140 http://www.aAlfa Aesar
    1474 2,4-dichlorop c1cc(c(cc1Cl) 138 1441 http://www.aAlfa Aesar
    1475 2,4-dichlorop c1cc(c(cc1Cl) 151 276194 http://www.aAlfa Aesar
    1476 2,4-dichlorop c1cc(c(cc1Cl) 47 215056 http://www.aAlfa Aesar
    1477 2,4-dichlorop c1cc(c(cc1Cl) 59 68298 http://www.aAlfa Aesar
    1478 2,4-dichlorop c1cc(c(cc1Cl) 38 73139 http://www.aAlfa Aesar
    1479 2,4-dichlorophc1cc(c(cc1Cl) 129 79576 http://www.aAlfa Aesar
    1480 2,4-dichlorophc1cc(c(cc1Cl) 60 72758 http://www.aAlfa Aesar
    1481 2,4-dichloropyc1cnc(cc1Cl)Cl -1 30920 http://www.aAlfa Aesar
    1482 2,4-dichlorop c1cnc(nc1Cl)C 60 69938 http://www.aAlfa Aesar
    1483 2,4-dichlorot Cc1ccc(cc1Cl)C -13 21111905 http://www.aAlfa Aesar
    1484 2,4-difluoro- c1cc(c(cc1F)F) 10 21106036 http://www.aAlfa Aesar
    1485 2,4-difluoro- COc1c(ccc(c1F 112 4196566 http://www. Alfa Aesar
    1486 2,4-difluoro- COc1c(ccc(c1F 194 3008767 http://www.aAlfa Aesar
    1487 2,4-difluoro- COc1c(ccc(c1F 45 3087686 http://www. Alfa Aesar
    1488 2,4-difluoro-3Cc1c(ccc(c1F) 44 9519057 http://www. Alfa Aesar
    1489 2,4-difluoro- Cc1c(ccc(c1F) 37 14669321 http://www. Alfa Aesar
    1490 2',4'-difluoroaCC(=O)Nc1ccc( 122 86739 http://www.aAlfa Aesar
    1491 2,4-difluoroanc1cc(c(cc1F)F -8 9328 http://www.aAlfa Aesar
    1492 2,4-difluorob c1cc(c(cc1F)F 3 66410 http://www.aAlfa Aesar
    1493 2,4-difluorob c1cc(c(cc1F)F 161 110182 http://www.aAlfa Aesar
    1494 2,4-difluorob B(c1ccc(cc1F) 249 2016086 http://www.aAlfa Aesar
    1495 2,4-difluorobec1cc(c(cc1F)F 188 66716 http://www.aAlfa Aesar
    1496 2,4-difluorobec1cc(c(cc1F)F 46 69952 http://www.aAlfa Aesar
    1497 2,4'-difluoro c1ccc(c(c1)C( 23 60970 http://www.aAlfa Aesar
    1498 2,4-difluoromac1cc(c(cc1F)F 123 511699 http://www.aAlfa Aesar
    1499 2',4'-difluoro CC(=O)N(C)c1c 84 2019260 http://www.aAlfa Aesar
    1500 2,4-difluorop c1cc(c(cc1F)F 23 109673 http://www.aAlfa Aesar
    1501 2,4-difluorophc1cc(c(cc1F)F 118 110175 http://www.aAlfa Aesar
    1502 2',4'-dihydro COc1ccccc1/C 177 4828020 http://www. Alfa Aesar
    1503 2',4-dihydrox COc1cc(ccc1O 128 4767768 http://www. Alfa Aesar
    1504 2',4'-dihydro Cc1c(ccc(c1O) 154 514753 http://www.aAlfa Aesar
    1505 2',4'-dihydro CC(=O)c1ccc( 144 6724 http://www.aAlfa Aesar
    1506 2,4-dihydroxyc1cc(c(cc1O) 136 6943 http://www.aAlfa Aesar
    1507 2,4-dihydroxyc1cc(c(cc1O) 241 145917 http://www.aAlfa Aesar
    1508 2,4-dihydrox c1ccc(cc1)C(= 146 8254 http://www.aAlfa Aesar
    1509 2',4'-dihydro CCC(=O)c1ccc 100 72148 http://www.aAlfa Aesar
    1510 2,4-dihydroxyc1cnc2c(n1)c( 348 9832 http://www.aAlfa Aesar
    1511 2,4-dimethox COc1ccc(c(c1) 39 124093 http://www.aAlfa Aesar
    1512 2,4-dimethoxyCOc1ccc(c(c1) 74 70990 http://www.aAlfa Aesar
    1513 2',4'-dimeth CC(=O)c1ccc( 40 63208 http://www.aAlfa Aesar
    1514 2,4-dimethoxyCOc1ccc(c(c1 35 16685 http://www.aAlfa Aesar
    1515 2,4-dimethox COc1ccc(c(c1 69 62390 http://www.aAlfa Aesar
    1516 2,4-dimethox COc1ccc(c(c1 107 201467 http://www.aAlfa Aesar
    1517 2,4-dimethoxyB(c1ccc(cc1O 118 2016093 http://www.aAlfa Aesar
    1518 2,4-dimethox COc1ccc(c(c1 168 4972023 http://www. Alfa Aesar
    1519 2,4-dimethoxyCOc1ccc(c(c1) 72 2016371 http://www.aAlfa Aesar
    1520 2,4-dimethoxyCOc1ccc(c(c1 109 6785 http://www.aAlfa Aesar
    1521 2,4-dimethoxyCOc1ccc(c(c1 94 70149 http://www.aAlfa Aesar
    1522 2,4-dimethoxyCOc1ccc(c(c1) 59 2016463 http://www. Alfa Aesar
    1523 2,4-dimethoxyCOc1ccc(c(c1 37 73766 http://www.aAlfa Aesar
    1524 2,4-dimethoxyCOc1ccc(c(c1) 100 599704 http://www.aAlfa Aesar
    1525 2,4-dimethoxyCOc1ccc(c(c1 32 523017 http://www.aAlfa Aesar
    1526 2,4-dimethoxyCOc1ccc(c(c1 52 2017878 http://www.aAlfa Aesar
    1527 2,4-dimethoxyCOc1ccc(c(c1 110 311242 http://www.aAlfa Aesar
    1528 2,4-dimethoxyCOc1ccnc(n1) 17 121621 http://www. Alfa Aesar
    1529 2,4-dimethyl- CC(C)C(C(C)C) -70 11259 http://www.aAlfa Aesar
    1530 2,4-dimethyl-6Cc1cc(c(c(c1) 67 66826 http://www. Alfa Aesar
    1531 2,4-dimethyl- Cc1cc(c(c(c1) 70 76179 http://www.aAlfa Aesar
    1532 2,4-dimethylan
    Cc1ccc(c(c1)C -15 13869462 http://www.aAlfa Aesar
    1533 2,4-dimethyl Cc1ccc(c(c1)C -9 21105885 http://www.aAlfa Aesar
    1534 2,4-dimethylbB(c1ccc(cc1C) 206 3409017 http://www.aAlfa Aesar
    1535 2,4-dimethylbCc1ccc(c(c1)C 125 11404 http://www.aAlfa Aesar
    1536 2,4-dimethyli Cc1c[nH]c(n1) 86 63444 http://www.aAlfa Aesar
    1537 2,4-dimethylpCC(C)CC(C)C -123 7619 http://www.aAlfa Aesar
    1538 2,4-dimethylpCc1ccc(c(c1)C 22 13839123 http://www.aAlfa Aesar
    1539 2,4-dimethylpCc1ccc(c(c1) 141 75213 http://www.aAlfa Aesar
    1540 2,4-dimethylpCc1ccc(c(c1)C 27 125606 http://www.aAlfa Aesar
    1541 2,4-dimethylsCc1ccc(c(c1)C -64 15829 http://www.aAlfa Aesar
    1542 2,4-dinitro-1 c1cc(c(cc1[N+ -21 2018776 http://www.aAlfa Aesar
    1543 2,4-dinitro-1- c1ccc2c(c1)c( 132 11309 http://www.aAlfa Aesar
    1544 2,4-dinitroani c1cc(c(cc1[N+ 178 7045 http://www.aAlfa Aesar
    1545 2,4-dinitroani COc1ccc(cc1[N 91 8080 http://www.aAlfa Aesar
    1546 2,4-dinitrobe c1cc(c(cc1[N+ 67 61548 http://www.aAlfa Aesar
    1547 2,4-dinitrobenc1cc(c(cc1[N+ 102 66861 http://www.aAlfa Aesar
    1548 2,4-dinitrobenc1cc(c(cc1[N+ 181 11387 http://www.aAlfa Aesar
    1549 2,4-dinitrobe c1cc(c(cc1[N+ 51 5383961 http://www.aAlfa Aesar
    1550 2,4-dinitroph c1cc(c(cc1[N+ 107 1448 http://www.aAlfa Aesar
    1551 2,4-dinitrophec1cc(c(cc1[N+ 139 14588 http://www.aAlfa Aesar
    1552 2,4-dinitrophec1cc(c(cc1[N+ 180 192195 http://www.aAlfa Aesar
    1553 2,4-dinitrotol Cc1ccc(cc1[N+ 69 8150 http://www.aAlfa Aesar
    1554 2,4-di-tert-bu CC(C)(C)c1ccc( 55 7037 http://www.aAlfa Aesar
    1555 2,4-hexadiyn-1C(C#CC#CCO) 112 85694 http://www.aAlfa Aesar
    1556 2,4-hexadiyneCC#CC#CC 67 121383 http://www.aAlfa Aesar
    1557 2,4-lutidine Cc1ccnc(c1)C -60 21132380 http://www.aAlfa Aesar
    1558 2,4-pentaned CC(=O)CC(=O) -23 29001 http://www.aAlfa Aesar
    1559 2,4-pentanediCC(=NO)CC(= 149 85498 http://www.aAlfa Aesar
    1560 2,4-thiazolidi C1C(=O)NC(=O 125 5242 http://www.aAlfa Aesar
    1561 2,5,6-trimeth Cc1cc2c(cc1C) 84 72063 http://www.aAlfa Aesar
    1562 2,5-bis(1-naphc1ccc2c(c1)cc 177 63368 http://www.aAlfa Aesar
    1563 2,5-bis(4-biphc1ccc(cc1)c2c 237 87437 http://www.aAlfa Aesar
    1564 2,5-bis(4-biphc1ccc(cc1)c2c 239 85930 http://www.aAlfa Aesar
    1565 2,5-bis(4-nitr c1cc(ccc1c2nn 311 13365 http://www.aAlfa Aesar
    1566 2,5-bis(5-tert CC(C)(C)c1ccc 201 258050 http://www.aAlfa Aesar
    1567 2,5-bis(chlor Cc1cc(c(cc1CC 132 72729 http://www.aAlfa Aesar
    1568 2,5-bis(trifl c1cc(c(cc1C(F) 147 21328647 http://www. Alfa Aesar
    1569 2,5-bis(triflu c1cc(c(cc1C(F) 61 2058515 http://www.aAlfa Aesar
    1570 2,5-bis(triflu c1cc(c(cc1C(F) 79 643319 http://www. Alfa Aesar
    1571 2,5-bis(trimethC[Si](C)(C)c1c 55 21242532 http://www. Alfa Aesar
    1572 2,5-diacetoxy Cc1cc(ccc1OC 41 3395363 http://www.aAlfa Aesar
    1573 2,5-diaminobec1cc(c(cc1N)S 299 59984 http://www. Alfa Aesar
    1574 2,5-diaminopyc1cc(ncc1N)N 96 19138 http://www. Alfa Aesar
    1575 2,5-dibromo-3c1(c(c(sc1Br)B 136 225449 http://www.aAlfa Aesar
    1576 2,5-dibromo-3c1c(c(c(c(c1Br 69 499338 http://www.aAlfa Aesar
    1577 2,5-dibromo-3Cc1cc(cnc1Br) 45 714347 http://www. Alfa Aesar
    1578 2,5-dibromo-4Cc1cc(ncc1Br) 38 2016181 http://www. Alfa Aesar
    1579 2,5-dibromoanc1cc(c(cc1Br) 54 69628 http://www.aAlfa Aesar
    1580 2,5-dibromobc1cc(c(cc1Br) 95 10437298 http://www. Alfa Aesar
    1581 2,5-dibromobec1cc(c(cc1Br) 71 2019147 http://www.aAlfa Aesar
    1582 2,5-dibromobec1cc(c(cc1Br) 155 11398 http://www.aAlfa Aesar
    1583 2,5-dibromobec1cc(c(cc1Br)C 49 74103 http://www.aAlfa Aesar
    1584 2,5-dibromo-pCc1cc(c(cc1Br 73 59562 http://www.aAlfa Aesar
    1585 2,5-dibromopyc1cc(ncc1Br)B 94 62562 http://www.aAlfa Aesar
    1586 2,5-dibromothc1c(sc(n1)Br)B 47 276255 http://www. Alfa Aesar
    1587 2,5-dibromot c1cc(sc1Br)Br -6 17429 http://www.aAlfa Aesar
    1588 2,5-dibromot Cc1cc(ccc1Br) 6 11511 http://www.aAlfa Aesar
    1589 2,5-dichloro- C1=C(C(=O)C= 160 11516 http://www. Alfa Aesar
    1590 2,5-dichloro-3c1(c(c(sc1Cl)C 87 311492 http://www.aAlfa Aesar
    1591 2,5-dichloro-3c1c(cnc(c1I)Cl 52 21242467 http://www. Alfa Aesar
    1592 2,5-dichloro-3c1c(cc(c(c1C(= 220 6685 http://www.aAlfa Aesar
    1593 2,5-dichloro-4c1c(c(cc(c1Cl) 155 21626 http://www.aAlfa Aesar
    1594 2',5'-dichloro CC(=O)CC(=O)N 95 67453 http://www.aAlfa Aesar
    1595 2',5'-dichlor CC(=O)c1cc(cc 12 68111 http://www.aAlfa Aesar
    1596 2,5-dichloroanc1cc(c(cc1Cl)N 50 13869655 http://www.aAlfa Aesar
    1597 2,5-dichlorob c1cc(c(cc1Cl) 56 21111840 http://www.aAlfa Aesar
    1598 2,5-dichlorob c1cc(c(cc1Cl) 160 20923 http://www.aAlfa Aesar
    1599 2,5-dichlorob B(c1cc(ccc1Cl 213 2053789 http://www.aAlfa Aesar
    1600 2,5-dichlorob c1cc(c(cc1Cl)S 38 71720 http://www.aAlfa Aesar
    1601 2,5-dichlorob c1cc(c(cc1Cl) 180 127250 http://www.aAlfa Aesar
    1602 2,5-dichlorobec1cc(c(cc1Cl) 153 10801689 http://www.aAlfa Aesar
    1603 2,5-dichlorobec1cc(c(cc1Cl) 130 80307 http://www.aAlfa Aesar
    1604 2,5-dichlorobec1cc(c(cc1Cl)C 78 105999 http://www.aAlfa Aesar
    1605 2,5-dichlorob c1cc(c(cc1Cl)C 41 2736032 http://www.aAlfa Aesar
    1606 2,5-dichloroh c1c(c(cc(c1Cl) 170 64 http://www.aAlfa Aesar
    1607 2,5-dichlorop c1cc(c(cc1Cl)O 57 65 http://www.aAlfa Aesar
    1608 2,5-dichlorop c1cc(c(cc1Cl) 30 71679 http://www.aAlfa Aesar
    1609 2,5-dichlorop c1cc(c(cc1Cl) 104 8998 http://www.aAlfa Aesar
    1610 2,5-dichloro-pCc1cc(c(cc1Cl) 69 13868642 http://www.aAlfa Aesar
    1611 2,5-dichloropyc1cc(ncc1Cl)Cl 61 25757 http://www.aAlfa Aesar
    1612 2,5-dichloropyB(c1cc(cnc1Cl 154 11179869 http://www. Alfa Aesar
    1613 2,5-dichlorot c1cc(sc1Cl)Cl -41 17474 http://www.aAlfa Aesar
    1614 2,5-dichlorothc1c(c(sc1Cl)C 148 195975 http://www.aAlfa Aesar
    1615 2,5-dichlorot Cc1cc(ccc1Cl)C 5 27492 http://www.aAlfa Aesar
    1616 2,5-diethoxyanCCOc1ccc(c(c 85 60122 http://www.aAlfa Aesar
    1617 2',5'-diethoxy CCOc1ccc(c(c 88 60066 http://www.aAlfa Aesar
    1618 2,5-difluoro- c1c(c(cc(c1F) 147 10724054 http://www. Alfa Aesar
    1619 2,5-difluoro- COc1cc(c(cc1F 99 3081972 http://www. Alfa Aesar
    1620 2,5-difluoro- COc1cc(c(cc1F 91 3059039 http://www. Alfa Aesar
    1621 2,5-difluoroanc1cc(c(cc1F)N 14 61094 http://www.aAlfa Aesar
    1622 2,5-difluorob c1cc(c(cc1F)C 112 456068 http://www.aAlfa Aesar
    1623 2,5-difluorob c1cc(c(cc1F)S 141 130327 http://www. Alfa Aesar
    1624 2,5-difluorobec1cc(c(cc1F)C 130 68816 http://www.aAlfa Aesar
    1625 2,5-difluorobec1cc(c(cc1F)C 33 110152 http://www.aAlfa Aesar
    1626 2,5-difluoroci c1cc(c(cc1F)/ 139 2015101 http://www.aAlfa Aesar
    1627 2,5-difluoromac1cc(c(cc1F)C 111 511697 http://www.aAlfa Aesar
    1628 2,5-difluorop c1cc(c(cc1F)O 38 85674 http://www.aAlfa Aesar
    1629 2,5-difluorophc1cc(c(cc1F)C 125 456060 http://www.aAlfa Aesar
    1630 2,5-difluorop c1cc(c(cc1F)N 75 511968 http://www.aAlfa Aesar
    1631 2,5-difluorotoCc1cc(ccc1F)F -35 61295 http://www.aAlfa Aesar
    1632 2,5-dihydro-3 CC1=CCS(=O)( 63 64103 http://www.aAlfa Aesar
    1633 2',5'-dihydro CC(=O)c1cc(c 206 9859 http://www.aAlfa Aesar
    1634 2,5-dihydroxyc1cc(c(cc1O) 99 64111 http://www.aAlfa Aesar
    1635 2',5'-dihydro CCC(=O)c1cc( 98 63495 http://www.aAlfa Aesar
    1636 2,5-diiodopyric1cc(ncc1I)I 155 3453478 http://www.aAlfa Aesar
    1637 2,5-diiodothi c1cc(sc1I)I 41 62577 http://www.aAlfa Aesar
    1638 2',5'-dimeth CC(=O)c1cc(c 19 64152 http://www.aAlfa Aesar
    1639 2,5-dimethoxyCOc1ccc(c(c1 80 13869661 http://www.aAlfa Aesar
    1640 2,5-dimethox COc1ccc(c(c1 49 60092 http://www.aAlfa Aesar
    1641 2,5-dimethoxyB(c1cc(ccc1O 93 2016094 http://www.aAlfa Aesar
    1642 2,5-dimethox COc1ccc(c(c1 147 181123 http://www.aAlfa Aesar
    1643 2,5-dimethoxyCOc1ccc(c(c1) 114 120739 http://www.aAlfa Aesar
    1644 2,5-dimethoxyCOc1ccc(c(c1 77 68524 http://www.aAlfa Aesar
    1645 2,5-dimethoxyCOc1ccc(c(c1 82 71525 http://www.aAlfa Aesar
    1646 2,5-dimethoxyCOc1ccc(c(c1 40 3389558 http://www.aAlfa Aesar
    1647 2,5-dimethoxyCOc1ccc(c(c1 36 125682 http://www.aAlfa Aesar
    1648 2,5-dimethoxyCOc1ccc(c(c1 124 67055 http://www. Alfa Aesar
    1649 2,5-dimethoxyCc1cc(ccc1OC 20 81759 http://www.aAlfa Aesar
    1650 2,5-dimethyl-1Cc1nnc(s1)C 63 87514 http://www.aAlfa Aesar
    1651 2,5-dimethyl- CC(=C)CCC(=C -75 11818 http://www.aAlfa Aesar
    1652 2,5-dimethyl- Cc1ccc(n1c2cc 50 59889 http://www.aAlfa Aesar
    1653 2,5-dimethyl- Cc1cc(c(n1c2c 89 59886 http://www.aAlfa Aesar
    1654 2,5-dimethyl- CC(=CC=C(C)C 12 12451 http://www.aAlfa Aesar
    1655 2,5-dimethyl- CC(=CC=C(C)C 221 124096 http://www.aAlfa Aesar
    1656 2,5-dimethyl- CC(C)(CCC(C)( 89 7740 http://www.aAlfa Aesar
    1657 2,5-dimethyl-3Cc1cc(c(o1)C) 20 2016548 http://www.aAlfa Aesar
    1658 2,5-dimethyl- Cc1c(nc(s1)C) 28 4207021 http://www. Alfa Aesar
    1659 2,5-dimethylan
    Cc1ccc(c(c1)N 15 13869434 http://www.aAlfa Aesar
    1660 2,5-dimethylbB(c1cc(ccc1C) 180 2016099 http://www.aAlfa Aesar
    1661 2,5-dimethylbCc1ccc(c(c1)C 134 11399 http://www.aAlfa Aesar
    1662 2,5-dimethylbCc1ccc2c(c1)n 40 6957 http://www.aAlfa Aesar
    1663 2,5-dimethylbCc1ccc(c(c1)C 41 85332 http://www.aAlfa Aesar
    1664 2,5-dimethylcCc1ccc(c(c1)/ 130 5382589 http://www.aAlfa Aesar
    1665 2,5-dimethylf Cc1ccc(o1)C -62 11763 http://www.aAlfa Aesar
    1666 2,5-dimethylpCc1ccc(c(c1)O 76 13839128 http://www.aAlfa Aesar
    1667 2,5-dimethylpCc1ccc(c(c1) 115 73830 http://www.aAlfa Aesar
    1668 2,5-dimethylpCc1ccc(c(c1)C 128 75441 http://www.aAlfa Aesar
    1669 2,5-dimethylpCc1ccc(c(c1)C 28 25822 http://www.aAlfa Aesar
    1670 2,5-dimethylpCc1cnc(cn1)C 15 28992 http://www.aAlfa Aesar
    1671 2,5-dimethylpCc1cc(=O)n2c( 253 10825277 http://www.aAlfa Aesar
    1672 2,5-dimethylsCc1ccc(c(c1)C -35 15433 http://www.aAlfa Aesar
    1673 2,5-dimethylt Cc1ccc(s1)C -63 11998 http://www.aAlfa Aesar
    1674 2,5-diphenyl-1c1ccc(cc1)c2n 140 12355 http://www.aAlfa Aesar
    1675 2,5-diphenyl- c1ccc(cc1)C2C 240 344378 http://www.aAlfa Aesar
    1676 2,5-diphenylf c1ccc(cc1)c2c 88 63567 http://www.aAlfa Aesar
    1677 2,5-diphenyloc1ccc(cc1)c2c 72 6838 http://www.aAlfa Aesar
    1678 2,5-diphenyl- c1ccc(cc1)C2 217 63244 http://www.aAlfa Aesar
    1679 2,5-di-tert-b CC(C)(C)c1cc( 216 2283 http://www.aAlfa Aesar
    1680 2,5-di-tert-b CC(C)(C)C1=C 153 16245 http://www.aAlfa Aesar
    1681 2,5-hexanedi CC(=O)CCC(=O -6 7744 http://www.aAlfa Aesar
    1682 2,5-norbornadC1C2C=CC1C= -20 8160 http://www.aAlfa Aesar
    1683 2,6,6-trimeth CC1=CC(=O)CC 20 56162 http://www.aAlfa Aesar
    1684 2,6-bis(2,2,2- c1cc(c(c(c1)O 116 2017758 http://www.aAlfa Aesar
    1685 2,6-bis(hydro Cc1cc(c(c(c1) 123 6772 http://www.aAlfa Aesar
    1686 2,6-bis(p-tolylCc1ccc(cc1)c2 165 76166 http://www.aAlfa Aesar
    1687 2,6-bis(trifl B(c1c(cccc1C(F 150 2063382 http://www.aAlfa Aesar
    1688 2,6-bis(triflu c1cc(c(c(c1)C( 138 81818 http://www.aAlfa Aesar
    1689 2,6-bis(triflu c1cc(nc(c1)C(F 57 512764 http://www.aAlfa Aesar
    1690 2,6-diacetylpyCC(=O)c1cccc( 80 63955 http://www.aAlfa Aesar
    1691 2,6-diamino-3,c1c(c(nc(c1F) 160 8351704 http://www. Alfa Aesar
    1692 2,6-diamino-3-c1c(c(c(nc1N)N 71 5894966 http://www.aAlfa Aesar
    1693 2,6-diaminopuc1[nH]c2c(n1) 302 28738 http://www.aAlfa Aesar
    1694 2,6-diaminopyc1cc(nc(c1)N) 120 8528 http://www.aAlfa Aesar
    1695 2,6-diaminotoCc1c(cccc1N) 105 12650 http://www.aAlfa Aesar
    1696 2,6-dibenzyli c1ccc(cc1)C= 117 86033 http://www.aAlfa Aesar
    1697 2,6-dibenzyloxc1ccc(cc1)CO 123 2289680 http://www.aAlfa Aesar
    1698 2',6-dibromo-3c1cc(ncc1c2cc 191 21242367 http://www. Alfa Aesar
    1699 2,6-dibromo-4-
    c1c(cc(c(c1Br) 38 127533 http://www.aAlfa Aesar
    1700 2,6-dibromo-4c1c(cc(c(c1Br) 65 212316 http://www.aAlfa Aesar
    1701 2,6-dibromo-4c1c(cc(c(c1Br) 55 60973 http://www.aAlfa Aesar
    1702 2,6-dibromo-4c1c(cc(c(c1Br 44 3509886 http://www.aAlfa Aesar
    1703 2,6-dibromo-4CC(C)c1cc(c(c( 46 122765 http://www.aAlfa Aesar
    1704 2,6-dibromo-4Cc1cc(c(c(c1)B 74 73471 http://www.aAlfa Aesar
    1705 2,6-dibromo- Cc1cc(c(c(c1)B 50 16163 http://www.aAlfa Aesar
    1706 2,6-dibromo-4c1c(cc(c(c1Br) 207 12676 http://www.aAlfa Aesar
    1707 2,6-dibromo-4Cc1c(cc(cc1Br 56 5378809 http://www.aAlfa Aesar
    1708 2,6-dibromo-4CCCc1cc(c(c(c 56 2054801 http://www.aAlfa Aesar
    1709 2,6-dibromoanc1cc(c(c(c1)Br 81 21169503 http://www.aAlfa Aesar
    1710 2,6-dibromonc1cc(cc2c1cc( 165 555940 http://www.aAlfa Aesar
    1711 2,6-dibromopc1cc(c(c(c1)Br 55 11354 http://www.aAlfa Aesar
    1712 2,6-dibromopyc1cc(nc(c1)Br) 119 11771 http://www.aAlfa Aesar
    1713 2,6-dibromoquC1=C(C(=O)C( 80 10378 http://www.aAlfa Aesar
    1714 2,6-dibromot Cc1c(cccc1Br) 4 31916 http://www.aAlfa Aesar
    1715 2,6-dichloro- C1=C(C(=O)C( 123 12246 http://www. Alfa Aesar
    1716 2,6-dichloro- Cc1cc(nc(c1C# 110 63319 http://www.aAlfa Aesar
    1717 2,6-dichloro-3c1c(c(nc(c1F)C 91 2015614 http://www. Alfa Aesar
    1718 2,6-dichloro-3c1cc(c(c(c1[N+ 108 3660595 http://www.aAlfa Aesar
    1719 2,6-dichloro-3c1cc(nc(c1[N+] 64 76872 http://www.aAlfa Aesar
    1720 2,6-dichloro-3Cc1c(ccc(c1Cl) 54 87699 http://www.aAlfa Aesar
    1721 2,6-dichloro-4c1c(cc(c(c1Cl) 32 599726 http://www.aAlfa Aesar
    1722 2,6-dichloro-4c1c(cc(c(c1Cl) 152 16499416 http://www. Alfa Aesar
    1723 2,6-dichloro-4c1c(cc(c(c1Cl) 36 124456 http://www.aAlfa Aesar
    1724 2,6-dichloro-4c1c(cc(c(c1Cl) 48 2018523 http://www.aAlfa Aesar
    1725 2,6-dichloro-4c1c(cc(c(c1Cl) 59 599703 http://www.aAlfa Aesar
    1726 2,6-dichloro-4c1c(cc(c(c1Cl) 56 2054417 http://www.aAlfa Aesar
    1727 2,6-dichloro- c1c(cc(c(c1Cl) 49 85672 http://www.aAlfa Aesar
    1728 2,6-dichloro- c1c(cc(c(c1Cl 228 460493 http://www. Alfa Aesar
    1729 2,6-dichloro-4c1c(cc(nc1Cl)C 163 9912100 http://www. Alfa Aesar
    1730 2,6-dichloro-4c1c(cc(c(c1Cl) 189 7152 http://www.aAlfa Aesar
    1731 2,6-dichloro-4c1c(cc(nc1Cl)C 96 3066636 http://www. Alfa Aesar
    1732 2,6-dichloro-4c1c(cc([n+](c1 178 2064658 http://www. Alfa Aesar
    1733 2,6-dichloro-5c1c(c(nc(c1F)C 154 2015436 http://www.aAlfa Aesar
    1734 2',6'-dichloro CC(=O)Nc1c(cc 181 26692 http://www.aAlfa Aesar
    1735 2',6'-dichlor CC(=O)c1c(ccc 43 67440 http://www.aAlfa Aesar
    1736 2,6-dichloroanc1cc(c(c(c1)Cl 39 11353 http://www.aAlfa Aesar
    1737 2,6-dichloroanCOc1c(cccc1Cl 10 15311 http://www.aAlfa Aesar
    1738 2,6-dichlorob c1cc(c(c(c1)Cl 71 6481 http://www.aAlfa Aesar
    1739 2,6-dichlorob c1cc(c(c(c1)C 149 82466 http://www.aAlfa Aesar
    1740 2,6-dichlorob c1cc(c(c(c1)Cl 199 15359 http://www.aAlfa Aesar
    1741 2,6-dichlorob B(c1c(cccc1Cl 152 2016084 http://www.aAlfa Aesar
    1742 2,6-dichlorob c1cc(c(c(c1)Cl 53 455505 http://www.aAlfa Aesar
    1743 2,6-dichlorobec1cc(c(c(c1)Cl 143 5555 http://www.aAlfa Aesar
    1744 2,6-dichlorobec1cc(c(c(c1)Cl 145 2923 http://www.aAlfa Aesar
    1745 2,6-dichlorob c1cc2c(cc1Cl)s 96 69609 http://www.aAlfa Aesar
    1746 2,6-dichlorobec1cc(c(c(c1)Cl 17 70761 http://www.aAlfa Aesar
    1747 2,6-dichlorobec1cc(c(c(c1)Cl 97 25276 http://www.aAlfa Aesar
    1748 2,6-dichlorob c1cc(c(c(c1)Cl 56 28010 http://www.aAlfa Aesar
    1749 2,6-dichlorobec1cc(c(c(c1)Cl 38 67397 http://www.aAlfa Aesar
    1750 2,6-dichloro-bc1cc(c(c(c1)Cl 65 4520331 http://www.aAlfa Aesar
    1751 2,6-dichloronic1cc(nc(c1C(= 149 746430 http://www.aAlfa Aesar
    1752 2,6-dichlorop c1cc(c(c(c1)Cl 67 6633 http://www.aAlfa Aesar
    1753 2,6-dichlorop c1cc(c(c(c1)C 44 525527 http://www.aAlfa Aesar
    1754 2,6-dichlorop c1cc(c(c(c1)Cl 43 109852 http://www.aAlfa Aesar
    1755 2,6-dichlorop c1cc(c(c(c1)Cl 217 2665961 http://www.aAlfa Aesar
    1756 2,6-dichlorophc1cc(c(c(c1)Cl 160 73131 http://www.aAlfa Aesar
    1757 2,6-dichlorophc1cc(c(c(c1)Cl 76 69139 http://www.aAlfa Aesar
    1758 2,6-dichlorop c1c(nc(cn1)Cl) 54 70868 http://www.aAlfa Aesar
    1759 2,6-dichloropyc1cc(nc(c1)Cl) 86 16095 http://www.aAlfa Aesar
    1760 2,6-dichloropyc1cc([n+](c(c1 138 714340 http://www. Alfa Aesar
    1761 2,6-dichlorot c1cc(c(c(c1)Cl 151 2016563 http://www. Alfa Aesar
    1762 2,6-dichlorot Cc1c(cccc1Cl)C 2 8065 http://www.aAlfa Aesar
    1763 2,6-difluoro- c1cc(c(c(c1O) 112 516459 http://www. Alfa Aesar
    1764 2,6-difluoro- COc1ccc(c(c1F 72 3019491 http://www. Alfa Aesar
    1765 2,6-difluoro- COc1ccc(c(c1F 55 3025049 http://www. Alfa Aesar
    1766 2,6-difluoro- COc1ccc(c(c1F 75 2915352 http://www. Alfa Aesar
    1767 2,6-difluoro-3Cc1ccc(c(c1F) 140 2054550 http://www.aAlfa Aesar
    1768 2,6-difluoro-3c1cc(c(c(c1[N 53 2018681 http://www.aAlfa Aesar
    1769 2,6-difluoro- c1c(cc(c(c1F) 181 21393505 http://www. Alfa Aesar
    1770 2,6-difluoro- c1c(cc(c(c1F)O 72 24603051 http://www. Alfa Aesar
    1771 2,6-difluoro- COc1cc(c(c(c1 39 4357711 http://www. Alfa Aesar
    1772 2,6-difluoro- COc1cc(c(c(c1 75 2935333 http://www. Alfa Aesar
    1773 2,6-difluoro- COc1cc(c(c(c1 184 2058487 http://www. Alfa Aesar
    1774 2,6-difluoro- COc1cc(c(c(c1 55 2059015 http://www. Alfa Aesar
    1775 2,6-difluoro- COc1cc(c(c(c1 45 2600509 http://www. Alfa Aesar
    1776 2,6-difluoro- COc1cc(c(c(c1 69 2512047 http://www. Alfa Aesar
    1777 2,6-difluorob c1cc(c(c(c1)F 16 120058 http://www.aAlfa Aesar
    1778 2,6-difluorob c1cc(c(c(c1)F 147 78873 http://www.aAlfa Aesar
    1779 2,6-difluorob c1cc(c(c(c1)F 190 393676 http://www. Alfa Aesar
    1780 2,6-difluorobec1cc(c(c(c1)F 158 9413 http://www.aAlfa Aesar
    1781 2,6-difluorobec1cc(c(c(c1)F 30 67268 http://www.aAlfa Aesar
    1782 2,6-difluorob c1cc(c(c(c1)F) 51 505402 http://www.aAlfa Aesar
    1783 2,6-difluorobec1cc(c(c(c1)F) 34 505514 http://www.aAlfa Aesar
    1784 2,6-difluoroci c1cc(c(c(c1)F 125 4522575 http://www.aAlfa Aesar
    1785 2,6-difluoromac1cc(c(c(c1)F 144 511660 http://www.aAlfa Aesar
    1786 2,6-difluorop c1cc(c(c(c1)F) 38 85185 http://www.aAlfa Aesar
    1787 2,6-difluorophc1cc(c(c(c1)F 24 455488 http://www.aAlfa Aesar
    1788 2,6-difluorophc1cc(c(c(c1)F 101 110179 http://www.aAlfa Aesar
    1789 2,6-dihydroxyCc1cc(nc(c1)O 197 70764 http://www. Alfa Aesar
    1790 2',6'-dihydro CC(=O)c1c(cc 158 62888 http://www.aAlfa Aesar
    1791 2,6-dihydroxyc1cc(cc2c1cc( 224 84452 http://www.aAlfa Aesar
    1792 2,6-diiodo-4- c1c(cc(c(c1I)O 153 9002 http://www.aAlfa Aesar
    1793 2,6-diisopropyCC(C)c1cccc(c -54 13859730 http://www.aAlfa Aesar
    1794 2,6-diisoprop CC(C)c1ccc2cc 69 29899 http://www.aAlfa Aesar
    1795 2,6-diisoprop CC(C)c1cccc(c 18 4774 http://www.aAlfa Aesar
    1796 2,6-dimethoxyCOc1ccc(c(c1C 131 2342060 http://www.aAlfa Aesar
    1797 2,6-dimethox Cc1cc(c(c(c1 93 202207 http://www. Alfa Aesar
    1798 2,6-dimethox Cc1cc(c(c(c1) 39 210530 http://www.aAlfa Aesar
    1799 2',6'-dimeth CC(=O)c1c(cc 70 15435 http://www.aAlfa Aesar
    1800 2,6-dimethoxyCOc1cccc(c1N 77 86612 http://www. Alfa Aesar
    1801 2,6-dimethox COc1cccc(c1C 97 87027 http://www.aAlfa Aesar
    1802 2,6-dimethoxyB(c1c(cccc1O 107 2016095 http://www.aAlfa Aesar
    1803 2,6-dimethoxyCOc1cccc(c1C 65 67377 http://www.aAlfa Aesar
    1804 2,6-dimethox COc1cccc(c1C 85 2079594 http://www.aAlfa Aesar
    1805 2,6-dimethox COc1ccc2cc(c 153 71934 http://www. Alfa Aesar
    1806 2,6-dimethox COC1=CC(=O) 255 61560 http://www.aAlfa Aesar
    1807 2,6-dimethox COc1cccc(c1O 54 6774 http://www.aAlfa Aesar
    1808 2,6-dimethoxyCOc1cccc(c1O 81 281700 http://www. Alfa Aesar
    1809 2,6-dimethoxyB(c1ccc(nc1O 129 2043407 http://www.aAlfa Aesar
    1810 2,6-dimethoxyCc1c(cccc1OC 39 72054 http://www.aAlfa Aesar
    1811 2,6-dimethyl- CC(C)CCCC(C) -10 75130 http://www.aAlfa Aesar
    1812 2,6-dimethyl- CC(C)CC(=O)C -42 7670 http://www.aAlfa Aesar
    1813 2,6-dimethyl- Cc1cc(cc(c1O) 97 482900 http://www.aAlfa Aesar
    1814 2,6-dimethyl-4Cc1cc(cc(c1OC 87 123324 http://www. Alfa Aesar
    1815 2,6-dimethyl- Cc1cc(=O)cc(o 134 13262 http://www.aAlfa Aesar
    1816 2',6'-dimethylCc1cccc(c1NC 181 15753 http://www.aAlfa Aesar
    1817 2,6-dimethylan
    Cc1cccc(c1N)C 11 6630 http://www.aAlfa Aesar
    1818 2,6-dimethylbCc1cccc(c1C( 116 10295497 http://www.aAlfa Aesar
    1819 2,6-dimethylbCc1cccc(c1C# 90 73130 http://www.aAlfa Aesar
    1820 2,6-dimethyl- CC1=CC(=O)C= 70 61542 http://www.aAlfa Aesar
    1821 2,6-dimethylpCc1cccc(c1O) 46 13839174 http://www.aAlfa Aesar
    1822 2,6-dimethylpCc1cccc(c1[N+ 74 68508 http://www.aAlfa Aesar
    1823 2,6-dimethylpCc1cncc(n1)C 41 7650 http://www.aAlfa Aesar
    1824 2,6-dimethylqCc1ccc2c(c1)c 57 12840 http://www.aAlfa Aesar
    1825 2,6-dinitro-4- c1c(cc(c(c1[N 55 85673 http://www.aAlfa Aesar
    1826 2,6-dinitrobenc1cc(c(c(c1)[ 148 454200 http://www.aAlfa Aesar
    1827 2,6-dinitrotol Cc1c(cccc1[N+ 62 11320 http://www.aAlfa Aesar
    1828 2,6-diphenylpc1ccc(cc1)c2c 102 68038 http://www.aAlfa Aesar
    1829 2,6-diphenylpc1ccc(cc1)c2c 78 65752 http://www.aAlfa Aesar
    1830 2,6-di-tert-b CC(C)(C)c1cc( 91 59976 http://www.aAlfa Aesar
    1831 2,6-di-tert-bu CCc1cc(c(c(c1) 43 18924 http://www.aAlfa Aesar
    1832 2,6-di-tert-bu Cc1cc(c(c(c1)C 71 13835296 http://www.aAlfa Aesar
    1833 2,6-di-tert-bu Cc1cc(nc(c1)C( 33 89326 http://www.aAlfa Aesar
    1834 2,6-di-tert-b CC(C)(C)C1=C 67 12336 http://www.aAlfa Aesar
    1835 2,6-di-tert-bu CC(C)(C)c1ccc 37 29135 http://www.aAlfa Aesar
    1836 2,6-lutidine Cc1cccc(n1)C -7 13842613 http://www.aAlfa Aesar
    1837 2,6-pyridined c1cc(nc(c1)C 112 64119 http://www.aAlfa Aesar
    1838 2,7-diacetoxy CC(=O)Oc1ccc 131 691590 http://www.aAlfa Aesar
    1839 2,7-dibromo-9c1cc-2c(cc1Br 202 228145 http://www. Alfa Aesar
    1840 2,7-dibromoflc1cc-2c(cc1Br 166 123526 http://www.aAlfa Aesar
    1841 2,7-dihydroxyc1cc(cc2c1ccc 186 10919 http://www.aAlfa Aesar
    1842 2,7-dimethox COc1ccc2ccc( 138 69467 http://www. Alfa Aesar
    1843 2,7-dimethylnCc1ccc2ccc(cc 97 10918 http://www.aAlfa Aesar
    1844 2,7-dimethyloCC(C)CCCCC(C -55 13451 http://www.aAlfa Aesar
    1845 2,8-bis(triflu c1cc2c(cc(nc2c 132 643280 http://www.aAlfa Aesar
    1846 2-[bis(methyl CSC(=C(C#N)C 82 89647 http://www. Alfa Aesar
    1847 2-[dimethyl(p-Cc1ccc(cc1)[S 56 25027428 http://www. Alfa Aesar
    1848 2-[n,n-bis(tri c1cc(ncc1Cl)N 46 344376 http://www.aAlfa Aesar
    1849 2-[n,n-bis(tri c1ccnc(c1)N(S 39 465381 http://www.aAlfa Aesar
    1850 2-acetamido-5CC(=O)Nc1ccc 149 2016916 http://www.aAlfa Aesar
    1851 2-acetamido-5CC(=O)Nc1ccc 223 454389 http://www.aAlfa Aesar
    1852 2-acetamido- CC(=O)Nc1ccc 177 258677 http://www. Alfa Aesar
    1853 2-acetamido-5CC(=O)Nc1ncc( 210 3872134 http://www.aAlfa Aesar
    1854 2-acetamido-5CC(=O)Nc1ccc( 200 306078 http://www.aAlfa Aesar
    1855 2-acetamido-6CC(=O)Nc1ccc 217 79430 http://www.aAlfa Aesar
    1856 2-acetamidobeCC(=O)Nc1ccc 186 6705 http://www.aAlfa Aesar
    1857 2-acetamidopCC(=O)Nc1ccc 208 11477 http://www.aAlfa Aesar
    1858 2-acetamidothCC(=O)Nc1ncc 203 16659 http://www.aAlfa Aesar
    1859 2-acetoacetotCc1ccccc1NC( 105 6887 http://www.aAlfa Aesar
    1860 2'-acetoxyac CC(=O)c1cccc 90 15847 http://www.aAlfa Aesar
    1861 2-acetyl-1-na CC(=O)c1ccc2 99 62933 http://www.aAlfa Aesar
    1862 2-acetyl-3,6-dCC(=O)c1c(ccc 86 2049917 http://www. Alfa Aesar
    1863 2-acetyl-3-amCC(=O)c1c(cc( 121 2086295 http://www.aAlfa Aesar
    1864 2-acetyl-3-amCC(=O)c1c(ccs 86 2016929 http://www.aAlfa Aesar
    1865 2-acetyl-3-br CC(=O)c1c(ccs 43 2045172 http://www.aAlfa Aesar
    1866 2-acetyl-3-meCc1c2ccccc2s 78 453232 http://www.aAlfa Aesar
    1867 2-acetyl-5-br CC(=O)c1ccc(s 95 71655 http://www.aAlfa Aesar
    1868 2-acetyl-5-ch CC(=O)c1ccc(s 46 72763 http://www.aAlfa Aesar
    1869 2-acetyl-5-io CC(=O)c1ccc(s 128 87183 http://www.aAlfa Aesar
    1870 2-acetyl-5-meCc1ccc(s1)C(= 26 75479 http://www.aAlfa Aesar
    1871 2-acetyl-5-ni CC(=O)c1cc2cc 175 453597 http://www.aAlfa Aesar
    1872 2-acetyl-5-ni CC(=O)c1ccc(s 106 35097 http://www.aAlfa Aesar
    1873 2-acetyl-6-meCC(=O)c1ccc2 108 69913 http://www.aAlfa Aesar
    1874 2-acetyl-7-meCC(=O)c1cc2c 93 36022 http://www.aAlfa Aesar
    1875 2-acetylanthr CC(=O)c1ccc2 190 4347393 http://www.aAlfa Aesar
    1876 2-acetylbenzoCC(=O)c1cc2c 71 14690 http://www.aAlfa Aesar
    1877 2-acetylbenzoCC(=O)c1cc2c 87 81059 http://www.aAlfa Aesar
    1878 2-acetylbenzoiCC(=O)c1cccc 117 61749 http://www.aAlfa Aesar
    1879 2-acetylfluor CC(=O)c1ccc-2 130 63103 http://www.aAlfa Aesar
    1880 2-acetylfuran CC(=O)c1ccco 29 13849 http://www.aAlfa Aesar
    1881 2-acetylnaphtCC(=O)c1ccc2 54 6855 http://www.aAlfa Aesar
    1882 2-acetylpyraz CC(=O)c1cncc 77 28682 http://www.aAlfa Aesar
    1883 2-acetylpyridiCC(=O)c1cccc 9 13648 http://www.aAlfa Aesar
    1884 2-acetylpyrrolCC(=O)c1ccc[ 90 13459 http://www.aAlfa Aesar
    1885 2-acetylquinoCC(=O)c1cnc2 78 9280950 http://www. Alfa Aesar
    1886 2-acetylthiop CC(=O)c1cccs 10 6654 http://www.aAlfa Aesar
    1887 2-adamantanoC1C2CC3CC1C 301 57723 http://www.aAlfa Aesar
    1888 2-allyl-4,6-di C=CCc1c(c(cc( 161 5373917 http://www.aAlfa Aesar
    1889 2-allylphenol C=CCc1ccccc1 -6 14864 http://www.aAlfa Aesar
    1890 2-amino-1,3,4c1nnc(s1)N 191 18755 http://www.aAlfa Aesar
    1891 2-amino-1,3-pC(C(CO)N)O 54 61591 http://www.aAlfa Aesar
    1892 2-amino-1-butCCC(CO)N -2 20788 http://www.aAlfa Aesar
    1893 2-amino-1-pr CC(CO)N 8 4945 http://www.aAlfa Aesar
    1894 2-amino-2',5- c1ccc(c(c1)C( 88 17070 http://www.aAlfa Aesar
    1895 2-amino-2-metCC(C)(CO)N 26 13835861 http://www.aAlfa Aesar
    1896 2-amino-2-thiC1CSC(=N1)N 80 14923 http://www.aAlfa Aesar
    1897 2-amino-3-(tr c1cc(c(c(c1)C( 155 525554 http://www.aAlfa Aesar
    1898 2-amino-3,4,5COc1cc(c(c(c 139 87213 http://www.aAlfa Aesar
    1899 2-amino-3,5-dCc1c(cc(c(n1) 145 456205 http://www.aAlfa Aesar
    1900 2-amino-3,5-dc1c(cc(c(c1C( 233 190263 http://www.aAlfa Aesar
    1901 2-amino-3,5-dc1c(nc(c(n1)N 116 538806 http://www. Alfa Aesar
    1902 2-amino-3,5-dc1c(cnc(c1Br) 104 89283 http://www.aAlfa Aesar
    1903 2-amino-3,5-dc1c(cc(c(c1C( 226 68531 http://www.aAlfa Aesar
    1904 2-amino-3,5-dc1c(cnc(c1Cl)N 82 70278 http://www.aAlfa Aesar
    1905 2-amino-3,5-dc1c(cnc(c1F)N 57 2063381 http://www.aAlfa Aesar
    1906 2-amino-3,5-dCc1cc(c(c(c1) 192 228067 http://www.aAlfa Aesar
    1907 2-amino-3,6-dc1cc(c(c(c1Cl 152 525531 http://www.aAlfa Aesar
    1908 2-amino-3,6-dic1c(c(c(nc1F)N 67 2062953 http://www.aAlfa Aesar
    1909 2-amino-3-benc1ccc(cc1)CO 93 81554 http://www.aAlfa Aesar
    1910 2-amino-3-broc1c(cnc(c1Br)N 100 10809898 http://www. Alfa Aesar
    1911 2-amino-3-broc1c(cnc(c1Br) 84 2044650 http://www. Alfa Aesar
    1912 2-amino-3-broCc1cc(c(c(c1) 204 2054799 http://www.aAlfa Aesar
    1913 2-amino-3-br Cc1cc(c(nc1)N 72 453034 http://www.aAlfa Aesar
    1914 2-amino-3-broc1c(cc(c(c1C# 188 78637 http://www.aAlfa Aesar
    1915 2-amino-3-br c1cc(c(nc1)N) 66 714367 http://www.aAlfa Aesar
    1916 2-amino-3-chlc1cc(c(c(c1)C 95 10508175 http://www. Alfa Aesar
    1917 2-amino-3-chlc1cnc(c(n1)N) 169 243075 http://www. Alfa Aesar
    1918 2-amino-3-chlc1cc(c(nc1)N) 61 604083 http://www. Alfa Aesar
    1919 2-amino-3-cyac1cc(c(nc1)N) 134 714889 http://www.aAlfa Aesar
    1920 2-amino-3-ethCCc1ccc(nc1N 47 2284275 http://www.aAlfa Aesar
    1921 2-amino-3-fluoc1c(cnc(c1F)N) 66 21429357 http://www. Alfa Aesar
    1922 2-amino-3-fluc1cc(c(nc1)N) 41 2043507 http://www. Alfa Aesar
    1923 2-amino-3-hydc1cc(c(nc1)N) 170 26152 http://www.aAlfa Aesar
    1924 2-amino-3-iodCc1cc(c(nc1)N 88 21242468 http://www. Alfa Aesar
    1925 2-amino-3-iodc1cc(c(nc1)N)I 90 2043841 http://www. Alfa Aesar
    1926 2-amino-3-metCc1cc(cnc1N)[ 260 2016198 http://www.aAlfa Aesar
    1927 2-amino-3-metCc1cccc(c1N) 176 70478 http://www.aAlfa Aesar
    1928 2-amino-3-metCc1cccnc1N 31 14608 http://www.aAlfa Aesar
    1929 2-amino-3-nitc1cc(c(c(c1)[ 211 190402 http://www. Alfa Aesar
    1930 2-amino-3-nitc1cc(c(nc1)N) 166 70279 http://www.aAlfa Aesar
    1931 2-amino-4-(1-c1ccc2c(c1)cc 157 133380 http://www.aAlfa Aesar
    1932 2-amino-4-(2-c1ccc2cc(ccc2 155 586588 http://www.aAlfa Aesar
    1933 2-amino-4-(4-c1cc(ccc1c2cs 184 539361 http://www.aAlfa Aesar
    1934 2-amino-4-(4-c1cc(ccc1c2cs 169 65995 http://www.aAlfa Aesar
    1935 2-amino-4-(p-tCc1ccc(cc1)c2 137 213410 http://www.aAlfa Aesar
    1936 2-amino-4-(tr c1cnc(cc1C(F) 73 2058573 http://www.aAlfa Aesar
    1937 2-amino-4,5,6C1CCc2c(c(c(s 143 70751 http://www. Alfa Aesar
    1938 2-amino-4,5-dc1c(c(cc(c1F) 182 643108 http://www.aAlfa Aesar
    1939 2'-amino-4',5 CC(=O)c1cc(c 106 523409 http://www.aAlfa Aesar
    1940 2-amino-4,5-dCOc1cc(c(cc1 99 643110 http://www.aAlfa Aesar
    1941 2-amino-4,6-dc1c(nc(nc1Cl) 220 58968 http://www.aAlfa Aesar
    1942 2-amino-4,6-dC(=O)c1c(nc(n 220 233350 http://www. Alfa Aesar
    1943 2-amino-4,6-dCOc1cc(nc(n1 95 106290 http://www.aAlfa Aesar
    1944 2-amino-4,6-dCc1cc(nc(n1)N 153 12480 http://www.aAlfa Aesar
    1945 2-amino-4-br c1cnc(cc1Br)N 146 604094 http://www. Alfa Aesar
    1946 2-amino-4-chlCC(C)c1cc(nc( 100 2054031 http://www. Alfa Aesar
    1947 2-amino-4-chlCc1cc(nc(n1)N 184 20500 http://www.aAlfa Aesar
    1948 2-amino-4-chlc1cc(c(cc1Cl) 161 148708 http://www.aAlfa Aesar
    1949 2-amino-4-chlc1cc2c(c(c1)Cl 204 27756 http://www.aAlfa Aesar
    1950 2-amino-4-chlc1cc(c(cc1Cl) 140 6995 http://www.aAlfa Aesar
    1951 2-amino-4-cyac1cnc(cc1C#N 150 5378572 http://www.aAlfa Aesar
    1952 2-amino-4-ethCCc1ccnc(c1) 67 105844 http://www.aAlfa Aesar
    1953 2-amino-4-fluc1cc(c(cc1F)N 194 2007081 http://www.aAlfa Aesar
    1954 2-amino-4-fluc1cc(c(cc1F)N 140 2017599 http://www. Alfa Aesar
    1955 2-amino-4-hydc1c(nc(nc1O)N 290 203961 http://www.aAlfa Aesar
    1956 2-amino-4-metCOc1nc(nc(n1 201 32251 http://www.aAlfa Aesar
    1957 2-amino-4-meCc1cc(nc(n1) 161 510436 http://www.aAlfa Aesar
    1958 2-amino-4-meCOc1cccc2c1n 156 20321 http://www.aAlfa Aesar
    1959 2-amino-4-metCc1ccnc(c1[N+ 136 212572 http://www.aAlfa Aesar
    1960 2-amino-4-metCc1cc(ncc1[N+ 224 212571 http://www.aAlfa Aesar
    1961 2-amino-4-metCc1ccc(c(c1)N 92 2079989 http://www.aAlfa Aesar
    1962 2-amino-4-metCc1cccc2c1nc 138 14403 http://www.aAlfa Aesar
    1963 2-amino-4-meCc1ccc(c(c1)N 136 6994 http://www.aAlfa Aesar
    1964 2-amino-4-metCc1ccnc(c1)N 99 1479 http://www.aAlfa Aesar
    1965 2-amino-4-metCc1ccnc(n1)N 160 7651 http://www.aAlfa Aesar
    1966 2-amino-4-metCc1csc(n1)N 44 66754 http://www.aAlfa Aesar
    1967 2-amino-4-meCc1csc(c1C(= 174 259355 http://www.aAlfa Aesar
    1968 2-amino-4-nitc1cc(c(cc1[N+ 143 2848685 http://www.aAlfa Aesar
    1969 2-amino-4-phec1ccc(cc1)c2c 150 36822 http://www.aAlfa Aesar
    1970 2-amino-4-terCC(C)(C)c1ccc 163 64143 http://www.aAlfa Aesar
    1971 2-amino-4-tertCC(C)(C)c1csc 101 2015958 http://www.aAlfa Aesar
    1972 2-amino-5-(4-p
    c1cnccc1c2nn 245 108254 http://www. Alfa Aesar
    1973 2-amino-5-(tr c1cc(ncc1C(F) 47 643016 http://www.aAlfa Aesar
    1974 2-amino-5,6-dC1Cc2c(sc(c2 154 226542 http://www. Alfa Aesar
    1975 2-amino-5-broCc1c(c(ncc1Br 134 5373880 http://www.aAlfa Aesar
    1976 2-amino-5-br Cc1cc(cnc1N)B 92 121582 http://www.aAlfa Aesar
    1977 2-amino-5-broc1c(cnc(c1[N+ 208 122478 http://www.aAlfa Aesar
    1978 2-amino-5-br Cc1cc(ncc1Br) 150 714362 http://www.aAlfa Aesar
    1979 2-amino-5-br c1c(ncc(n1)Br 115 521210 http://www. Alfa Aesar
    1980 2-amino-5-br c1cc(ncc1Br)N 138 63790 http://www.aAlfa Aesar
    1981 2-amino-5-br c1c(cnc(n1)N) 233 201527 http://www. Alfa Aesar
    1982 2-amino-5-chlc1ccc(c(c1)C( 95 63107 http://www.aAlfa Aesar
    1983 2-amino-5-chlc1c(cnc(c1F)N 96 9840165 http://www. Alfa Aesar
    1984 2-amino-5-chlc1c(cnc(c1I)N) 97 9251159 http://www. Alfa Aesar
    1985 2-amino-5-chlc1c(cnc(c1[N+ 193 194763 http://www.aAlfa Aesar
    1986 2-amino-5-ch c1cc(c(cc1Cl) 72 2054307 http://www.aAlfa Aesar
    1987 2-amino-5-ch c1cc(c(cc1Cl) 171 71211 http://www.aAlfa Aesar
    1988 2-amino-5-ch c1cc(c(cc1Cl) 149 13594575 http://www.aAlfa Aesar
    1989 2-amino-5-chlc1cc(c(cc1Cl) 96 72274 http://www.aAlfa Aesar
    1990 2-amino-5-ch c1ccc(cc1)C(= 98 12339 http://www.aAlfa Aesar
    1991 2-amino-5-chlc1cc(c(cc1Cl) 108 510021 http://www. Alfa Aesar
    1992 2-amino-5-chlc1cc(ncc1Cl)N 137 59561 http://www.aAlfa Aesar
    1993 2-amino-5-chlc1c(cnc(n1)N) 235 71792 http://www.aAlfa Aesar
    1994 2-amino-5-cyac1cc(ncc1C#N 162 714890 http://www.aAlfa Aesar
    1995 2-amino-5-cycC1CC1c2nnc(s 214 625671 http://www.aAlfa Aesar
    1996 2-amino-5-ethy
    CCc1nnc(s1)N 200 24633 http://www.aAlfa Aesar
    1997 2-amino-5-ethy
    CCSc1nnc(s1) 132 91679 http://www.aAlfa Aesar
    1998 2-amino-5-fluc1cc(c(cc1F)C 183 91637 http://www.aAlfa Aesar
    1999 2-amino-5-fluc1cc(c(cc1F)O 138 161483 http://www. Alfa Aesar
    2000 2-amino-5-fluc1cc(ncc1F)N 95 2019333 http://www.aAlfa Aesar
    2001 2-amino-5-iodc1cc(ncc1I)N 128 79922 http://www.aAlfa Aesar
    2002 2-amino-5-iodc1c(cnc(n1)N) 219 210698 http://www.aAlfa Aesar
    2003 2-amino-5-metCOc1ccc(c(c1 151 244660 http://www.aAlfa Aesar
    2004 2-amino-5-metCc1c(nc(s1)N) 110 86773 http://www. Alfa Aesar
    2005 2-amino-5-meCc1ccc(c(c1)O 157 68571 http://www.aAlfa Aesar
    2006 2-amino-5-metCc1ccc(nc1)N 76 14609 http://www.aAlfa Aesar
    2007 2-amino-5-metCc1cnc(s1)N 97 312333 http://www.aAlfa Aesar
    2008 2-amino-5-nitc1cc(c(cc1[N+ 209 26545 http://www.aAlfa Aesar
    2009 2-amino-5-ni c1ccc(cc1)C(= 167 14916 http://www.aAlfa Aesar
    2010 2-amino-5-nitc1cc(ncc1[N+] 188 70280 http://www.aAlfa Aesar
    2011 2-amino-5-nitc1c(cnc(n1)N) 237 68960 http://www.aAlfa Aesar
    2012 2-amino-5-n-pCCCS(=O)(=O)c 221 79502 http://www.aAlfa Aesar
    2013 2-amino-5-phec1ccc(cc1)c2c 135 94822 http://www. Alfa Aesar
    2014 2-amino-5-tertCC(C)(C)c1nnc 183 148794 http://www.aAlfa Aesar
    2015 2-amino-5-trifc1(nnc(s1)N)C( 225 74571 http://www.aAlfa Aesar
    2016 2-amino-6-(tr c1cc(nc(c1)N)C 88 717331 http://www.aAlfa Aesar
    2017 2-amino-6-br c1cc(nc(c1)Br 90 265823 http://www. Alfa Aesar
    2018 2-amino-6-chlc1cc(c(c(c1)C 151 67623 http://www.aAlfa Aesar
    2019 2-amino-6-chlc1cc(c(c(c1)C 135 73129 http://www.aAlfa Aesar
    2020 2-amino-6-chlc1cc2c(cc1Cl) 200 6956 http://www. Alfa Aesar
    2021 2-amino-6-chlc1cc(nc(c1)Cl 71 178702 http://www.aAlfa Aesar
    2022 2-amino-6-ethCCOc1ccc2c(c 162 6924 http://www.aAlfa Aesar
    2023 2-amino-6-fluc1cc(c(c(c1)F 166 454576 http://www.aAlfa Aesar
    2024 2-amino-6-fluc1cc(c(c(c1)F 127 455918 http://www.aAlfa Aesar
    2025 2-amino-6-fluc1cc2c(cc1F)s 184 283242 http://www.aAlfa Aesar
    2026 2-amino-6-fluc1cc(nc(c1)F) 60 2042129 http://www. Alfa Aesar
    2027 2-amino-6-metCOc1ccc(c(n1) 171 3077533 http://www. Alfa Aesar
    2028 2-amino-6-meCOc1ccc2c(c1) 163 14869 http://www.aAlfa Aesar
    2029 2-amino-6-metCc1ccc2c(c1)s 141 16405 http://www.aAlfa Aesar
    2030 2-amino-6-metCc1cccc(n1)N 43 14991 http://www.aAlfa Aesar
    2031 2-amino-6-nitc1cc2c(cc1[N+ 248 21284 http://www.aAlfa Aesar
    2032 2'-aminoacetaCC(=O)Nc1ccc 135 10676 http://www. Alfa Aesar
    2033 2-aminoanthrc1ccc2cc3cc(c 237 11443 http://www.aAlfa Aesar
    2034 2-aminobenzac1ccc(c(c1)C( 112 10298355 http://www.aAlfa Aesar
    2035 2-aminobenzan
    c1ccc(cc1)NC 132 70518 http://www.aAlfa Aesar
    2036 2-aminobenzeB(c1ccccc1N) 189 2053640 http://www.aAlfa Aesar
    2037 2-aminobenzec1ccc(c(c1)N) 155 65726 http://www.aAlfa Aesar
    2038 2-aminobenzhc1ccc(c(c1)C( 123 85476 http://www.aAlfa Aesar
    2039 2-aminobenzic1ccc2c(c1)[n 230 13035 http://www.aAlfa Aesar
    2040 2-aminobenzon
    c1ccc(c(c1)C# 47 65745 http://www.aAlfa Aesar
    2041 2-aminobenz c1ccc(cc1)C(= 107 68569 http://www.aAlfa Aesar
    2042 2-aminobenzoc1ccc2c(c1)nc 128 8382 http://www.aAlfa Aesar
    2043 2-aminobenzylc1ccc(c(c1)CO 83 20149 http://www.aAlfa Aesar
    2044 2-aminobiphec1ccc(cc1)c2c 50 6748 http://www.aAlfa Aesar
    2045 2-aminobutanCCC(C)N -104 23255 http://www.aAlfa Aesar
    2046 2-aminoethyl B(c1ccccc1)(c 189 1540 http://www.aAlfa Aesar
    2047 2-aminofluor c1ccc-2c(c1)C 128 1484 http://www.aAlfa Aesar
    2048 2-aminophenoc1ccc(c(c1)N) 175 5596 http://www.aAlfa Aesar
    2049 2-aminopyrazc1cnc(cn1)N 120 71088 http://www.aAlfa Aesar
    2050 2-aminopyridic1ccnc(c1)N 58 10008 http://www.aAlfa Aesar
    2051 2-aminopyridic1cc(c(nc1)N) 101 644660 http://www.aAlfa Aesar
    2052 2-aminopyridic1cnc(cc1C(= 258 312218 http://www.aAlfa Aesar
    2053 2-aminopyridic1cnc(cc1C(= 301 245055 http://www.aAlfa Aesar
    2054 2-aminopyrid c1cnc(cc1CO) 83 1246676 http://www.aAlfa Aesar
    2055 2-aminopyridic1cc(ncc1C(=S 174 3153071 http://www. Alfa Aesar
    2056 2-aminopyrimc1cnc(nc1)N 125 7690 http://www.aAlfa Aesar
    2057 2-aminothiazoc1csc(n1)N 90 2070 http://www.aAlfa Aesar
    2058 2-aminothiazolc1c(sc(n1)N)C 185 8233061 http://www. Alfa Aesar
    2059 2-anilino-4,6- c1ccc(cc1)Nc 173 655475 http://www.aAlfa Aesar
    2060 2-benzimidazoc1ccc2c(c1)[n 209 19265 http://www.aAlfa Aesar
    2061 2-benzothiazolc1ccc2c(c1)nc 101 303555 http://www.aAlfa Aesar
    2062 2-benzothiaz c1ccc2c(c1)nc 98 235671 http://www. Alfa Aesar
    2063 2-benzoxazolic1ccc2c(c1)[n 140 5820 http://www.aAlfa Aesar
    2064 2-benzoyl-1,3c1ccc(cc1)C( 108 85740 http://www.aAlfa Aesar
    2065 2-benzoylbenzc1ccc(cc1)C(= 129 6554 http://www.aAlfa Aesar
    2066 2-benzoylnap c1ccc(cc1)C(= 81 62721 http://www.aAlfa Aesar
    2067 2-benzoylpyri c1ccc(cc1)C(= 43 6771 http://www.aAlfa Aesar
    2068 2-benzoylthi c1ccc(cc1)C(= 56 60596 http://www.aAlfa Aesar
    2069 2-benzyl-4-ch c1ccc(cc1)Cc2 48 8118 http://www.aAlfa Aesar
    2070 2-benzylaminoc1ccc(cc1)CNc 95 21847 http://www.aAlfa Aesar
    2071 2-benzylcycl c1ccc(cc1)CC 29 89370 http://www.aAlfa Aesar
    2072 2-benzyliden c1ccc(cc1)C= 54 89352 http://www.aAlfa Aesar
    2073 2-benzyloxy-3c1ccc(cc1)COc 71 21107920 http://www. Alfa Aesar
    2074 2-benzyloxy- COc1cc(c(cc1 140 490135 http://www.aAlfa Aesar
    2075 2-benzyloxy-5c1ccc(cc1)COc 47 9283327 http://www. Alfa Aesar
    2076 2-benzyloxy-5c1ccc(cc1)COc 102 21242437 http://www. Alfa Aesar
    2077 2-benzyloxy-5B(c1cc(ccc1OC 119 2062811 http://www. Alfa Aesar
    2078 2-benzyloxy-5c1ccc(cc1)COc 92 21107919 http://www. Alfa Aesar
    2079 2-benzyloxyanc1ccc(cc1)CO 37 210181 http://www. Alfa Aesar
    2080 2-benzyloxyb c1ccc(cc1)CO 47 305749 http://www.aAlfa Aesar
    2081 2-benzyloxybeB(c1ccccc1OC 98 2053675 http://www.aAlfa Aesar
    2082 2-benzyloxybec1ccc(cc1)CO 77 1415125 http://www.aAlfa Aesar
    2083 2-benzyloxyphc1ccc(cc1)CO 97 453504 http://www.aAlfa Aesar
    2084 2-benzyloxyphc1ccc(cc1)CO 77 487876 http://www.aAlfa Aesar
    2085 2-benzyloxypyB(c1cccnc1OC 146 21242318 http://www. Alfa Aesar
    2086 2-benzylphenoc1ccc(cc1)Cc2 52 22638 http://www.aAlfa Aesar
    2087 2-benzylpyrid c1ccc(cc1)Cc2 10 7300 http://www.aAlfa Aesar
    2088 2-biphenylmec1ccc(cc1)c2c 49 68709 http://www.aAlfa Aesar
    2089 2-bromo-1,3,5c1c(cc(c(c1F)B 4 67931 http://www.aAlfa Aesar
    2090 2-bromo-1,3- c1cc(c(c(c1)Cl 61 27488 http://www.aAlfa Aesar
    2091 2-bromo-1,3- COc1cccc(c1B 93 532247 http://www.aAlfa Aesar
    2092 2-bromo-1,4- c1cc(c(cc1Cl)B 34 14309 http://www.aAlfa Aesar
    2093 2-bromo-1,4-dc1cc(c(cc1F)Br -31 61179 http://www.aAlfa Aesar
    2094 2-bromo-1-in c1ccc2c(c1)CC 130 86140 http://www.aAlfa Aesar
    2095 2-bromo-1-in c1ccc2c(c1)CC 38 120903 http://www.aAlfa Aesar
    2096 2-bromo-1-tric1ccc(cc1)C(c 205 537293 http://www. Alfa Aesar
    2097 2-bromo-2',3'C(C(=O)c1c(c(c 31 2056289 http://www.aAlfa Aesar
    2098 2-bromo-2',4 COc1ccc(c(c1 104 89124 http://www.aAlfa Aesar
    2099 2-bromo-2'-h c1ccc(c(c1)C( 46 173716 http://www.aAlfa Aesar
    2100 2-bromo-2'-mCOc1ccccc1C( 44 110036 http://www.aAlfa Aesar
    2101 2-bromo-2'-n c1ccc(c(c1)C( 55 213373 http://www. Alfa Aesar
    2102 2-bromo-2-nitC(C(CO)([N+]( 127 2356 http://www.aAlfa Aesar
    2103 2-bromo-3'-(t c1cc(cc(c1)C(F 22 2058642 http://www. Alfa Aesar
    2104 2-bromo-3-(trc1cc(c(nc1)Br) 38 4365407 http://www. Alfa Aesar
    2105 2-bromo-3',4'c1cc(c(cc1C(= 57 214055 http://www.aAlfa Aesar
    2106 2-bromo-3,5-bi
    c1c(cc(c(c1C(F 35 3511117 http://www. Alfa Aesar
    2107 2-bromo-3',5'CC(C)(C)c1cc( 106 535513 http://www. Alfa Aesar
    2108 2-bromo-3-chlc1cc(c(nc1)Br) 60 5379338 http://www.aAlfa Aesar
    2109 2-bromo-3-fluc1cc(c(c(c1)F 159 267469 http://www. Alfa Aesar
    2110 2-bromo-3-fluo
    CC(C)(C(C(=O) 54 280103 http://www. Alfa Aesar
    2111 2-bromo-3-hyd
    c1cc(c(nc1)Br 184 21591 http://www.aAlfa Aesar
    2112 2-bromo-3-iodCc1cc(c(nc1)Br 85 21242391 http://www. Alfa Aesar
    2113 2-bromo-3'-mCOc1cccc(c1) 62 91526 http://www.aAlfa Aesar
    2114 2-bromo-3-met
    Cc1cc(cnc1Br) 57 4371808 http://www.aAlfa Aesar
    2115 2-bromo-3'-n c1cc(cc(c1)[N 94 67758 http://www.aAlfa Aesar
    2116 2-bromo-3-nitc1cc(c(nc1)Br 124 482681 http://www.aAlfa Aesar
    2117 2-bromo-4'-(1c1cc(ccc1C(= 121 2914307 http://www.aAlfa Aesar
    2118 2-bromo-4'-(dCCN(CC)c1ccc( 51 2073913 http://www.aAlfa Aesar
    2119 2-bromo-4-(trc1cc(c(cc1C(F) 30 84751 http://www.aAlfa Aesar
    2120 2-bromo-4-(trc1cc(c(cc1C(F 162 2058654 http://www. Alfa Aesar
    2121 2-bromo-4,5-dCOc1cc(c(cc1 255 642982 http://www.aAlfa Aesar
    2122 2-bromo-4,6-dc1c(cc(c(c1Cl) 80 21168862 http://www.aAlfa Aesar
    2123 2-bromo-4,6-dc1c(cc(c(c1F)N 40 120059 http://www.aAlfa Aesar
    2124 2-bromo-4,6-dc1c(cc(c(c1F) 126 16812345 http://www. Alfa Aesar
    2125 2-bromo-4,6-dCc1cc(c(c(c1) 44 149132 http://www.aAlfa Aesar
    2126 2-bromo-4,6-dc1c(cc(c(c1[N 152 14979 http://www.aAlfa Aesar
    2127 2-bromo-4,6-dCC(C)(C)c1cc(c 57 453430 http://www.aAlfa Aesar
    2128 2-bromo-4'-c c1cc(ccc1C(=O 96 61599 http://www.aAlfa Aesar
    2129 2-bromo-4-chlc1cc(c(cc1Cl)B 66 63298 http://www.aAlfa Aesar
    2130 2-bromo-4-chc1cc(c(cc1Cl)B 33 62871 http://www.aAlfa Aesar
    2131 2-bromo-4-cy c1cnc(cc1C#N 72 9910251 http://www. Alfa Aesar
    2132 2-bromo-4-fluo
    c1c(c(cc(c1N)B 27 21168663 http://www. Alfa Aesar
    2133 2'-bromo-4'-flCC(=O)Nc1ccc( 118 599665 http://www.aAlfa Aesar
    2134 2-bromo-4'-f c1cc(ccc1C(=O 47 87353 http://www.aAlfa Aesar
    2135 2-bromo-4-fluc1cc(c(cc1F)B 168 1064837 http://www.aAlfa Aesar
    2136 2-bromo-4-fluc1cc(c(cc1F)B 76 106283 http://www.aAlfa Aesar
    2137 2-bromo-4-fluc1cc(c(cc1F)B 44 526306 http://www.aAlfa Aesar
    2138 2-bromo-4-iodc1cnc(cc1I)Br 61 901677 http://www.aAlfa Aesar
    2139 2-bromo-4'-mCOc1ccc(cc1) 70 4795 http://www.aAlfa Aesar
    2140 2-bromo-4-met
    COc1ccc(c(c1) 129 3184086 http://www. Alfa Aesar
    2141 2'-bromo-4'-mCc1ccc(c(c1)B 118 62414 http://www.aAlfa Aesar
    2142 2-bromo-4'-mCc1ccc(cc1)C( 52 62483 http://www.aAlfa Aesar
    2143 2-bromo-4-met
    Cc1ccc(c(c1)B 15 10942 http://www.aAlfa Aesar
    2144 2-bromo-4-meCc1ccc(c(c1)B 35 3835008 http://www. Alfa Aesar
    2145 2-bromo-4-meCc1ccc(c(c1)B 16 21627 http://www.aAlfa Aesar
    2146 2-bromo-4-nitCc1cc(c(c(c1[ 60 2037960 http://www.aAlfa Aesar
    2147 2-bromo-4'-n c1cc(ccc1C(=O 97 60204 http://www.aAlfa Aesar
    2148 2-bromo-4-nitCOc1ccc(cc1Br 106 71205 http://www.aAlfa Aesar
    2149 2-bromo-4-nitCCOc1ccc(cc1B 55 13734224 http://www.aAlfa Aesar
    2150 2-bromo-4-nitc1c[n+](c(cc1[ 145 3127338 http://www.aAlfa Aesar
    2151 2-bromo-4-nitCc1ccc(cc1Br) 76 74171 http://www.aAlfa Aesar
    2152 2-bromo-4'-p c1ccc(cc1)c2c 125 60614 http://www.aAlfa Aesar
    2153 2-bromo-4-pyc1cnc(cc1CO) 61 14325008 http://www.aAlfa Aesar
    2154 2-bromo-5-(trc1cc(c(cc1C(F) 72 2037012 http://www. Alfa Aesar
    2155 2-bromo-5-(trc1cc(c(cc1C(F 61 2063390 http://www.aAlfa Aesar
    2156 2-bromo-5-(trc1cc(ncc1C(F)( 46 2018101 http://www.aAlfa Aesar
    2157 2-bromo-5-chCc1c2cc(ccc2s 106 2017235 http://www.aAlfa Aesar
    2158 2-bromo-5-chlc1cc(c(cc1Cl) 154 80332 http://www.aAlfa Aesar
    2159 2-bromo-5-chlc1cc(c(cc1Cl)C 19 119948 http://www.aAlfa Aesar
    2160 2-bromo-5-fluc1cc(c(cc1F)N 44 2053738 http://www.aAlfa Aesar
    2161 2-bromo-5-fl c1cc(c(cc1F)C 54 2053742 http://www.aAlfa Aesar
    2162 2-bromo-5-fluc1cc(c(cc1F)C 155 2058440 http://www.aAlfa Aesar
    2163 2-bromo-5-fluc1cc(c(cc1F)C 90 84538 http://www.aAlfa Aesar
    2164 2-bromo-5-fluc1cc(c(cc1F)C 35 451922 http://www.aAlfa Aesar
    2165 2-bromo-5-fluc1cc(c(cc1F)/ 190 4647139 http://www.aAlfa Aesar
    2166 2-bromo-5-fluc1cc(ncc1F)Br 29 2063314 http://www.aAlfa Aesar
    2167 2-bromo-5-iodCc1cc(cnc1Br) 45 8284206 http://www. Alfa Aesar
    2168 2-bromo-5-iodCc1cc(ncc1I)B 51 21242424 http://www. Alfa Aesar
    2169 2-bromo-5-iodc1cc(c(cc1I)C 175 2017259 http://www.aAlfa Aesar
    2170 2-bromo-5-iodc1cc(ncc1I)Br 124 3925513 http://www.aAlfa Aesar
    2171 2-bromo-5-meCOc1ccc(c(c1) 160 2010679 http://www. Alfa Aesar
    2172 2-bromo-5-meCOc1ccc(c(c1) 158 81154 http://www.aAlfa Aesar
    2173 2-bromo-5-meCc1ccc(nc1)Br 43 490509 http://www.aAlfa Aesar
    2174 2-bromo-5-nitc1cc(c(cc1[N+ 139 74546 http://www.aAlfa Aesar
    2175 2-bromo-5-nitCOc1cc(ccc1Br 104 91525 http://www.aAlfa Aesar
    2176 2-bromo-5-nitc1cc(c(cc1[N+ 180 212451 http://www.aAlfa Aesar
    2177 2-bromo-5-nitc1cc(c(cc1[N+] 43 119974 http://www.aAlfa Aesar
    2178 2-bromo-5-nitc1cc(ncc1[N+] 138 70615 http://www.aAlfa Aesar
    2179 2-bromo-5-nitc1c(sc(n1)Br)[ 88 17200 http://www.aAlfa Aesar
    2180 2-bromo-5-nitc1cc(sc1[N+]( 44 75087 http://www.aAlfa Aesar
    2181 2-bromo-5-nitCc1cc(ccc1Br) 78 220493 http://www.aAlfa Aesar
    2182 2-bromo-6-(trc1cc(nc(c1)Br) 50 2063046 http://www. Alfa Aesar
    2183 2-bromo-6-chlo
    c1c(cc(c(c1Cl) 31 644260 http://www.aAlfa Aesar
    2184 2-bromo-6-chlc1c(cc(c(c1Cl) 56 534050 http://www.aAlfa Aesar
    2185 2-bromo-6-chlc1c(cc(c(c1Cl) 175 60196 http://www.aAlfa Aesar
    2186 2-bromo-6-chlc1cc(c(c(c1)Br 149 30618 http://www. Alfa Aesar
    2187 2-bromo-6-fluc1cc(nc(c1)Br) 32 554862 http://www. Alfa Aesar
    2188 2-bromo-6-meCOc1ccc2cc(cc 108 71123 http://www.aAlfa Aesar
    2189 2-bromo-6-meCOc1cccc(c1O 64 9195140 http://www.aAlfa Aesar
    2190 2-bromo-6-met
    Cc1cccc(c1C(= 109 2017276 http://www.aAlfa Aesar
    2191 2-bromo-6-nitrc1c(cc(c(c1[N+ 71 128340 http://www.aAlfa Aesar
    2192 2-bromo-6-nitc1cc(c(c(c1)Br 68 10332929 http://www. Alfa Aesar
    2193 2-bromo-6-nitCc1c(cccc1Br) 40 110131 http://www.aAlfa Aesar
    2194 2-bromoacetaC(C(=O)N)Br 89 62834 http://www.aAlfa Aesar
    2195 2'-bromoacetaCC(=O)Nc1ccc 99 120188 http://www.aAlfa Aesar
    2196 2-bromoacet c1ccc(cc1)C(= 50 6023 http://www.aAlfa Aesar
    2197 2-bromoacryliC=C(C(=O)O)B 68 74570 http://www.aAlfa Aesar
    2198 2-bromoadamC1C2CC3CC1C 139 455764 http://www.aAlfa Aesar
    2199 2-bromoanilinc1ccc(c(c1)N) 29 21111816 http://www.aAlfa Aesar
    2200 2-bromoanisoCOc1ccccc1Br 3 13881329 http://www.aAlfa Aesar
    2201 2-bromobenzac1ccc(c(c1)C= 20 21111817 http://www.aAlfa Aesar
    2202 2-bromobenzac1ccc(c(c1)C= 102 643344 http://www.aAlfa Aesar
    2203 2-bromobenz c1ccc(c(c1)C( 161 70021 http://www.aAlfa Aesar
    2204 2-bromobenzeB(c1ccccc1Br) 109 2053715 http://www.aAlfa Aesar
    2205 2-bromobenzec1ccc(c(c1)S( 192 2079976 http://www.aAlfa Aesar
    2206 2-bromobenzen
    c1ccc(c(c1)S(= 50 453936 http://www.aAlfa Aesar
    2207 2-bromobenzhc1ccc(c(c1)C( 153 91680 http://www.aAlfa Aesar
    2208 2-bromobenzic1ccc2c(c1)[n 198 2056600 http://www. Alfa Aesar
    2209 2-bromobenzoi
    c1ccc(c(c1)C( 148 6674 http://www.aAlfa Aesar
    2210 2-bromobenzon
    c1ccc(c(c1)C# 55 15440 http://www.aAlfa Aesar
    2211 2-bromobenzoy
    c1ccc(c(c1)C(= 10 22012 http://www.aAlfa Aesar
    2212 2-bromobenzyl
    c1ccc(c(c1)CO 80 65682 http://www.aAlfa Aesar
    2213 2-bromobenzyc1ccc(c(c1)CBr 31 69414 http://www.aAlfa Aesar
    2214 2-bromobiphec1ccc(cc1)c2c 1 15494 http://www.aAlfa Aesar
    2215 2-bromobuta CCC(C)Br -112 6306 http://www.aAlfa Aesar
    2216 2-bromobutyriCCC(C(=O)O)B -4 6403 http://www.aAlfa Aesar
    2217 2-bromoethanC(CBr)O -80 10436 http://www.aAlfa Aesar
    2218 2-bromofluor c1ccc-2c(c1)C 112 13697 http://www.aAlfa Aesar
    2219 2-bromohexanCCCCC(C(=O)O 4 11294432 http://www.aAlfa Aesar
    2220 2-bromoindenc1ccc2c(c1)CC 36 500428 http://www.aAlfa Aesar
    2221 2-bromoisobutCC(C)(C(=O)O) 44 10790335 http://www.aAlfa Aesar
    2222 2-bromoisovalCC(C)C(C(=O)O 39 10794 http://www.aAlfa Aesar
    2223 2-bromomesitCc1cc(c(c(c1)C 2 21112244 http://www.aAlfa Aesar
    2224 2-bromo-m-xyCc1cccc(c1Br) -10 13875201 http://www.aAlfa Aesar
    2225 2-bromonaphtc1ccc2cc(ccc2 55 10894 http://www.aAlfa Aesar
    2226 2-bromonicotic1cc(c(nc1)Br 254 203366 http://www. Alfa Aesar
    2227 2-bromopent CCCC(C)Br -96 7602 http://www.aAlfa Aesar
    2228 2-bromophenoc1ccc(c(c1)O) 5 6974 http://www.aAlfa Aesar
    2229 2-bromophenox
    c1ccc(c(c1)OC 49 2015964 http://www.aAlfa Aesar
    2230 2-bromophenyl
    c1ccc(c(c1)CC 106 79171 http://www.aAlfa Aesar
    2231 2-bromophenyl
    c1ccc(c(c1)CC 19 27535 http://www.aAlfa Aesar
    2232 2-bromoprop CC(C)Br -89 6118 http://www.aAlfa Aesar
    2233 2-bromoprop CC(=C)Br -87 10729 http://www.aAlfa Aesar
    2234 2-bromopropio
    CC(C(=O)O)Br 25 11236 http://www.aAlfa Aesar
    2235 2-bromo-p-xyCc1ccc(c(c1)B 10 21171515 http://www.aAlfa Aesar
    2236 2-bromopyridc1cnc(cc1C=O 54 2043689 http://www.aAlfa Aesar
    2237 2-bromopyridc1cnc(cc1C(=O 192 3816070 http://www.aAlfa Aesar
    2238 2-bromopyrimc1cnc(nc1)Br 55 70715 http://www.aAlfa Aesar
    2239 2-bromoquinolB(c1cc2ccccc2 146 16498301 http://www.aAlfa Aesar
    2240 2-bromostyreC=Cc1ccccc1B -53 15432 http://www.aAlfa Aesar
    2241 2-bromotereph
    c1cc(c(cc1C(= 299 61788 http://www.aAlfa Aesar
    2242 2-bromotetradCCCCCCCCCCC 42 59718 http://www.aAlfa Aesar
    2243 2-bromothiazoc1c(sc(n1)Br) 94 2053681 http://www. Alfa Aesar
    2244 2-bromothiazoc1c(sc(n1)Br) 182 2043899 http://www. Alfa Aesar
    2245 2-bromothioan
    COc1ccccc1SB -24 11548480 http://www.aAlfa Aesar
    2246 2-bromotolueCc1ccccc1Br -27 13875320 http://www.aAlfa Aesar
    2247 2-butanol CCC(C)O -115 6320 http://www.aAlfa Aesar
    2248 2-butanone CCC(=O)C -87 6321 http://www.aAlfa Aesar
    2249 2-butanone o CCC(=NO)C -30 7020 http://www.aAlfa Aesar
    2250 2-butyn-1-ol CC#CCO -2 12450 http://www.aAlfa Aesar
    2251 2-butyne CC#CC -32 9990 http://www.aAlfa Aesar
    2252 2-butyne-1,4-dC(C#CCO)O 56 7775 http://www.aAlfa Aesar
    2253 2-butynoic aciCC#CC(=O)O 77 61810 http://www.aAlfa Aesar
    2254 2-butynyl p-t CC#CCOS(=O)( 48 5381846 http://www.aAlfa Aesar
    2255 2-carboxy-3, COc1ccc(c(c1 147 61517 http://www.aAlfa Aesar
    2256 2-carboxybenc1ccc(c(c1)C= 99 8099 http://www.aAlfa Aesar
    2257 2-carboxybenzB(c1ccccc1C( 220 2015747 http://www.aAlfa Aesar
    2258 2-carboxymeth
    Cc1ccnc(n1)S 192 89218 http://www.aAlfa Aesar
    2259 2-carboxyphenc1ccc(c(c1)C( 164 3300 http://www.aAlfa Aesar
    2260 2-chloro-1-(2 c1cc(c(cc1[N+] 71 2008927 http://www.aAlfa Aesar
    2261 2-chloro-1,3- c1c(cc(c(c1Br) 86 2006731 http://www.aAlfa Aesar
    2262 2-chloro-1,3- c1cc(c(c(c1)[N 86 21242790 http://www.aAlfa Aesar
    2263 2-chloro-1,4 c1cc(c(cc1Br)C 40 21242146 http://www.aAlfa Aesar
    2264 2-chloro-1-fl c1cc(c(cc1[N+] 44 21171397 http://www.aAlfa Aesar
    2265 2-chloro-1-io c1cc(c(cc1[N+] 99 87248 http://www.aAlfa Aesar
    2266 2-chloro-1-meCn1ccnc1Cl -10 2053751 http://www. Alfa Aesar
    2267 2-chloro-1-tri c1ccc(cc1)C(c 201 2053756 http://www. Alfa Aesar
    2268 2-chloro-2,2- C(=O)(C(F)(F)C 82 61034 http://www.aAlfa Aesar
    2269 2-chloro-2',4 c1cc(c(cc1F)F 46 511201 http://www.aAlfa Aesar
    2270 2-chloro-2',6' CCc1cccc(c1N 130 86962 http://www.aAlfa Aesar
    2271 2-chloro-2',6' Cc1cccc(c1NC( 148 63963 http://www.aAlfa Aesar
    2272 2-chloro-2-meCCC(C)(C)Cl -73 55090 http://www.aAlfa Aesar
    2273 2-chloro-2'-ni c1ccc(c(c1)NC 88 193114 http://www.aAlfa Aesar
    2274 2-chloro-3-(tr c1cc(c(c(c1)N) 27 4164467 http://www. Alfa Aesar
    2275 2-chloro-3-(t c1cc(c(c(c1)C( 44 2018330 http://www.aAlfa Aesar
    2276 2-chloro-3-(tr c1cc(c(c(c1)C( 134 2018335 http://www.aAlfa Aesar
    2277 2-chloro-3-(tr c1cc(c(c(c1)C( 40 2842431 http://www. Alfa Aesar
    2278 2-chloro-3-(tr c1cc(c(c(c1)C( 76 2058368 http://www.aAlfa Aesar
    2279 2-chloro-3-(t c1cc(c(c(c1)C( 36 4394445 http://www. Alfa Aesar
    2280 2-chloro-3-(tr c1cc(c(c(c1)C( 132 3052959 http://www. Alfa Aesar
    2281 2-chloro-3-(tr c1cc(c(c(c1)C( 58 4370981 http://www. Alfa Aesar
    2282 2-chloro-3-(tr c1cc(c(nc1)Cl) 39 512734 http://www.aAlfa Aesar
    2283 2-chloro-3',4 c1cc(c(cc1C(= 174 60198 http://www.aAlfa Aesar
    2284 2-chloro-3,4- COc1ccc(c(c1 102 2055507 http://www.aAlfa Aesar
    2285 2-chloro-3,4- COc1ccc(c(c1 71 2055505 http://www.aAlfa Aesar
    2286 2-chloro-3,4- COc1ccc(c(c1 195 4647242 http://www.aAlfa Aesar
    2287 2-chloro-3,5-dc1c(cnc(c1I)Cl) 73 549232 http://www. Alfa Aesar
    2288 2-chloro-3,5-dc1c(cc(c(c1C( 199 16326 http://www.aAlfa Aesar
    2289 2-chloro-3,5-dc1c(cc(c(c1C(F 63 61168 http://www.aAlfa Aesar
    2290 2-chloro-3,5-dc1c(cnc(c1[N+ 63 68255 http://www.aAlfa Aesar
    2291 2-chloro-3,6-dc1cc(c(c(c1F)N 29 16499432 http://www. Alfa Aesar
    2292 2-chloro-3,6- c1cc(c(c(c1F)C 47 2053925 http://www.aAlfa Aesar
    2293 2-chloro-3,6-dc1cc(c(c(c1F)C 127 2053946 http://www.aAlfa Aesar
    2294 2-chloro-3,6-dc1cc(c(c(c1F)C 47 2053957 http://www.aAlfa Aesar
    2295 2-chloro-3,6- c1cc(c(c(c1F)O 54 2053976 http://www.aAlfa Aesar
    2296 2-chloro-3-cy Cc1cc(nc(c1C# 99 193892 http://www.aAlfa Aesar
    2297 2-chloro-3-cy c1ccc(cc1)c2c 145 2044721 http://www. Alfa Aesar
    2298 2-chloro-3-cy Cc1ccc(c(n1)C 116 453934 http://www.aAlfa Aesar
    2299 2-chloro-3-cy c1cc(c(nc1)Cl 107 73147 http://www.aAlfa Aesar
    2300 2-chloro-3-fluc1c[n+](c(c(c1 177 5379339 http://www.aAlfa Aesar
    2301 2-chloro-3-hy c1cc(c(nc1)Cl 170 73202 http://www.aAlfa Aesar
    2302 2-chloro-3-io c1cc(c(nc1)Cl) 95 2017429 http://www.aAlfa Aesar
    2303 2-chloro-3-meCOc1cccnc1Cl 47 94117 http://www.aAlfa Aesar
    2304 2-chloro-3-meCc1cc2ccccc2n 83 300559 http://www. Alfa Aesar
    2305 2-chloro-3-meCc1c(nc2ccccc 73 206218 http://www. Alfa Aesar
    2306 2-chloro-3'-ni c1cc(cc(c1)[N 114 463445 http://www.aAlfa Aesar
    2307 2-chloro-3-nitc1cc(c(c(c1)[ 184 18716 http://www.aAlfa Aesar
    2308 2-chloro-3-nitc1cc(c(nc1)Cl) 101 71920 http://www.aAlfa Aesar
    2309 2-chloro-4-(meCS(=O)(=O)c1c 194 643017 http://www.aAlfa Aesar
    2310 2'-chloro-4'-( CC(=O)Nc1ccc( 136 2018329 http://www.aAlfa Aesar
    2311 2-chloro-4-(t B(c1ccc(cc1Cl) 111 2063394 http://www.aAlfa Aesar
    2312 2-chloro-4-(t c1cc(c(cc1C(F) 170 2054334 http://www. Alfa Aesar
    2313 2-chloro-4-(tr c1cc(c(cc1C(F) 37 2018333 http://www.aAlfa Aesar
    2314 2-chloro-4-(tr c1cc(c(cc1C(F) 83 2018142 http://www. Alfa Aesar
    2315 2-chloro-4-(tr c1cnc(c(c1C(F 159 9944821 http://www. Alfa Aesar
    2316 2-chloro-4,5-dc1c(c(cc(c1F)F 106 644235 http://www.aAlfa Aesar
    2317 2-chloro-4,5-dc1c(c(cc(c1F)F 35 3300422 http://www. Alfa Aesar
    2318 2-chloro-4,5- Cc1cc(c(cc1C) 71 63919 http://www.aAlfa Aesar
    2319 2-chloro-4,6-bCCNc1nc(nc(n 228 5027 http://www.aAlfa Aesar
    2320 2-chloro-4,6- c1c(cc(c(c1Cl) 100 3502035 http://www.aAlfa Aesar
    2321 2-chloro-4,6-dc1c(cc(c(c1F)N 30 2015841 http://www. Alfa Aesar
    2322 2-chloro-4,6-dCOc1nc(nc(n1 77 17426 http://www.aAlfa Aesar
    2323 2-chloro-4,6-dc1c(cc(c(c1[N+ 154 17987 http://www.aAlfa Aesar
    2324 2-chloro-4-cy c1cc(c(cc1C#N 103 2017408 http://www. Alfa Aesar
    2325 2-chloro-4-cy c1cnc(cc1C#N) 71 494376 http://www.aAlfa Aesar
    2326 2-chloro-4-fl c1cc(c(cc1F)Cl 35 67570 http://www. Alfa Aesar
    2327 2-chloro-4-fl Cc1c(ccc(c1Cl 188 9020609 http://www. Alfa Aesar
    2328 2'-chloro-4'-f CC(=O)Nc1ccc( 117 512372 http://www.aAlfa Aesar
    2329 2-chloro-4'-f c1cc(ccc1C(=O 48 107349 http://www.aAlfa Aesar
    2330 2-chloro-4-fl c1cc(c(cc1F)C 62 127945 http://www.aAlfa Aesar
    2331 2-chloro-4-fl c1cc(c(cc1F)Cl 30 456078 http://www.aAlfa Aesar
    2332 2-chloro-4-fluc1cc(c(cc1F)C 185 67802 http://www.aAlfa Aesar
    2333 2-chloro-4-fluc1cc(c(cc1F)C 64 98019 http://www.aAlfa Aesar
    2334 2-chloro-4-fluc1cc(c(cc1F)C 45 4163081 http://www.aAlfa Aesar
    2335 2-chloro-4-fl c1cc(c(cc1F)Cl 37 2007169 http://www.aAlfa Aesar
    2336 2-chloro-4-fluc1cc(c(cc1F)C 247 4864421 http://www.aAlfa Aesar
    2337 2-chloro-4-fl c1cc(c(cc1F)Cl 22 67381 http://www.aAlfa Aesar
    2338 2-chloro-4-fluc1cc(c(cc1F)C 104 2007168 http://www.aAlfa Aesar
    2339 2-chloro-4-fluc1cc(c(cc1F)C 68 2007170 http://www.aAlfa Aesar
    2340 2-chloro-4h-1c1ccc2c(c1)C( 38 206914 http://www.aAlfa Aesar
    2341 2-chloro-4-hy c1cnc(cc1O)Cl 171 78485 http://www. Alfa Aesar
    2342 2-chloro-4-io Cc1c(ccnc1Cl)I 107 8259166 http://www. Alfa Aesar
    2343 2-chloro-4-iodc1cc(c(cc1I)Cl 70 249202 http://www.aAlfa Aesar
    2344 2-chloro-4-io c1cnc(cc1I)Cl 43 1247454 http://www.aAlfa Aesar
    2345 2-chloro-4-meB(c1ccc(cc1Cl 202 2053749 http://www. Alfa Aesar
    2346 2-chloro-4-meCOc1ccc(c(c1) 57 11346503 http://www. Alfa Aesar
    2347 2-chloro-4-m COc1ccc(c(c1) 42 78892 http://www.aAlfa Aesar
    2348 2-chloro-4-meCOc1ccc(c(c1) 42 11346581 http://www. Alfa Aesar
    2349 2-chloro-4-meCc1ccnc(c1[N+ 53 306292 http://www. Alfa Aesar
    2350 2-chloro-4-meCc1ccc(c(c1)C 7 11512 http://www.aAlfa Aesar
    2351 2-chloro-4-meB(c1ccc(cc1Cl 200 2053753 http://www. Alfa Aesar
    2352 2-chloro-4-meCc1ccnc(n1)Cl 47 9804352 http://www. Alfa Aesar
    2353 2-chloro-4-meCc1cc(nc2c1cc 55 62656 http://www. Alfa Aesar
    2354 2-chloro-4-nitc1cc(c(cc1[N+ 108 8179 http://www.aAlfa Aesar
    2355 2-chloro-4-ni c1cc(c(cc1[N+ 170 1991 http://www.aAlfa Aesar
    2356 2-chloro-4-nitc1cc(c(cc1[N+ 142 7168 http://www.aAlfa Aesar
    2357 2-chloro-4-nitc1cc(c(cc1[N+ 80 124737 http://www.aAlfa Aesar
    2358 2-chloro-4-ni c1cc(c(cc1[N+ 110 11577 http://www.aAlfa Aesar
    2359 2-chloro-4-ni c1cc(c(cc1[N+ 61 3805331 http://www.aAlfa Aesar
    2360 2-chloro-4-nitc1cc(c(cc1[N+ 97 2038495 http://www.aAlfa Aesar
    2361 2-chloro-4-nitc1cnc(cc1[N+] 52 642344 http://www.aAlfa Aesar
    2362 2-chloro-4-nitc1c[n+](c(cc1[ 154 76164 http://www.aAlfa Aesar
    2363 2-chloro-4-ni Cc1ccc(cc1Cl) 64 8178 http://www.aAlfa Aesar
    2364 2-chloro-5-(c c1cc(ncc1CCl) 40 136966 http://www.aAlfa Aesar
    2365 2-chloro-5-(tr c1cc(c(cc1C(F) 9 8162 http://www.aAlfa Aesar
    2366 2-chloro-5-(tr c1cc(c(cc1C(F) 39 60924 http://www.aAlfa Aesar
    2367 2-chloro-5-(tr c1cc(c(cc1C(F) 59 2058370 http://www.aAlfa Aesar
    2368 2-chloro-5-(tr c1cc(c(cc1C(F 113 2058379 http://www.aAlfa Aesar
    2369 2-chloro-5-(tr c1cc(c(cc1C(F) 32 2058384 http://www.aAlfa Aesar
    2370 2-chloro-5-(tr c1cc(ncc1C(F)( 31 83365 http://www.aAlfa Aesar
    2371 2-chloro-5,5- CC1(CC(=O)C(C 163 109039 http://www. Alfa Aesar
    2372 2-chloro-5-cy c1cc(ncc1C#N) 118 4325263 http://www.aAlfa Aesar
    2373 2-chloro-5-fluc1cc(c(cc1F)N) 26 2018175 http://www.aAlfa Aesar
    2374 2-chloro-5-fluc1cc(c(cc1F)C 148 267729 http://www. Alfa Aesar
    2375 2-chloro-5-fluc1cc(c(cc1F)C 84 84540 http://www. Alfa Aesar
    2376 2-chloro-5-fluc1cc(c(cc1F)C 70 2054017 http://www.aAlfa Aesar
    2377 2-chloro-5-fluc1cc(ncc1F)Cl 19 2062945 http://www. Alfa Aesar
    2378 2-chloro-5-hy c1cc(c(cc1O)C 179 403236 http://www. Alfa Aesar
    2379 2-chloro-5-hy c1cc(ncc1O)Cl 155 716264 http://www.aAlfa Aesar
    2380 2-chloro-5-io c1cc(c(cc1I)C( 159 453265 http://www.aAlfa Aesar
    2381 2-chloro-5-io c1cc(ncc1I)Cl 97 3598525 http://www.aAlfa Aesar
    2382 2-chloro-5-meCOc1ccc(c(c1) 27 67990 http://www.aAlfa Aesar
    2383 2-chloro-5-meCOc1ccc2c(c1) 167 452873 http://www.aAlfa Aesar
    2384 2-chloro-5-meCOc1ccc(c(c1) 172 192186 http://www. Alfa Aesar
    2385 2-chloro-5-meCc1ccc(c(c1)N 32 60136 http://www. Alfa Aesar
    2386 2-chloro-5-meCc1ccc(c(c1)O 46 11513 http://www.aAlfa Aesar
    2387 2-chloro-5-nitc1cc(c(cc1[N+ 119 21272 http://www.aAlfa Aesar
    2388 2-chloro-5-ni c1cc(c(cc1[N+ 79 65763 http://www.aAlfa Aesar
    2389 2-chloro-5-ni c1cc(c(cc1[N+ 179 252640 http://www.aAlfa Aesar
    2390 2-chloro-5-nitc1cc(c(cc1[N+ 167 16359 http://www.aAlfa Aesar
    2391 2-chloro-5-nitc1cc(c(cc1[N+ 106 77114 http://www.aAlfa Aesar
    2392 2-chloro-5-nitc1cc(c(cc1[N+] 22 55156 http://www.aAlfa Aesar
    2393 2-chloro-5-nitc1cc(c(cc1[N+] 59 105125 http://www.aAlfa Aesar
    2394 2-chloro-5-nitc1cc(c(cc1[N+ 77 483211 http://www.aAlfa Aesar
    2395 2-chloro-5-ni c1cc(c(cc1[N+ 94 2838009 http://www.aAlfa Aesar
    2396 2-chloro-5-nitc1cc(ncc1[N+] 107 70680 http://www.aAlfa Aesar
    2397 2-chloro-5-ni Cc1cc(ccc1Cl) 43 75176 http://www.aAlfa Aesar
    2398 2-chloro-6-(tr c1cc(nc(c1C(= 119 2058469 http://www. Alfa Aesar
    2399 2-chloro-6-(tr c1cc(c(c(c1)Cl 151 16499365 http://www. Alfa Aesar
    2400 2-chloro-6-(tr c1cc(nc(c1)Cl) 29 523600 http://www.aAlfa Aesar
    2401 2-chloro-6-cy c1cc(nc(c1)Cl 87 105843 http://www. Alfa Aesar
    2402 2-chloro-6-fl COc1ccc(c(c1C 102 16499508 http://www. Alfa Aesar
    2403 2-chloro-6-fl COc1ccc(c(c1C 49 3088202 http://www. Alfa Aesar
    2404 2-chloro-6-fl Cc1ccc(c(c1Cl 27 643460 http://www.aAlfa Aesar
    2405 2-chloro-6-fl Cc1ccc(c(c1Cl 152 2054074 http://www.aAlfa Aesar
    2406 2-chloro-6-fl Cc1ccc(c(c1Cl 117 2054080 http://www.aAlfa Aesar
    2407 2-chloro-6-fluCc1ccc(c(c1Cl 59 14191611 http://www. Alfa Aesar
    2408 2-chloro-6-fl Cc1ccc(c(c1Cl 69 2054084 http://www.aAlfa Aesar
    2409 2-chloro-6-fl Cc1ccc(c(c1Cl 36 2054091 http://www. Alfa Aesar
    2410 2-chloro-6-fl Cc1ccc(c(c1Cl 49 2054095 http://www. Alfa Aesar
    2411 2-chloro-6-fl c1cc(c(c(c1)Cl 37 61164 http://www.aAlfa Aesar
    2412 2-chloro-6-fl c1cc(c(c(c1)C 126 2036554 http://www.aAlfa Aesar
    2413 2-chloro-6-fl c1cc(c(c(c1)Cl 141 89012 http://www.aAlfa Aesar
    2414 2-chloro-6-fluc1cc(c(c(c1)Cl 158 61264 http://www.aAlfa Aesar
    2415 2-chloro-6-fluc1cc(c(c(c1)Cl 58 62791 http://www.aAlfa Aesar
    2416 2-chloro-6-fl c1cc2c(cc1F)sc 91 1544722 http://www. Alfa Aesar
    2417 2-chloro-6-fluc1cc(c(c(c1)Cl 43 82951 http://www.aAlfa Aesar
    2418 2-chloro-6-fluc1cc(c(c(c1)Cl 63 599720 http://www.aAlfa Aesar
    2419 2-chloro-6-fl c1cc(c(c(c1)Cl 63 2054122 http://www.aAlfa Aesar
    2420 2-chloro-6-fluc1cc(c(c(c1)C 122 110060 http://www.aAlfa Aesar
    2421 2-chloro-6-fluc1cc(c(c(c1)C 42 110169 http://www.aAlfa Aesar
    2422 2-chloro-6-hy c1cc(nc(c1)Cl 130 77221 http://www.aAlfa Aesar
    2423 2-chloro-6-io Cc1c(cccc1I)Cl 11 2038377 http://www.aAlfa Aesar
    2424 2-chloro-6-meCOc1ccc2c(c1) 150 600459 http://www. Alfa Aesar
    2425 2-chloro-6-met
    Cc1cc(cc(c1N) 175 2015257 http://www.aAlfa Aesar
    2426 2-chloro-6-meCc1cccc(c1N)C 2 6631 http://www.aAlfa Aesar
    2427 2-chloro-6-meCc1cccc(c1C=O 37 13339033 http://www. Alfa Aesar
    2428 2-chloro-6-m Cc1cccc(c1C(= 165 101784 http://www.aAlfa Aesar
    2429 2-chloro-6-meCc1cccc(c1C(= 104 80189 http://www.aAlfa Aesar
    2430 2-chloro-6-meCc1cccc(c1C#N 81 21574 http://www.aAlfa Aesar
    2431 2-chloro-6-met
    Cc1ccc(c(n1)C 160 108608 http://www.aAlfa Aesar
    2432 2-chloro-6-nitc1c(cc(c(c1[N+ 65 2015839 http://www.aAlfa Aesar
    2433 2-chloro-6-ni c1cc(c(c(c1)C 185 77822 http://www.aAlfa Aesar
    2434 2-chloro-6-nitc1cc(c(c(c1)C 164 71611 http://www.aAlfa Aesar
    2435 2-chloro-6-nitc1cc(c(c(c1)C 121 73126 http://www.aAlfa Aesar
    2436 2-chloro-6-ni c1cc(c(c(c1)Cl 70 11291 http://www.aAlfa Aesar
    2437 2-chloro-6-ni Cc1c(cccc1Cl) 36 6484 http://www.aAlfa Aesar
    2438 2-chloro-6-phc1ccc(cc1)Oc2 61 2019410 http://www.aAlfa Aesar
    2439 2-chloro-7-meCc1cc(nc2c1cc 112 639706 http://www. Alfa Aesar
    2440 2-chloroacetaC(C(=O)N)Cl 118 6332 http://www.aAlfa Aesar
    2441 2'-chloroacetaCC(=O)Nc1ccc 87 10322 http://www.aAlfa Aesar
    2442 2'-chloroacetoCC(=O)CC(=O) 105 6889 http://www.aAlfa Aesar
    2443 2-chloroacet c1ccc(cc1)C(= 54 10303 http://www.aAlfa Aesar
    2444 2-chloroacryliC=C(C(=O)O)C 65 11242 http://www.aAlfa Aesar
    2445 2-chloroanilinc1ccc(c(c1)N)C -3 13854248 http://www.aAlfa Aesar
    2446 2-chloroanthrc1ccc2c(c1)C( 209 8235 http://www.aAlfa Aesar
    2447 2-chlorobenz c1ccc(c(c1)C= 10 21106014 http://www.aAlfa Aesar
    2448 2-chlorobenz c1ccc(c(c1)C( 142 62328 http://www.aAlfa Aesar
    2449 2-chlorobenzeB(c1ccccc1Cl) 98 2016074 http://www.aAlfa Aesar
    2450 2-chlorobenz c1ccc(c(c1)S( 190 73458 http://www.aAlfa Aesar
    2451 2-chlorobenzec1ccc(c(c1)S(= 27 68670 http://www.aAlfa Aesar
    2452 2-chlorobenzhc1ccc(c(c1)C( 118 72174 http://www.aAlfa Aesar
    2453 2-chlorobenzic1ccc2c(c1)[n 183 70932 http://www.aAlfa Aesar
    2454 2-chlorobenzoc1ccc(c(c1)C( 140 8071 http://www.aAlfa Aesar
    2455 2-chlorobenzon
    c1ccc(c(c1)C# 45 12818 http://www.aAlfa Aesar
    2456 2-chlorobenz c1ccc(cc1)C(= 46 71173 http://www.aAlfa Aesar
    2457 2-chlorobenzoc1ccc2c(c1)nc( 32 11492 http://www.aAlfa Aesar
    2458 2-chlorobenzoc1ccc(c(c1)C(Cl 30 15636 http://www.aAlfa Aesar
    2459 2-chlorobenzot
    c1ccc(c(c1)C(F -6 6655 http://www.aAlfa Aesar
    2460 2-chlorobenzoc1ccc(c(c1)C(= -4 62327 http://www.aAlfa Aesar
    2461 2-chlorobenzoy
    c1ccc(c(c1)C( 56 2015957 http://www.aAlfa Aesar
    2462 2-chlorobenzyc1ccc(c(c1)CO 70 26799 http://www.aAlfa Aesar
    2463 2-chlorobenzylc1ccc(c(c1)CCl -13 11412 http://www.aAlfa Aesar
    2464 2-chloro-beta c1ccc(c(c1)/C 48 4520408 http://www.aAlfa Aesar
    2465 2-chlorobutanCCC(C)Cl -141 6315 http://www.aAlfa Aesar
    2466 2-chlorobutyrCCC(C(=O)N)C 75 305926 http://www.aAlfa Aesar
    2467 2-chlorocinnac1ccc(c(c1)/C 38 4643134 http://www.aAlfa Aesar
    2468 2-chloro-D-phc1ccc(c(c1)C[ 212 5324011 http://www. Alfa Aesar
    2469 2-chloroethanC(CCl)O -63 21106015 http://www.aAlfa Aesar
    2470 2-chloroethyl c1cc(ccc1F)S( 69 2018171 http://www.aAlfa Aesar
    2471 2-chloroethyl CCOCCCl -60 11836 http://www.aAlfa Aesar
    2472 2-chloroethyl c1ccc(cc1)S(= 54 13057 http://www.aAlfa Aesar
    2473 2-chloroethyl Cc1ccc(cc1)S( 79 163558 http://www.aAlfa Aesar
    2474 2-chloroethyl C(CCl)P(=O)(O 70 26031 http://www.aAlfa Aesar
    2475 2-chlorohydr c1cc(c(cc1O)C 102 295 http://www.aAlfa Aesar
    2476 2-chloroimidac1cnc([nH]1)C 166 2053747 http://www. Alfa Aesar
    2477 2-chloro-l-phec1ccc(c(c1)C 234 2042221 http://www. Alfa Aesar
    2478 2-chloromande
    c1ccc(c(c1)C( 83 88197 http://www.aAlfa Aesar
    2479 2-chloro-m-xyCc1cccc(c1Cl) -36 13875381 http://www.aAlfa Aesar
    2480 2-chloro-n-(h C(C(=O)NCO)C 100 56246 http://www.aAlfa Aesar
    2481 2-chloro-n-cy C1CC1NC(=O)C 82 642934 http://www. Alfa Aesar
    2482 2-chloronicot c1cc(c(nc1)Cl 165 74530 http://www.aAlfa Aesar
    2483 2-chloronicotic1cc(c(nc1)Cl) 40 2054937 http://www.aAlfa Aesar
    2484 2-chloro-n-m CN(C(=O)CCl) 40 2016460 http://www.aAlfa Aesar
    2485 2-chloro-n-meCNC(=O)CCl 46 60139 http://www. Alfa Aesar
    2486 2-chlorophenoc1ccc(c(c1)O)C 8 13837686 http://www.aAlfa Aesar
    2487 2-chlorophenoc1ccc2c(c1)Nc 200 6821 http://www.aAlfa Aesar
    2488 2-chlorophenoc1ccc(c(c1)OC 150 11475 http://www.aAlfa Aesar
    2489 2-chlorophenoc1ccc(c(c1)OC 112 157860 http://www.aAlfa Aesar
    2490 2-chlorophenylc1ccc(c(c1)CC 96 16208 http://www.aAlfa Aesar
    2491 2-chlorophenylc1ccc(c(c1)CC 23 21111776 http://www.aAlfa Aesar
    2492 2-chloroprop CC(C)Cl -117 6121 http://www.aAlfa Aesar
    2493 2-chloroprop CC(=C)Cl -138 10730 http://www.aAlfa Aesar
    2494 2-chloropyrid c1ccnc(c1)Cl -46 7689 http://www.aAlfa Aesar
    2495 2-chloropyridic1cc[n+](c(c1) 69 67994 http://www.aAlfa Aesar
    2496 2-chloropyridiB(c1cccnc1Cl) 160 2043404 http://www.aAlfa Aesar
    2497 2-chloropyrid c1cc(c(nc1)Cl 52 644639 http://www. Alfa Aesar
    2498 2-chloropyridiB(c1ccnc(c1)C 162 4324790 http://www. Alfa Aesar
    2499 2-chloropyrid c1cnc(cc1C=O) 48 2043692 http://www. Alfa Aesar
    2500 2-chloropyrid c1cnc(cc1C(=O 202 2078757 http://www. Alfa Aesar
    2501 2-chloropyridic1cnc(cc1C(=O 231 206891 http://www.aAlfa Aesar
    2502 2-chloropyrid c1cnc(cc1CO)C 65 5417984 http://www. Alfa Aesar
    2503 2-chloropyrimc1cnc(nc1)Cl 66 66996 http://www.aAlfa Aesar
    2504 2-chloroquinoc1ccc2c(c1)ccc 36 11434 http://www.aAlfa Aesar
    2505 2-chloroquinolB(c1cc2ccccc2 146 3408924 http://www.aAlfa Aesar
    2506 2-chloroquinoc1ccc2c(c1)cc 149 602013 http://www. Alfa Aesar
    2507 2-chlorostyre C=Cc1ccccc1C -63 14205 http://www.aAlfa Aesar
    2508 2-chlorothiop c1cc(sc1)Cl -72 7027 http://www.aAlfa Aesar
    2509 2-chlorotolue Cc1ccccc1Cl -36 13875281 http://www.aAlfa Aesar
    2510 2-chloroverat COc1ccc(c(c1 71 71762 http://www.aAlfa Aesar
    2511 2-coumarano c1ccc2c(c1)C 50 61668 http://www.aAlfa Aesar
    2512 2-cyano-3,5-dic1c(cnc(c1F)C 32 2063396 http://www.aAlfa Aesar
    2513 2-cyano-3,6-dc1cc(nc(c1I)C# 194 21242395 http://www. Alfa Aesar
    2514 2-cyano-3-flu c1cc(c(nc1)C# 29 5416483 http://www. Alfa Aesar
    2515 2-cyano-3-iodc1cc(c(nc1)C# 99 11632365 http://www. Alfa Aesar
    2516 2-cyano-3-metCc1cccnc1C#N 86 716358 http://www.aAlfa Aesar
    2517 2-cyano-4'-meCc1ccc(cc1)c2 51 128357 http://www.aAlfa Aesar
    2518 2-cyano-4-metCc1ccnc(c1)C 87 80072 http://www.aAlfa Aesar
    2519 2-cyano-5-flu c1cc(ncc1F)C 43 9507399 http://www. Alfa Aesar
    2520 2-cyano-6-flu c1cc(nc(c1)F) 34 21242429 http://www. Alfa Aesar
    2521 2-cyanobenzac1ccc(c(c1)C 104 91446 http://www. Alfa Aesar
    2522 2-cyanobenzac1ccc(c(c1)C# 173 65715 http://www.aAlfa Aesar
    2523 2-cyanobenzen
    c1ccc(c(c1)C# 67 455642 http://www.aAlfa Aesar
    2524 2-cyanobenzoic1ccc(c(c1)C# 211 121703 http://www. Alfa Aesar
    2525 2-cyanopyridi c1ccnc(c1)C# 27 7241 http://www.aAlfa Aesar
    2526 2-cyclohexen-C1CC=CC(=O) -53 13005 http://www.aAlfa Aesar
    2527 2-cyclohexylbc1ccc(c(c1)C 104 5383522 http://www.aAlfa Aesar
    2528 2-cyclohexyle C1CCC(CC1)C -20 19315 http://www.aAlfa Aesar
    2529 2-decanol CCCCCCCCC(C -5 13616 http://www.aAlfa Aesar
    2530 2-decanone CCCCCCCCC(= 3 12218 http://www.aAlfa Aesar
    2531 2-deoxy-D-gluC1[C@H]([C@ 150 388402 http://www.aAlfa Aesar
    2532 2-deoxy-D-ribC(C=O)[C@@H 85 4573703 http://www.aAlfa Aesar
    2533 2'-deoxyuridi c1cn(c(=O)[n 166 559288 http://www.aAlfa Aesar
    2534 2-dicyclohexy CN(C)c1ccccc 123 2015973 http://www. Alfa Aesar
    2535 2-dicyclohexylCC(C)Oc1cccc 125 17345441 http://www. Alfa Aesar
    2536 2-dicyclohexy Cc1ccccc1c2c 109 2016680 http://www. Alfa Aesar
    2537 2-dimethylamiCN(C)c1ccccc 72 62335 http://www.aAlfa Aesar
    2538 2-diphenylphoc1ccc(cc1)P(c 191 9036488 http://www.aAlfa Aesar
    2539 2-dodecanoneCCCCCCCCCCC 19 21153 http://www.aAlfa Aesar
    2540 2-ethoxy-1-etCCOC1C=Cc2c 65 25898 http://www.aAlfa Aesar
    2541 2-ethoxy-1-n CCOc1ccc2ccc 112 79481 http://www.aAlfa Aesar
    2542 2-ethoxy-1-naCCOc1ccc2ccc 144 67755 http://www.aAlfa Aesar
    2543 2-ethoxy-1-naCCOc1ccc2ccc 78 97721 http://www.aAlfa Aesar
    2544 2-ethoxy-4-meCCOc1cc(ccc1 29 68233 http://www.aAlfa Aesar
    2545 2-ethoxy-4-ni CCOc1cc(ccc1C 150 2018018 http://www. Alfa Aesar
    2546 2'-ethoxyace CCOc1ccccc1C 40 21242062 http://www.aAlfa Aesar
    2547 2-ethoxybenz CCOc1ccccc1C 133 3167 http://www.aAlfa Aesar
    2548 2-ethoxybenzeB(c1ccccc1OC 100 2016645 http://www.aAlfa Aesar
    2549 2-ethoxybenzoCCOc1ccccc1C 20 60586 http://www.aAlfa Aesar
    2550 2-ethoxycinnaCCOc1ccccc1/ 135 643372 http://www.aAlfa Aesar
    2551 2-ethoxyethanCCOCCO -90 13836591 http://www.aAlfa Aesar
    2552 2-ethoxyethylCCOCCOC(=O) -62 13839109 http://www.aAlfa Aesar
    2553 2-ethoxynaphCCOc1ccc2ccc 36 6862 http://www.aAlfa Aesar
    2554 2-ethoxyphenCCOc1ccccc1 26 60121 http://www.aAlfa Aesar
    2555 2-ethyl-1,3-c CCC1C(=O)CC 169 63170 http://www.aAlfa Aesar
    2556 2-ethyl-1-but CCC(CC)CO -52 7080 http://www.aAlfa Aesar
    2557 2-ethyl-1-but CCC(=C)CC -132 12430 http://www.aAlfa Aesar
    2558 2-ethyl-1-hex CCCCC(CC)CO -76 7434 http://www.aAlfa Aesar
    2559 2-ethyl-2-(hy CCC(CO)(CO)C 60 6264 http://www.aAlfa Aesar
    2560 2-ethyl-2-oxazCCC1=NCCO1 -62 59786 http://www.aAlfa Aesar
    2561 2-ethyl-4-metCCc1[nH]cc(n 47 63447 http://www.aAlfa Aesar
    2562 2-ethyl-6-meth
    CCc1cccc(c1N -25 30109 http://www.aAlfa Aesar
    2563 2-ethylanilineCCc1ccccc1N -47 13860641 http://www.aAlfa Aesar
    2564 2-ethylanthraCCc1ccc2c(c1 109 6514 http://www.aAlfa Aesar
    2565 2-ethylbenzenB(c1ccccc1CC 97 3314842 http://www.aAlfa Aesar
    2566 2-ethylbutyricCCC(CC)C(=O) -15 6649 http://www.aAlfa Aesar
    2567 2-ethylhexaneCCCC(C(CC)CO -40 21106534 http://www.aAlfa Aesar
    2568 2-ethylhexanoCCCCC(CC)C(= -59 8373 http://www.aAlfa Aesar
    2569 2-ethylhexyl aCCCCC(CC)COC -45 7353 http://www.aAlfa Aesar
    2570 2-ethylhexyl aCCCCC(CC)CO -90 7354 http://www.aAlfa Aesar
    2571 2-ethylhexyla CCCCC(CC)CN -76 7433 http://www.aAlfa Aesar
    2572 2-ethylimidaz CCc1[nH]ccn1 82 59518 http://www.aAlfa Aesar
    2573 2-ethylphenolCCc1ccccc1O -18 13865680 http://www.aAlfa Aesar
    2574 2-ethylpyridinCCc1ccccn1 -63 7242 http://www.aAlfa Aesar
    2575 2-ethylthio-1,CCSc1nnc(s1) 121 1013183 http://www.aAlfa Aesar
    2576 2-ethyltoluen CCc1ccccc1C -17 11409 http://www.aAlfa Aesar
    2577 2-fluoro-3-(t c1cc(c(c(c1)C( 96 526492 http://www.aAlfa Aesar
    2578 2-fluoro-3-(tr c1cc(c(c(c1)C( 127 451949 http://www.aAlfa Aesar
    2579 2-fluoro-3-(tr c1cc(c(c(c1)C( 25 512323 http://www.aAlfa Aesar
    2580 2-fluoro-3-(tr c1cc(c(c(c1)C( 48 2019201 http://www.aAlfa Aesar
    2581 2-fluoro-3-hy c1cc(c(nc1)F) 132 2043483 http://www. Alfa Aesar
    2582 2-fluoro-3-m COc1cccc(c1F 49 3002912 http://www. Alfa Aesar
    2583 2-fluoro-3-meCc1cccc(c1F)C 115 2019021 http://www.aAlfa Aesar
    2584 2-fluoro-4-(t c1cc(c(cc1C(F) 141 526493 http://www.aAlfa Aesar
    2585 2-fluoro-4-(t B(c1ccc(cc1F)C 114 10820000 http://www. Alfa Aesar
    2586 2-fluoro-4-(tr c1cc(c(cc1C(F 168 451950 http://www.aAlfa Aesar
    2587 2-fluoro-4-(t c1ccc(cc1)C(=O 39 495195 http://www.aAlfa Aesar
    2588 2-fluoro-4-(tr c1cc(c(cc1C(F) 29 2019202 http://www.aAlfa Aesar
    2589 2-fluoro-4-(tr c1cnc(c(c1C(F 92 21330149 http://www. Alfa Aesar
    2590 2-fluoro-4-(tr c1cc(c(cc1C(F 80 3088471 http://www. Alfa Aesar
    2591 2'-fluoro-4'- CC(=O)c1ccc(c 122 2007027 http://www.aAlfa Aesar
    2592 2-fluoro-4-hy c1cc(c(cc1O)F 169 510445 http://www. Alfa Aesar
    2593 2-fluoro-4-hy c1cc(c(cc1O)F 125 2016419 http://www.aAlfa Aesar
    2594 2-fluoro-4'-h c1ccc(c(c1)C( 117 2063378 http://www.aAlfa Aesar
    2595 2-fluoro-4-hy c1cnc(cc1O)F 148 2043532 http://www. Alfa Aesar
    2596 2-fluoro-4-iodc1cc(c(cc1I)F) 56 161430 http://www.aAlfa Aesar
    2597 2-fluoro-4-iodc1cnc(cc1I)F 58 5386425 http://www. Alfa Aesar
    2598 2-fluoro-4-io Cc1ccc(cc1F)I 23 110087 http://www.aAlfa Aesar
    2599 2'-fluoro-4'- CC(=O)c1ccc( 52 515341 http://www.aAlfa Aesar
    2600 2-fluoro-4-m COc1ccc(c(c1) 45 2016616 http://www.aAlfa Aesar
    2601 2-fluoro-4-meCOc1ccc(c(c1) 196 2054938 http://www. Alfa Aesar
    2602 2-fluoro-4'- COc1ccc(cc1)C 56 2063379 http://www.aAlfa Aesar
    2603 2-fluoro-4-meCc1ccc(c(c1)F 188 2017822 http://www. Alfa Aesar
    2604 2-fluoro-4-meCc1ccc(c(c1)F 53 2058698 http://www. Alfa Aesar
    2605 2-fluoro-4-meCc1ccc(c(c1)F 45 4345771 http://www. Alfa Aesar
    2606 2-fluoro-4-nit COc1ccc(cc1F) 104 193737 http://www. Alfa Aesar
    2607 2-fluoro-4-nit c1cc(c(cc1[N+ 174 267525 http://www.aAlfa Aesar
    2608 2-fluoro-4-ni c1cc(c(cc1[N+ 119 9442 http://www.aAlfa Aesar
    2609 2-fluoro-4-nit Cc1ccc(cc1F)[ 35 66646 http://www.aAlfa Aesar
    2610 2-fluoro-5-(h B(c1cc(ccc1F) 71 21242534 http://www. Alfa Aesar
    2611 2-fluoro-5-(t c1cc(c(cc1C(F) 116 2019172 http://www.aAlfa Aesar
    2612 2-fluoro-5-(t B(c1cc(ccc1F)C 107 2043988 http://www. Alfa Aesar
    2613 2-fluoro-5-(tr c1cc(c(cc1C(F 102 599766 http://www.aAlfa Aesar
    2614 2-fluoro-5-(tr c1cc(c(cc1C(F 120 4643144 http://www.aAlfa Aesar
    2615 2-fluoro-5-fo B(c1cc(ccc1F) 170 2043929 http://www. Alfa Aesar
    2616 2-fluoro-5-hy c1cc(c(cc1O)C 205 2054878 http://www. Alfa Aesar
    2617 2-fluoro-5-hy c1cc(ncc1O)F 152 2043805 http://www. Alfa Aesar
    2618 2-fluoro-5-io c1cc(c(cc1I)C 44 10621171 http://www. Alfa Aesar
    2619 2-fluoro-5-iodc1cc(c(cc1I)C 163 2059165 http://www. Alfa Aesar
    2620 2-fluoro-5-iodc1cc(c(cc1I)C 72 2059168 http://www. Alfa Aesar
    2621 2-fluoro-5-iodc1cc(c(cc1I)C( 29 2058463 http://www. Alfa Aesar
    2622 2-fluoro-5-iodc1cc(ncc1I)F 32 2063322 http://www.aAlfa Aesar
    2623 2-fluoro-5-meCOc1ccc(c(c1) 83 2054942 http://www. Alfa Aesar
    2624 2-fluoro-5-meCc1ccc(c(c1)S 33 2062923 http://www.aAlfa Aesar
    2625 2-fluoro-5-meCc1ccc(c(c1)C 161 212275 http://www. Alfa Aesar
    2626 2-fluoro-5-meCc1ccc(c(c1)C 51 2054979 http://www. Alfa Aesar
    2627 2-fluoro-5-nit c1cc(c(cc1[N+ 101 61103 http://www.aAlfa Aesar
    2628 2-fluoro-5-ni c1cc(c(cc1[N+ 58 2016514 http://www.aAlfa Aesar
    2629 2-fluoro-5-nit c1cc(c(cc1[N+ 143 247474 http://www.aAlfa Aesar
    2630 2-fluoro-5-nit c1cc(c(cc1[N+ 71 453068 http://www.aAlfa Aesar
    2631 2-fluoro-5-nit Cc1cc(ccc1F)[ 39 61316 http://www.aAlfa Aesar
    2632 2-fluoro-6-(tr c1cc(c(c(c1)F) 86 599608 http://www.aAlfa Aesar
    2633 2-fluoro-6-(tr c1cc(c(c(c1)F) 27 128446 http://www.aAlfa Aesar
    2634 2-fluoro-6-(tr c1cc(c(c(c1)F) 44 2019205 http://www.aAlfa Aesar
    2635 2-fluoro-6-hy c1cc(c(c(c1)F 156 2063359 http://www.aAlfa Aesar
    2636 2-fluoro-6-hy c1cc(nc(c1)F) 127 2043585 http://www. Alfa Aesar
    2637 2-fluoro-6-iodc1cc(c(c(c1)I) 50 455971 http://www.aAlfa Aesar
    2638 2-fluoro-6-m COc1cccc(c1C 59 2018999 http://www. Alfa Aesar
    2639 2-fluoro-6-m COc1cccc(c1C 192 503924 http://www. Alfa Aesar
    2640 2-fluoro-6-meB(c1c(cccc1F) 125 2543135 http://www. Alfa Aesar
    2641 2-fluoro-6-meCOc1cccc(c1C 91 2019002 http://www. Alfa Aesar
    2642 2-fluoro-6-meCOc1cccc(c1C 103 456306 http://www.aAlfa Aesar
    2643 2-fluoro-6-meCOc1cccc(c1C 37 2059555 http://www. Alfa Aesar
    2644 2-fluoro-6-meCOc1cccc(c1C 20 2059557 http://www. Alfa Aesar
    2645 2-fluoro-6-ni c1cc(c(c(c1)F) 52 67350 http://www.aAlfa Aesar
    2646 2-fluoro-6-ni c1cc(c(c(c1)F) 93 66353 http://www.aAlfa Aesar
    2647 2-fluoro-6-nit Cc1c(cccc1F)[ 7 63050 http://www.aAlfa Aesar
    2648 2-fluoro-6-ph c1ccc(cc1)Oc2 92 2019091 http://www.aAlfa Aesar
    2649 2'-fluoroacetaCC(=O)Nc1ccc 78 61177 http://www.aAlfa Aesar
    2650 2-fluoro-alphaCC(c1ccc(c(c1 113 3277 http://www.aAlfa Aesar
    2651 2-fluoroanilin c1ccc(c(c1)N) -29 9208 http://www.aAlfa Aesar
    2652 2-fluoroanisolCOc1ccccc1F -39 13875445 http://www.aAlfa Aesar
    2653 2-fluorobenzac1ccc(c(c1)C= -45 21106521 http://www.aAlfa Aesar
    2654 2-fluorobenz c1ccc(c(c1)C( 116 61279 http://www.aAlfa Aesar
    2655 2-fluorobenzeB(c1ccccc1F)( 104 2016106 http://www.aAlfa Aesar
    2656 2-fluorobenzec1ccc(c(c1)F)S 30 121416 http://www.aAlfa Aesar
    2657 2-fluorobenzhc1ccc(c(c1)C( 73 120062 http://www.aAlfa Aesar
    2658 2-fluorobenzoic1ccc(c(c1)C( 124 9547 http://www.aAlfa Aesar
    2659 2-fluorobenzotc1ccc(c(c1)C(Cl -20 61413 http://www.aAlfa Aesar
    2660 2-fluorobenzotc1ccc(c(c1)C(F -49 9424 http://www.aAlfa Aesar
    2661 2-fluorobenzoy
    c1ccc(c(c1)C(= 5 9425 http://www.aAlfa Aesar
    2662 2-fluorobiphec1ccc(cc1)c2c 74 60900 http://www.aAlfa Aesar
    2663 2-fluorobiphenB(c1ccc(c(c1) 246 2055088 http://www.aAlfa Aesar
    2664 2-fluoro-D-phc1ccc(c(c1)C[ 210 625055 http://www. Alfa Aesar
    2665 2-fluoroethanC(CF)O -27 9354 http://www.aAlfa Aesar
    2666 2-fluoromandec1ccc(c(c1)C( 115 2063312 http://www.aAlfa Aesar
    2667 2-fluorophenoc1ccc(c(c1)O) 15 9326 http://www.aAlfa Aesar
    2668 2-fluorophenylc1ccc(c(c1)CC 63 61294 http://www.aAlfa Aesar
    2669 2-fluoropyridiB(c1cccnc1F)( 172 2063413 http://www.aAlfa Aesar
    2670 2-fluoropyridic1cnc(cc1C(=O 346 306289 http://www.aAlfa Aesar
    2671 2-fluoroquinolB(c1cc2ccccc2 92 2063414 http://www.aAlfa Aesar
    2672 2-fluorotolue Cc1ccccc1F -87 13875158 http://www.aAlfa Aesar
    2673 2-formylbenzeB(c1ccccc1C= 118 257820 http://www.aAlfa Aesar
    2674 2-formylphenoc1ccc(c(c1)C 133 42337 http://www.aAlfa Aesar
    2675 2-furaldehydec1cc(oc1)C=O -38 13863629 http://www.aAlfa Aesar
    2676 2-furamide c1cc(oc1)C(= 141 62325 http://www.aAlfa Aesar
    2677 2-furoic acid c1cc(oc1)C(= 130 10251740 http://www.aAlfa Aesar
    2678 2-furoic acid c1cc(oc1)C(= 79 17687 http://www.aAlfa Aesar
    2679 2-furoyl chlor c1cc(oc1)C(=O -1 13861158 http://www.aAlfa Aesar
    2680 2-furoylacetonc1cc(oc1)C(= 79 124986 http://www.aAlfa Aesar
    2681 2h-1,4-benzoxc1ccc2c(c1)N 174 65595 http://www. Alfa Aesar
    2682 2-heptanone CCCCCC(=O)C -35 7760 http://www.aAlfa Aesar
    2683 2-hexanone CCCCC(=O)C -56 11095 http://www.aAlfa Aesar
    2684 2-hexyne CCCC#CC -90 31016 http://www.aAlfa Aesar
    2685 2-hexynoic acCCCC#CC(=O) 25 287294 http://www.aAlfa Aesar
    2686 2h-pyrido[3,2 c1cc2c(nc1)N 206 79850 http://www.aAlfa Aesar
    2687 2-hydrazinobec1ccc2c(c1)nc 200 11493 http://www.aAlfa Aesar
    2688 2-hydroxy-1- c1ccc2c(c1)cc 79 12291 http://www.aAlfa Aesar
    2689 2-hydroxy-2-(tCC(C(=O)O)(C( 85 2055496 http://www.aAlfa Aesar
    2690 2-hydroxy-3,5-c1c(cnc(c1[N+ 178 68801 http://www.aAlfa Aesar
    2691 2-hydroxy-3-i Cc1cc(c(nc1)O 192 21242458 http://www. Alfa Aesar
    2692 2-hydroxy-3-mCOc1cc(cc(c1O 140 272164 http://www.aAlfa Aesar
    2693 2-hydroxy-3- COc1cccc(c1O 41 21105848 http://www.aAlfa Aesar
    2694 2-hydroxy-3-mCOc1cccc(c1O 152 63328 http://www.aAlfa Aesar
    2695 2-hydroxy-3-mCc1cc(cnc1O)[ 230 80395 http://www.aAlfa Aesar
    2696 2-hydroxy-3-mCc1cccc(c1O) 191 124930 http://www.aAlfa Aesar
    2697 2-hydroxy-3-mCc1c(nccn1)O 153 79636 http://www. Alfa Aesar
    2698 2-hydroxy-3-nc1cc(c(c(c1)[ 110 71268 http://www.aAlfa Aesar
    2699 2-hydroxy-4- CC(=C)C(=O)Oc 78 67421 http://www.aAlfa Aesar
    2700 2-hydroxy-4-(tc1cnc(cc1C(F) 159 2055501 http://www. Alfa Aesar
    2701 2'-hydroxy-4' CC(=O)c1c(cc 82 60021 http://www.aAlfa Aesar
    2702 2-hydroxy-4,6COc1cc(c(c(c 161 69118 http://www.aAlfa Aesar
    2703 2-hydroxy-4,6Cc1cc(nc(=O)[ 203 9136 http://www.aAlfa Aesar
    2704 2-hydroxy-4- Cc1ccc(cc1)C( 99 64706 http://www.aAlfa Aesar
    2705 2'-hydroxy-4 CC(=O)c1ccc( 49 10621 http://www.aAlfa Aesar
    2706 2-hydroxy-4- COc1ccc(c(c1 42 62803 http://www.aAlfa Aesar
    2707 2-hydroxy-4- COc1ccc(c(c1) 64 4471 http://www.aAlfa Aesar
    2708 2-hydroxy-4-mCc1cc(ncc1[N+ 189 306300 http://www.aAlfa Aesar
    2709 2-hydroxy-4-mCc1ccnc(c1)O 130 247223 http://www.aAlfa Aesar
    2710 2-hydroxy-4-mCc1cc(nc2c1c 226 62306 http://www.aAlfa Aesar
    2711 2-hydroxy-4- CCCCCCCCOc1c 48 15020 http://www.aAlfa Aesar
    2712 2'-hydroxy-5' CC(=O)c1cc(cc 30 2055474 http://www. Alfa Aesar
    2713 2-hydroxy-5-( c1cc(c(cc1OC( 32 1064749 http://www.aAlfa Aesar
    2714 2-hydroxy-5-( c1cc(c(cc1OC( 86 21242259 http://www. Alfa Aesar
    2715 2-hydroxy-5- COc1cc(cc(c1O 129 5383561 http://www.aAlfa Aesar
    2716 2-hydroxy-5-i c1cc(ncc1I)O 190 404403 http://www.aAlfa Aesar
    2717 2'-hydroxy-5 CC(=O)c1cc(c 49 62915 http://www.aAlfa Aesar
    2718 2-hydroxy-5- COc1ccc(c(c1 15 21168855 http://www.aAlfa Aesar
    2719 2-hydroxy-5-mCOc1ccc(c(c1 143 68296 http://www.aAlfa Aesar
    2720 2'-hydroxy-5' Cc1cc(c(c(c1) 135 643302 http://www. Alfa Aesar
    2721 2'-hydroxy-5' Cc1ccc(c(c1)N 149 258186 http://www.aAlfa Aesar
    2722 2'-hydroxy-5' Cc1ccc(c(c1)C 47 14340 http://www.aAlfa Aesar
    2723 2-hydroxy-5-mCc1ccc(nc1)O 185 63659 http://www.aAlfa Aesar
    2724 2-hydroxy-5-nc1cc(c(cc1[N+ 125 60173 http://www.aAlfa Aesar
    2725 2-hydroxy-5-nic1c(cnc(c1C(= 246 4296769 http://www. Alfa Aesar
    2726 2-hydroxy-5-nc1cc(ncc1[N+] 190 71770 http://www.aAlfa Aesar
    2727 2'-hydroxy-6 CC(=O)c1c(cc 58 62910 http://www.aAlfa Aesar
    2728 2-hydroxy-6- COc1cccc(c1C 71 62893 http://www.aAlfa Aesar
    2729 2-hydroxy-6-mCc1c(ccc(n1)O 235 472809 http://www. Alfa Aesar
    2730 2-hydroxy-6-mCc1ccc(c(n1)O 236 85682 http://www.aAlfa Aesar
    2731 2-hydroxy-6-mCc1cccc(n1)O 159 69228 http://www.aAlfa Aesar
    2732 2'-hydroxyac CC(=O)c1cccc 5 21105920 http://www.aAlfa Aesar
    2733 2-hydroxybenzB(c1ccccc1O) 185 2053870 http://www.aAlfa Aesar
    2734 2-hydroxybenc1ccc(c(c1)C( 148 13048 http://www.aAlfa Aesar
    2735 2-hydroxybenc1ccc2c(c1)[n 315 11490 http://www.aAlfa Aesar
    2736 2-hydroxybenzc1ccc(c(c1)C# 94 11413 http://www.aAlfa Aesar
    2737 2-hydroxybenc1ccc(cc1)C(= 39 8045 http://www.aAlfa Aesar
    2738 2-hydroxybenzc1ccc2c(c1)nc 138 13036 http://www.aAlfa Aesar
    2739 2-hydroxybenzc1ccc(c(c1)CO 85 4962 http://www.aAlfa Aesar
    2740 2-hydroxycarbc1ccc2c(c1)c3 272 84451 http://www. Alfa Aesar
    2741 2'-hydroxychac1ccc(cc1)/C= 90 553827 http://www.aAlfa Aesar
    2742 2-hydroxyethyCC(=C)C(=O) -12 12791 http://www.aAlfa Aesar
    2743 2-hydroxyisobu
    CC(C)(C(=O)O 79 11181 http://www.aAlfa Aesar
    2744 2-hydroxymetc1ccc2c(c1)O 89 18223 http://www.aAlfa Aesar
    2745 2-hydroxynicotc1cc(c(nc1)O) 259 62331 http://www.aAlfa Aesar
    2746 2-hydroxyoctaCCCCCCC(C(= 69 84994 http://www.aAlfa Aesar
    2747 2-hydroxyphen
    c1ccc(c(c1)O 128 21359 http://www.aAlfa Aesar
    2748 2-hydroxyphen
    c1ccc(c(c1)CC 146 11476 http://www.aAlfa Aesar
    2749 2-hydroxypyric1ccnc(c1)O 107 8537 http://www.aAlfa Aesar
    2750 2-hydroxyquinc1ccc2c(c1)cc 198 5816 http://www.aAlfa Aesar
    2751 2-indanol c1ccc2c(c1)CC 70 70326 http://www.aAlfa Aesar
    2752 2-indanone c1ccc2c(c1)CC 54 11488 http://www.aAlfa Aesar
    2753 2-indanyl p-t Cc1ccc(cc1)S 120 5384384 http://www.aAlfa Aesar
    2754 2-indanylacetic1ccc2c(c1)C 92 4347287 http://www.aAlfa Aesar
    2755 2'-iodo-1,1':3'c1ccc(cc1)c2c 115 3293258 http://www. Alfa Aesar
    2756 2-iodo-1,3,5- Cc1cc(c(c(c1)C 29 70050 http://www.aAlfa Aesar
    2757 2-iodo-1-methCn1ccnc1I 81 297628 http://www. Alfa Aesar
    2758 2-iodo-1-trity c1ccc(cc1)C(c 171 537291 http://www. Alfa Aesar
    2759 2-iodo-2-met CC(C)(C)I -38 10733 http://www.aAlfa Aesar
    2760 2-iodo-3-methCOc1cccnc1I 59 713868 http://www.aAlfa Aesar
    2761 2-iodo-3-methCc1cccc(c1I)C 152 2040114 http://www.aAlfa Aesar
    2762 2-iodo-4-(trif c1cc(c(cc1C(F) 51 2063465 http://www.aAlfa Aesar
    2763 2-iodo-4,6-dimCc1cc(c(c(c1)I 65 20582347 http://www. Alfa Aesar
    2764 2-iodo-5-nitroc1cc(ncc1[N+] 166 715988 http://www. Alfa Aesar
    2765 2-iodo-5-nitr Cc1cc(ccc1I)[ 102 71550 http://www.aAlfa Aesar
    2766 2-iodoacetamC(C(=O)N)I -94 3596 http://www.aAlfa Aesar x sign inversion JCB
    2767 2-iodoaniline c1ccc(c(c1)N)I 55 11500 http://www.aAlfa Aesar
    2768 2-iodobenzal c1ccc(c(c1)C= 37 558584 http://www.aAlfa Aesar
    2769 2-iodobenzoicc1ccc(c(c1)C( 162 6675 http://www.aAlfa Aesar
    2770 2-iodobenzoylc1ccc(c(c1)C(= 30 62329 http://www.aAlfa Aesar
    2771 2-iodobenzyl c1ccc(c(c1)CO) 91 96816 http://www.aAlfa Aesar
    2772 2-iodobenzyl c1ccc(c(c1)CBr 56 9601348 http://www.aAlfa Aesar
    2773 2-iodobutane CCC(C)I -104 10119 http://www.aAlfa Aesar
    2774 2-iodoimidazoc1cnc([nH]1)I 191 2053884 http://www. Alfa Aesar
    2775 2-iodophenol c1ccc(c(c1)O)I 40 10328 http://www.aAlfa Aesar
    2776 2-iodophenyl c1ccc(c(c1)N= 38 128183 http://www.aAlfa Aesar
    2777 2-iodophenylac1ccc(c(c1)CC 116 2060306 http://www.aAlfa Aesar
    2778 2-iodopropan CC(C)I -90 6122 http://www.aAlfa Aesar
    2779 2-iodopyridin c1cnc(cc1C(=O 165 21927913 http://www. Alfa Aesar
    2780 2-iodothioph c1cc(sc1)I -40 17866 http://www.aAlfa Aesar
    2781 2-isopropoxyeCC(C)OCCO -60 7705 http://www.aAlfa Aesar
    2782 2'-isopropylacCC(C)c1ccccc 73 2018342 http://www.aAlfa Aesar
    2783 2-isopropylbeB(c1ccccc1C(C 86 2053893 http://www.aAlfa Aesar
    2784 2-isopropylbeCC(C)c1[nH]c 235 20780 http://www.aAlfa Aesar
    2785 2-isopropylimCC(C)c1[nH]c 129 110053 http://www.aAlfa Aesar
    2786 2-isopropylnaCC(C)c1ccc2cc 14 15410 http://www.aAlfa Aesar
    2787 2-isopropylphCC(C)c1ccccc 15 6677 http://www.aAlfa Aesar
    2788 2-ketoglutaricC(CC(=O)O)C( 115 50 http://www.aAlfa Aesar
    2789 2-mercapto-1,c1nnc(s1)S 143 2298787 http://www.aAlfa Aesar
    2790 2-mercapto-1-Cn1ccnc1S 146 1131173 http://www.aAlfa Aesar
    2791 2-mercapto-4-Cc1csc(n1)S 88 1013221 http://www.aAlfa Aesar
    2792 2-mercapto-4-c1ccc(cc1)c2c 174 2272272 http://www.aAlfa Aesar
    2793 2-mercapto-5-COc1ccc2c(n1) 240 9301999 http://www. Alfa Aesar
    2794 2-mercapto-5COc1ccc2c(c1) 257 579127 http://www.aAlfa Aesar
    2795 2-mercapto-5COc1ccc2c(c1) 196 2108521 http://www.aAlfa Aesar
    2796 2-mercapto-5-Cc1nnc(s1)S 184 1414905 http://www.aAlfa Aesar
    2797 2-mercapto-5-CCCc1cnc(nc1 209 21242373 http://www. Alfa Aesar
    2798 2-mercapto-6-c1cc2c(cc1[N+ 252 823571 http://www.aAlfa Aesar
    2799 2-mercapto-7Cc1cc(nc2c1cc 234 589577 http://www. Alfa Aesar
    2800 2-mercaptobec1ccc2c(c1)[n 303 616466 http://www.aAlfa Aesar
    2801 2-mercaptobec1ccc2c(c1)nc 180 608157 http://www.aAlfa Aesar
    2802 2-mercaptobec1ccc2c(c1)nc 192 621391 http://www.aAlfa Aesar
    2803 2-mercaptoben
    c1ccc(c(c1)CO 32 121911 http://www.aAlfa Aesar
    2804 2-mercaptoetC(CS)O -100 1512 http://www.aAlfa Aesar
    2805 2-mercaptoimc1cnc([nH]1)S 225 1013196 http://www.aAlfa Aesar
    2806 2-mercaptoproCC(C(=O)O)S 11 56121 http://www.aAlfa Aesar
    2807 2-mercaptopyrc1ccnc(c1)S 127 2005897 http://www.aAlfa Aesar
    2808 2-mercaptopyrc1cc[n+](c(c1) 71 10446934 http://www.aAlfa Aesar
    2809 2-mercaptothic1csc(n1)S 79 1013197 http://www.aAlfa Aesar
    2810 2-mercaptothiC1CSC(=S)N1 105 2005898 http://www.aAlfa Aesar
    2811 2-mesitylethaCc1cc(c(c(c1) 82 73437 http://www.aAlfa Aesar
    2812 2-methoxy-1- COc1ccc2cccc 83 71672 http://www.aAlfa Aesar
    2813 2-methoxy-3-nCOc1c(cccn1)[ 54 221926 http://www.aAlfa Aesar
    2814 2-methoxy-4-(COc1cc(ccc1C# 35 4360030 http://www. Alfa Aesar
    2815 2-methoxy-4- Cc1ccc(c(c1)O 169 4269251 http://www.aAlfa Aesar
    2816 2-methoxy-4-m
    Cc1ccc(c(c1)O 87 9519986 http://www.aAlfa Aesar
    2817 2-methoxy-4- Cc1ccc(c(c1)O 6 21105936 http://www.aAlfa Aesar
    2818 2-methoxy-4-nCOc1cc(ccc1N) 140 7060 http://www.aAlfa Aesar
    2819 2-methoxy-4-nCOc1cc(ccc1S( 97 273612 http://www.aAlfa Aesar
    2820 2-methoxy-4-nCOc1cc(ccc1C( 147 68287 http://www.aAlfa Aesar
    2821 2-methoxy-4-nCOc1cc(ccc1C# 179 257521 http://www. Alfa Aesar
    2822 2-methoxy-4-nCOc1cc(ccc1N 108 530992 http://www.aAlfa Aesar
    2823 2-methoxy-4-vCOc1cc(ccc1O 27 325 http://www.aAlfa Aesar
    2824 2'-methoxy-5'CC(=O)c1cc(cc 46 21379297 http://www. Alfa Aesar
    2825 2-methoxy-5-(COc1ccc(cc1C= 23 2063506 http://www. Alfa Aesar
    2826 2-methoxy-5-(COc1ccc(cc1C( 64 2055652 http://www. Alfa Aesar
    2827 2-methoxy-5-(COc1ccc(cc1N) 58 522188 http://www.aAlfa Aesar
    2828 2-methoxy-5-(COc1ccc(cc1C= 87 2059507 http://www. Alfa Aesar
    2829 2-methoxy-5-(COc1ccc(cc1C( 110 13664240 http://www. Alfa Aesar
    2830 2-methoxy-5-(COc1ccc(cc1C# 32 13493642 http://www. Alfa Aesar
    2831 2-methoxy-5-(COc1ccc(cc1CB 36 16499500 http://www. Alfa Aesar
    2832 2-methoxy-5- Cc1ccc(c(c1)O 37 13863 http://www.aAlfa Aesar
    2833 2-methoxy-5-nCOc1ccc(cc1N) 117 7167 http://www.aAlfa Aesar
    2834 2-methoxy-5-nCOc1ccc(cc1C( 157 250369 http://www. Alfa Aesar
    2835 2-methoxy-5-nCOc1ccc(cc1O) 105 62678 http://www.aAlfa Aesar
    2836 2-methoxybenCOc1ccccc1C 37 21111781 http://www.aAlfa Aesar
    2837 2-methoxybenCOc1ccccc1C( 129 68065 http://www.aAlfa Aesar
    2838 2-methoxybenB(c1ccccc1OC 104 2015720 http://www.aAlfa Aesar
    2839 2-methoxybenCOc1ccccc1C( 80 22483 http://www.aAlfa Aesar
    2840 2-methoxybenz
    COc1ccccc1C( 101 10892 http://www.aAlfa Aesar
    2841 2-methoxybe COc1ccccc1C( 37 68220 http://www.aAlfa Aesar
    2842 2-methoxybipCOc1ccccc1c2 30 6574 http://www.aAlfa Aesar
    2843 2-methoxycrotC/C=C(/C(=O) 58 5894650 http://www.aAlfa Aesar
    2844 2-methoxyethCOCCO -85 7728 http://www.aAlfa Aesar
    2845 2-methoxyethCOCCN -82 7727 http://www.aAlfa Aesar
    2846 2-methoxyhydCOc1cc(ccc1O 89 63180 http://www.aAlfa Aesar
    2847 2-methoxynapCOc1ccc2cccc 72 6852 http://www.aAlfa Aesar
    2848 2-methoxynicoCOc1c(cccn1) 149 617437 http://www.aAlfa Aesar
    2849 2-methoxypheCOc1ccccc1O 30 447 http://www.aAlfa Aesar
    2850 2-methoxyphen
    COc1ccccc1O 120 15095 http://www.aAlfa Aesar
    2851 2-methoxypheCOc1ccccc1OC 59 61569 http://www.aAlfa Aesar
    2852 2-methoxyphen
    COc1ccccc1CC 124 6867 http://www.aAlfa Aesar
    2853 2-methoxyphen
    COc1ccccc1C 68 73531 http://www.aAlfa Aesar
    2854 2-methoxypyriB(c1cccnc1OC 137 2043409 http://www.aAlfa Aesar
    2855 2-methyl-1,4 CC1=CC(=O)c2 106 3915 http://www.aAlfa Aesar
    2856 2-methyl-1-buCC(=C)C#C -113 56118 http://www.aAlfa Aesar
    2857 2-methyl-1-b CCC(=C)C -137 10766 http://www. Alfa Aesar
    2858 2-methyl-1-p CCCC(=C)C -136 12446 http://www. Alfa Aesar
    2859 2-methyl-1-phCC(C)(Cc1cccc 24 7250 http://www.aAlfa Aesar
    2860 2-methyl-2-(pCc1ccc(cc1)C 50 21242637 http://www. Alfa Aesar
    2861 2-methyl-2,4-CC(CC(C)(C)O -40 13884973 http://www.aAlfa Aesar
    2862 2-methyl-2-a CC1(C2CC3CC( 216 120313 http://www.aAlfa Aesar
    2863 2-methyl-2-buCCC(C)(C)O -12 6165 http://www.aAlfa Aesar
    2864 2-methyl-2-b CC=C(C)C -134 10113 http://www.aAlfa Aesar
    2865 2-methyl-2-imCC1=NCCN1 100 10341 http://www.aAlfa Aesar
    2866 2-methyl-2-niCC(CO)(CO)[N+ 150 6235 http://www.aAlfa Aesar
    2867 2-methyl-2-peCCCC(C)(C)O -103 11056 http://www.aAlfa Aesar
    2868 2-methyl-2-p CC1(CNCCO1)c 36 2326301 http://www. Alfa Aesar
    2869 2-methyl-2-thCC1=NCCS1 -101 15985 http://www.aAlfa Aesar
    2870 2-methyl-3-(trCc1c(cccc1N)C 39 2017614 http://www.aAlfa Aesar
    2871 2-methyl-3-(trCc1c(cccc1C(F 30 2059174 http://www. Alfa Aesar
    2872 2-methyl-3,5-dCc1c(cc(cc1[N 205 89258 http://www.aAlfa Aesar
    2873 2-methyl-3-buCC(C)(C=C)O -28 7959 http://www.aAlfa Aesar
    2874 2-methyl-3-buCC(C)(C#C)O 3 21106133 http://www.aAlfa Aesar
    2875 2-methyl-3-furCc1c(cco1)C( 98 214059 http://www.aAlfa Aesar
    2876 2-methyl-3-nitCc1c(cccc1[N+ 90 11290 http://www.aAlfa Aesar
    2877 2-methyl-3-niCc1c(cccc1OC) 53 70915 http://www.aAlfa Aesar
    2878 2-methyl-3-niCc1c(cccc1[N+ 184 15284 http://www.aAlfa Aesar
    2879 2-methyl-3-niCc1c(cccc1O)[ 150 71887 http://www.aAlfa Aesar
    2880 2-methyl-3-niCc1c(cccc1[N 36 3395646 http://www.aAlfa Aesar
    2881 2'-methyl-4'-nCc1cc(ccc1NC( 199 68440 http://www.aAlfa Aesar
    2882 2-methyl-4-nitCc1cc(ccc1N)[ 132 7163 http://www.aAlfa Aesar
    2883 2-methyl-4-niCc1cc(ccc1C(= 154 67359 http://www. Alfa Aesar
    2884 2-methyl-4-niCc1cc(ccc1N= 83 3502471 http://www.aAlfa Aesar
    2885 2-methyl-4-phCc1nc(cs1)c2c 54 507952 http://www. Alfa Aesar
    2886 2-methyl-5-(trCc1ccc(cc1N)C 38 2017615 http://www.aAlfa Aesar
    2887 2-methyl-5-(trCc1ccc(cc1C(= 124 2055918 http://www. Alfa Aesar
    2888 2-methyl-5-niCn1cc2cc(ccc2 129 88046 http://www.aAlfa Aesar
    2889 2-methyl-5-nitCc1ccc(cc1N)[ 107 7166 http://www.aAlfa Aesar
    2890 2-methyl-5-niCc1ccc(cc1S(= 44 8146 http://www.aAlfa Aesar
    2891 2-methyl-5-niCc1ccc(cc1C(= 179 453303 http://www.aAlfa Aesar
    2892 2-methyl-5-nitCc1ccc(cc1C#N 106 310867 http://www.aAlfa Aesar
    2893 2-methyl-5-niCc1nc2cc(ccc2 133 68730 http://www.aAlfa Aesar
    2894 2-methyl-5-niCc1ccc(cc1O)[ 118 84472 http://www.aAlfa Aesar
    2895 2-methyl-5-niCc1ccc(cc1N= 51 258211 http://www.aAlfa Aesar
    2896 2-methyl-5-phe
    Cc1c(cc(o1)c2 183 643637 http://www.aAlfa Aesar
    2897 2-methyl-5-phCc1ccc(s1)c2c 48 5895565 http://www.aAlfa Aesar
    2898 2-methyl-6-nitCc1cccc(c1N)[ 95 10824 http://www.aAlfa Aesar
    2899 2-methyl-6-niCc1cccc(c1C(= 155 15285 http://www.aAlfa Aesar
    2900 2-methyl-6-niCc1nc2ccc(cc2 155 72064 http://www.aAlfa Aesar
    2901 2-methyl-6-niCc1ccc2cc(ccc 164 62387 http://www.aAlfa Aesar
    2902 2-methyl-8-niCc1ccc2cccc(c 138 12858 http://www.aAlfa Aesar
    2903 2'-methylacetCc1ccccc1NC( 111 10298354 http://www.aAlfa Aesar
    2904 2-methylanth Cc1ccc2c(c1) 172 6515 http://www.aAlfa Aesar
    2905 2-methylbenzeB(c1ccccc1C)( 163 2015070 http://www.aAlfa Aesar
    2906 2-methylbenzCc1ccccc1C(c2 94 21172151 http://www.aAlfa Aesar
    2907 2-methylbenzCc1[nH]c2ccc 176 11489 http://www.aAlfa Aesar
    2908 2-methylbenzCc1cc2ccccc2 52 64114 http://www. Alfa Aesar
    2909 2-methylbenzCc1ccccc1C(= -18 60565 http://www.aAlfa Aesar
    2910 2-methylbenzoCc1nc2cc(ccc 186 609841 http://www. Alfa Aesar
    2911 2-methylbenzoCc1nc2ccccc2 12 8138 http://www.aAlfa Aesar
    2912 2-methylbenzCc1nc2ccccc2 3 6955 http://www.aAlfa Aesar
    2913 2-methylbenzyCc1ccccc1CO 35 6728 http://www.aAlfa Aesar
    2914 2-methylbenzCc1ccccc1CBr 19 6726 http://www.aAlfa Aesar
    2915 2-methylbenzyCc1ccccc1CCl 2 21106134 http://www.aAlfa Aesar
    2916 2-methylbenzyCc1ccccc1CP( 186 494610 http://www.aAlfa Aesar
    2917 2-methylbipheCc1ccccc1c2cc 0 12044 http://www.aAlfa Aesar
    2918 2-methylcycloCC1C(=O)CCC 206 64107 http://www.aAlfa Aesar
    2919 2-methylcycl CC1CCCCC1=O -14 10939 http://www.aAlfa Aesar
    2920 2-methylcycloCC1C(=O)CCC 214 12464 http://www.aAlfa Aesar
    2921 2-methylformaCc1ccccc1NC 59 6933 http://www.aAlfa Aesar
    2922 2-methylfuranCc1ccco1 -89 10340 http://www.aAlfa Aesar
    2923 2-methylglutarCC(CCC(=O)O) 76 11549 http://www.aAlfa Aesar
    2924 2-methylhydr Cc1cc(ccc1O) 129 6983 http://www.aAlfa Aesar
    2925 2-methylimidaCc1[nH]c2ccn 177 331008 http://www.aAlfa Aesar
    2926 2-methylimidaCc1[nH]ccn1 143 12225 http://www.aAlfa Aesar
    2927 2-methylindolCc1cc2ccccc2 58 6954 http://www.aAlfa Aesar
    2928 2-methylmaloCC(C(=O)N)C( 209 198208 http://www.aAlfa Aesar
    2929 2-methylnaphCc1ccc2ccccc 33 6788 http://www.aAlfa Aesar
    2930 2-methylnaphtCc1nc2c3cccc 96 68397 http://www.aAlfa Aesar
    2931 2-methylnaphtCc1nc2cc3ccc 87 124136 http://www.aAlfa Aesar
    2932 2-methylpent CCCC(C)C -154 7604 http://www.aAlfa Aesar
    2933 2-methylpheno
    Cc1ccccc1OCC 154 67226 http://www.aAlfa Aesar
    2934 2-methylpiperCC1CCCCN1 -4 7686 http://www.aAlfa Aesar
    2935 2-methylpyrazCc1cnccn1 -30 7688 http://www.aAlfa Aesar
    2936 2-methylpyrazCc1cnc(cn1)C 166 109495 http://www.aAlfa Aesar
    2937 2-methylresorCc1c(cccc1O) 120 11350 http://www.aAlfa Aesar
    2938 2-methylstyreCc1ccccc1C=C -69 11410 http://www.aAlfa Aesar
    2939 2-methyltetraCC1CCCO1 -136 7028 http://www.aAlfa Aesar
    2940 2-methylthio Cc1cccs1 -63 21168808 http://www.aAlfa Aesar
    2941 2-methylvalerCCCC(C)C=O -100 28985 http://www.aAlfa Aesar
    2942 2-methylvaleriCCCC(C)C(=O) -85 7064 http://www.aAlfa Aesar
    2943 2-naphthalde c1ccc2cc(ccc2 61 5966 http://www.aAlfa Aesar
    2944 2-naphthaleneB(c1ccc2ccccc 267 2016127 http://www.aAlfa Aesar
    2945 2-naphthoic ac1ccc2cc(ccc2 184 6856 http://www.aAlfa Aesar
    2946 2-naphthoic hc1ccc2cc(ccc 147 110080 http://www.aAlfa Aesar
    2947 2-naphthol c1ccc2cc(ccc2 122 8341 http://www.aAlfa Aesar
    2948 2-naphthoxyacc1ccc2cc(ccc 156 8115 http://www.aAlfa Aesar
    2949 2-naphthoyl cc1ccc2cc(ccc2 50 67790 http://www.aAlfa Aesar
    2950 2-naphthyl ac CC(=O)Oc1ccc 69 66352 http://www.aAlfa Aesar
    2951 2-naphthyl bec1ccc(cc1)C(= 107 60100 http://www.aAlfa Aesar
    2952 2-naphthyl is c1ccc2cc(ccc 55 15849 http://www. Alfa Aesar
    2953 2-naphthylacet
    c1ccc2cc(ccc2 142 10915 http://www.aAlfa Aesar
    2954 2-naphthylacet
    c1ccc2cc(ccc 83 21112279 http://www.aAlfa Aesar
    2955 2-n-butoxyethCCCCOCCO -79 13836399 http://www.aAlfa Aesar
    2956 2-n-hexyldecaCCCCCCCCC(C 10 30486 http://www.aAlfa Aesar
    2957 2-nitro-4-(tri c1cc(c(cc1C(F) 107 61182 http://www.aAlfa Aesar
    2958 2-nitro-4-(tri c1cc(c(cc1C(F) 43 2056110 http://www.aAlfa Aesar
    2959 2-nitro-4-(tri c1cc(c(cc1C(F 42 63097 http://www.aAlfa Aesar
    2960 2-nitro-4-(tri c1cc(c(cc1C(F 64 24583653 http://www. Alfa Aesar
    2961 2-nitro-4-(tri c1cc(c(cc1C(F) 38 2040984 http://www. Alfa Aesar
    2962 2-nitro-4-(tri c1cc(c(cc1C(F) 44 2056116 http://www. Alfa Aesar
    2963 2-nitro-4-(tri c1cc(c(cc1C(F 40 2056122 http://www.aAlfa Aesar
    2964 2-nitro-5-(1-pc1cc(c(cc1N2C 69 2054880 http://www.aAlfa Aesar
    2965 2-nitro-5-(tri c1cc(c(cc1C(F) 100 193733 http://www.aAlfa Aesar
    2966 2'-nitroacetanCC(=O)Nc1cccc 92 10619 http://www.aAlfa Aesar
    2967 2'-nitroaceto CC(=O)c1ccccc 27 10868 http://www.aAlfa Aesar
    2968 2-nitroaniline c1ccc(c(c1)N) 72 13853943 http://www.aAlfa Aesar
    2969 2-nitroanisoleCOc1ccccc1[N+ 10 6781 http://www.aAlfa Aesar
    2970 2-nitrobenzal c1ccc(c(c1)C= 45 10630 http://www.aAlfa Aesar
    2971 2-nitrobenzal c1ccc(c(c1)C= 100 86743 http://www.aAlfa Aesar
    2972 2-nitrobenza c1ccc(c(c1)C( 176 11178542 http://www.aAlfa Aesar
    2973 2-nitrobenzenB(c1ccccc1[N+ 150 2053964 http://www.aAlfa Aesar
    2974 2-nitrobenzene
    c1ccc(c(c1)[N+ 74 22737 http://www.aAlfa Aesar
    2975 2-nitrobenzenc1ccc(c(c1)[N 191 122128 http://www.aAlfa Aesar
    2976 2-nitrobenzenc1ccc(c(c1)[N 67 14784 http://www.aAlfa Aesar
    2977 2-nitrobenzhyc1ccc(c(c1)C( 121 3009396 http://www.aAlfa Aesar
    2978 2-nitrobenzoicc1ccc(c(c1)C( 148 10616 http://www.aAlfa Aesar
    2979 2-nitrobenzonic1ccc(c(c1)C# 109 11428 http://www.aAlfa Aesar
    2980 2-nitrobenzyl c1ccc(c(c1)CO 72 11429 http://www.aAlfa Aesar
    2981 2-nitrobenzyl c1ccc(c(c1)CB 47 69974 http://www.aAlfa Aesar
    2982 2-nitrobenzyl c1ccc(c(c1)CCl 49 11427 http://www.aAlfa Aesar
    2983 2-nitrochalco c1ccc(cc1)C(= 126 4494729 http://www.aAlfa Aesar
    2984 2-nitroethanoC(CO)[N+](=O) -80 11751 http://www.aAlfa Aesar
    2985 2-nitro-m-xyl Cc1cccc(c1[N+ 15 6420 http://www.aAlfa Aesar
    2986 2-nitrophenolc1ccc(c(c1)[N 46 13837787 http://www.aAlfa Aesar
    2987 2-nitrophenoxc1ccc(c(c1)[N 158 15096 http://www.aAlfa Aesar
    2988 2-nitrophenyl c1ccc(c(c1)N= 75 121348 http://www.aAlfa Aesar
    2989 2-nitrophenylac1ccc(c(c1)CC 141 69754 http://www.aAlfa Aesar
    2990 2-nitrophenylac1ccc(c(c1)CC 83 11395 http://www.aAlfa Aesar
    2991 2-nitrophlorogc1c(cc(c(c1O) 189 77119 http://www.aAlfa Aesar
    2992 2-nitroresorci c1cc(c(c(c1)O 83 11267 http://www.aAlfa Aesar
    2993 2-nitroterephtCOC(=O)c1ccc( 175 89037 http://www. Alfa Aesar
    2994 2-nitroterephtCOC(=O)c1ccc( 134 10656979 http://www. Alfa Aesar
    2995 2-nitrothioph c1cc(sc1)[N+] 44 11373 http://www.aAlfa Aesar
    2996 2-nitrothiophec1c(csc1[N+]( 122 125775 http://www.aAlfa Aesar
    2997 2-nitrothioph c1c(csc1[N+]( 80 127689 http://www.aAlfa Aesar
    2998 2-nitrothiophec1c(csc1[N+]( 147 2057552 http://www.aAlfa Aesar
    2999 2-nitrotoluen Cc1ccccc1[N+] -4 21106144 http://www.aAlfa Aesar
    3000 2-nonadecanoCCCCCCCCCCC 55 62631 http://www.aAlfa Aesar
    3001 2-nonanol CCCCCCCC(C) -35 11861 http://www.aAlfa Aesar
    3002 2-nonanone CCCCCCCC(=O -15 12632 http://www.aAlfa Aesar
    3003 2-n-propylresoCCCc1c(cccc1 103 230102 http://www. Alfa Aesar
    3004 2-octanone CCCCCCC(=O) -16 7802 http://www.aAlfa Aesar
    3005 2-oxazolidino C1COC(=O)N1 87 66579 http://www.aAlfa Aesar
    3006 2-oxocyclopent
    C1CC(C(=O)C1 49 2807132 http://www. Alfa Aesar
    3007 2-pentadecanCCCCCCCCCCC 39 55242 http://www.aAlfa Aesar
    3008 2-pentanone CCCC(=O)C -78 7607 http://www.aAlfa Aesar
    3009 2-pentyne CCC#CC -109 11807 http://www.aAlfa Aesar
    3010 2-pentynoic aCCC#CC(=O)O 50 287293 http://www. Alfa Aesar
    3011 2-phenoxyacec1ccc(cc1)OC 102 62524 http://www.aAlfa Aesar
    3012 2-phenoxyanilc1ccc(cc1)Oc2 47 68404 http://www.aAlfa Aesar
    3013 2-phenoxybenz
    c1ccc(cc1)Oc 113 67782 http://www.aAlfa Aesar
    3014 2-phenoxybipc1ccc(cc1)c2c 49 73277 http://www.aAlfa Aesar
    3015 2-phenoxyethc1ccc(cc1)OC 12 13848467 http://www.aAlfa Aesar
    3016 2-phenoxyethc1ccc(cc1)OC 33 61801 http://www.aAlfa Aesar
    3017 2-phenoxyethyc1ccc(cc1)OCC 24 21168833 http://www.aAlfa Aesar
    3018 2-phenoxynicoc1ccc(cc1)Oc2 181 110046 http://www.aAlfa Aesar
    3019 2-phenoxyprop
    CC(C(=O)O)Oc 118 13069 http://www.aAlfa Aesar
    3020 2-phenyl-2-prCC(C)(c1ccccc 32 11556 http://www.aAlfa Aesar
    3021 2-phenyl-3-buCC(C#C)(c1ccc 49 83147 http://www.aAlfa Aesar
    3022 2-phenyl-5-oxc1ccc(cc1)C2 91 9427205 http://www.aAlfa Aesar
    3023 2-phenylanth c1ccc(cc1)c2c 162 277768 http://www. Alfa Aesar
    3024 2-phenylbenzic1ccc(cc1)c2[ 297 12324 http://www.aAlfa Aesar
    3025 2-phenylbenzoc1ccc(cc1)c2n 114 12864 http://www.aAlfa Aesar
    3026 2-phenylbenz c1ccc(cc1)c2n 103 63220 http://www.aAlfa Aesar
    3027 2-phenylcycl c1ccc(cc1)C2 58 86285 http://www.aAlfa Aesar
    3028 2-phenylethanc1ccc(cc1)CC -27 5830 http://www.aAlfa Aesar
    3029 2-phenylethylCC(=O)OCCc1c -31 21105987 http://www.aAlfa Aesar
    3030 2-phenylethy c1ccc(cc1)CCN -60 13856352 http://www.aAlfa Aesar
    3031 2-phenylhydr c1ccc(cc1)c2c 101 13493 http://www.aAlfa Aesar
    3032 2-phenylimidac1ccc(cc1)c2[ 148 62795 http://www.aAlfa Aesar
    3033 2-phenylindolc1ccc(cc1)c2c 190 13105 http://www.aAlfa Aesar
    3034 2-phenylindolc1ccc(cc1)c2c 251 533133 http://www.aAlfa Aesar
    3035 2-phenylphenc1ccc(cc1)c2c 56 13839012 http://www.aAlfa Aesar
    3036 2-phenylpiperc1ccc(cc1)C2 85 219555 http://www. Alfa Aesar
    3037 2-phenylpropiCC(c1ccccc1) -5 9874 http://www.aAlfa Aesar
    3038 2-phenylpyridc1ccc(cc1)c2c -5 13286 http://www.aAlfa Aesar
    3039 2-phenylquinoc1ccc(cc1)c2c 83 64618 http://www. Alfa Aesar
    3040 2-phenylquinolc1ccc(cc1)c2c 215 8274 http://www.aAlfa Aesar
    3041 2-phosphonobu
    CCC(C(=O)O)P 125 3397533 http://www.aAlfa Aesar
    3042 2-phosphonopr
    CC(C(=O)O)P( 120 65949 http://www.aAlfa Aesar
    3043 2-phthalimidoCC(C(=O)O)N1 163 78381 http://www.aAlfa Aesar
    3044 2-picoline Cc1ccccn1 -70 13839199 http://www.aAlfa Aesar
    3045 2-picoline n-oCc1cccc[n+]1[ 48 13013 http://www.aAlfa Aesar
    3046 2-picolinic aci c1ccnc(c1)C(= 137 993 http://www.aAlfa Aesar
    3047 2-piperazinonC1CNC(=O)CN 132 201574 http://www.aAlfa Aesar
    3048 2-propanesulfCC(C)S(=O)(=O -47 74370 http://www.aAlfa Aesar
    3049 2-propanethioCC(C)S -131 6124 http://www.aAlfa Aesar
    3050 2-propanol CC(C)O -90 3644 http://www.aAlfa Aesar
    3051 2-propionylfu CCC(=O)c1ccc 28 69124 http://www. Alfa Aesar
    3052 2-propionylpyCCC(=O)c1ccc 50 55200 http://www.aAlfa Aesar
    3053 2-pyridineacec1ccnc(c1)CC 119 197575 http://www.aAlfa Aesar
    3054 2-pyridineacetc1ccnc(c1)CC 24 68462 http://www.aAlfa Aesar
    3055 2-pyridinemetc1ccnc(c1)CO -6 10990 http://www.aAlfa Aesar
    3056 2-pyridinesulfc1ccnc(c1)S( 78 453012 http://www.aAlfa Aesar
    3057 2-pyrrolidino C1CC(=O)NC1 24 11530 http://www.aAlfa Aesar
    3058 2-sec-butylphCCC(C)c1cccc 10 6718 http://www.aAlfa Aesar
    3059 2-sulfobenzoi c1ccc2c(c1)C 120 59152 http://www.aAlfa Aesar
    3060 2-tert-butyl- Cc1ccc(c(c1)C 52 16109 http://www.aAlfa Aesar
    3061 2-tert-butyl-4 Cc1c(sc(n1)C( 156 14460314 http://www. Alfa Aesar
    3062 2-tert-butyl- Cc1cccc(c1N= 37 2737861 http://www.aAlfa Aesar
    3063 2-tert-butyla CC(C)(C)c1ccc 99 59903 http://www.aAlfa Aesar
    3064 2-tert-butylp CC(C)(C)c1ccc -7 6657 http://www.aAlfa Aesar
    3065 2-tert-butylprCC(C)(C)C(CO 55 90576 http://www.aAlfa Aesar
    3066 2-tetralone c1ccc2c(c1)C 18 61564 http://www.aAlfa Aesar
    3067 2-thionaphthoc1ccc2cc(ccc2 81 6791 http://www.aAlfa Aesar
    3068 2-thiophenea c1cc(sc1)CC(= 147 70584 http://www.aAlfa Aesar
    3069 2-thiopheneacc1cc(sc1)CC(= 63 15174 http://www.aAlfa Aesar
    3070 2-thiophenemc1cc(sc1)CO 0 62674 http://www.aAlfa Aesar
    3071 2-tridecanol CCCCCCCCCCC 25 14701 http://www.aAlfa Aesar
    3072 2-tridecanoneCCCCCCCCCCC 30 11132 http://www.aAlfa Aesar
    3073 2-triisopropylsCC(C)[Si](C1S 48 3790600 http://www. Alfa Aesar
    3074 2-undecanol CCCCCCCCCC( 2 14700 http://www.aAlfa Aesar
    3075 2-undecanoneCCCCCCCCCC( 12 7871 http://www.aAlfa Aesar
    3076 2-vinylbenzenB(c1ccccc1C= 106 2054002 http://www.aAlfa Aesar
    3077 2-vinylbenzoicC=Cc1ccccc1C 94 2283633 http://www. Alfa Aesar
    3078 2-vinylnaphthC=Cc1ccc2ccc 65 12675 http://www.aAlfa Aesar
    3079 2-vinylpyridinC=Cc1ccccn1 -50 7240 http://www.aAlfa Aesar
    3080 3-(1h-tetrazolc1cc(cc(c1)N) 204 90932 http://www.aAlfa Aesar
    3081 3-(1h-tetrazolc1cc(cc(c1)C( 285 295920 http://www. Alfa Aesar
    3082 3-(1h-tetrazolc1cc(cc(c1)c2 209 21242322 http://www. Alfa Aesar
    3083 3-(1-naphthyl)c1ccc2c(c1)cc 211 1250976 http://www.aAlfa Aesar
    3084 3-(1-piperazinc1ccc2c(c1)c 75 10766340 http://www. Alfa Aesar
    3085 3-(1-piperazinc1cc(cc(c1)O 207 2018259 http://www.aAlfa Aesar
    3086 3-(1-piperidi c1cc(cc(c1)O 140 722291 http://www. Alfa Aesar
    3087 3-(2,4-dichlor c1cc(c(cc1Cl) 91 2022499 http://www. Alfa Aesar
    3088 3-(2,6-dichlo C#CCOc1c(cccc 44 2057177 http://www.aAlfa Aesar
    3089 3-(2,6-dichlor Cc1c(c(no1)c2 223 69928 http://www.aAlfa Aesar
    3090 3-(2-carboxyvB(c1cccc(c1)/ 218 4720445 http://www.aAlfa Aesar
    3091 3-(2-chloro-6-Cc1c(c(no1)c2 51 2018243 http://www.aAlfa Aesar
    3092 3-(2-chloro-6-Cc1c(c(no1)c2 202 69927 http://www.aAlfa Aesar
    3093 3-(2-chlorophCc1c(c(no1)c2 42 87202 http://www.aAlfa Aesar
    3094 3-(2-chloropheCc1c(c(no1)c2 190 81435 http://www.aAlfa Aesar
    3095 3-(2-chlorophec1ccc(c(c1)CC 96 86367 http://www.aAlfa Aesar
    3096 3-(2-furyl)-2- c1ccc(cc1)C(= 59 21105990 http://www.aAlfa Aesar
    3097 3-(2-furyl)acroc1cc(oc1)/C= 51 1266397 http://www.aAlfa Aesar
    3098 3-(2-furyl)acryc1cc(oc1)/C= 142 558553 http://www.aAlfa Aesar
    3099 3-(2-furyl)pro c1cc(oc1)CCC 58 63470 http://www. Alfa Aesar
    3100 3-(2-hydroxypc1ccc(c(c1)CC 87 850 http://www.aAlfa Aesar
    3101 3-(2-methoxypCOc1ccccc1O 81 3396 http://www.aAlfa Aesar
    3102 3-(2-methoxypCOc1ccccc1CC 87 72837 http://www.aAlfa Aesar
    3103 3-(2-methyl-4-Cc1nc(cn1CCC 115 283057 http://www.aAlfa Aesar
    3104 3-(2-methylphCc1ccccc1OCC 70 3919 http://www.aAlfa Aesar
    3105 3-(2-naphthyltc1ccc2cc(ccc 105 451940 http://www.aAlfa Aesar
    3106 3-(2-piperazinc1cc(cc(c1)O 184 14904390 http://www. Alfa Aesar
    3107 3-(2-thienyl)- Cc1ccc(cc1)C( 79 455275 http://www.aAlfa Aesar
    3108 3-(3,4,5-trim COc1cc(cc(c1 104 58390 http://www.aAlfa Aesar
    3109 3-(3,4-dichlo CN(C)C(=O)Nc1 158 3008 http://www.aAlfa Aesar
    3110 3-(3,4-difluor c1cc(c(cc1CCC 51 2059233 http://www. Alfa Aesar
    3111 3-(3,4-dihydr c1cc(c(cc1CC 138 308986 http://www.aAlfa Aesar
    3112 3-(3,4-dimethCOc1ccc(cc1O 160 190192 http://www. Alfa Aesar
    3113 3-(3,4-dimethCOc1ccc(cc1O 98 67572 http://www.aAlfa Aesar
    3114 3-(3,5-difluo c1c(cc(cc1F)F 180 2063300 http://www. Alfa Aesar
    3115 3-(3-aminophec1cc(cc(c1)N) 100 2017098 http://www.aAlfa Aesar
    3116 3-(3-bromophe
    c1cc(cc(c1)Br 64 1554532 http://www.aAlfa Aesar
    3117 3-(3-fluoro-4 COc1ccc(cc1F 171 60990 http://www.aAlfa Aesar
    3118 3-(3-fluorophec1cc(cc(c1)F) 45 2019123 http://www. Alfa Aesar
    3119 3-(3-furyl)acryc1cocc1/C=C/ 153 558554 http://www.aAlfa Aesar
    3120 3-(3-hydroxypc1cc(cc(c1)O) 112 89 http://www.aAlfa Aesar
    3121 3-(3-methoxypCOc1cccc(c1) 45 59714 http://www.aAlfa Aesar
    3122 3-(3-pyridyl)p c1cc(cnc1)CC 158 227872 http://www.aAlfa Aesar
    3123 3-(4-aminophec1cc(ccc1CCC 134 67981 http://www.aAlfa Aesar
    3124 3-(4-bromoben
    c1cc(ccc1C(= 147 72831 http://www.aAlfa Aesar
    3125 3-(4-bromophe
    c1cc(ccc1CCC 135 2017295 http://www. Alfa Aesar
    3126 3-(4-bromophe
    c1cc(ccc1SCC 111 11861420 http://www. Alfa Aesar
    3127 3-(4-carboxypc1cc(ccc1CCC 290 746437 http://www.aAlfa Aesar
    3128 3-(4-chlorobenc1cc(ccc1C(=O 158 584766 http://www.aAlfa Aesar
    3129 3-(4-chlorobenc1cc(ccc1C(=O 129 70009 http://www.aAlfa Aesar
    3130 3-(4-chlorophc1cc(ccc1OCC 80 7411 http://www.aAlfa Aesar
    3131 3-(4-chlorophec1cc(ccc1C(CC 166 527877 http://www.aAlfa Aesar
    3132 3-(4-chlorophec1cc(ccc1CCC( 119 109752 http://www. Alfa Aesar
    3133 3-(4-ethylbenzCCc1ccc(cc1) 93 280545 http://www.aAlfa Aesar
    3134 3-(4-fluorobenc1cc(ccc1C(= 101 91589 http://www.aAlfa Aesar
    3135 3-(4-fluoropheCC(C)n1cc(c2c 97 643359 http://www.aAlfa Aesar
    3136 3-(4-fluorophec1cc(ccc1CCC 90 120076 http://www.aAlfa Aesar
    3137 3-(4-hydroxy- COc1cc(ccc1O 90 13701 http://www.aAlfa Aesar
    3138 3-(4-hydroxypc1cc(ccc1CCC 129 9965 http://www.aAlfa Aesar
    3139 3-(4-hydroxyph
    c1cc(ccc1CCC 56 78547 http://www.aAlfa Aesar
    3140 3-(4-methoxybCOc1ccc(cc1) 139 4511143 http://www.aAlfa Aesar
    3141 3-(4-methoxybCOc1ccc(cc1) 149 69077 http://www.aAlfa Aesar
    3142 3-(4-methoxypCOc1ccc(cc1) 104 86435 http://www.aAlfa Aesar
    3143 3-(4-methylben
    Cc1ccc(cc1)C 139 602123 http://www.aAlfa Aesar
    3144 3-(4-methylbeCc1ccc(cc1)C 126 213498 http://www.aAlfa Aesar
    3145 3-(4-methylphCc1ccc(cc1)C 116 66558 http://www.aAlfa Aesar
    3146 3-(4-methylsuCS(=O)(=O)c1 170 524171 http://www.aAlfa Aesar
    3147 3-(4-morpholic1cc(cc(c1)O 130 124684 http://www.aAlfa Aesar
    3148 3-(4-morpholiC1COCCN1CC -15 55014 http://www.aAlfa Aesar
    3149 3-(aminomethy
    c1cc(cnc1)CN -21 28777 http://www.aAlfa Aesar
    3150 3-(boc-amino)CC(C)(C)OC(= 143 2037555 http://www.aAlfa Aesar
    3151 3-(boc-amino)CC(C)(C)OC(=O 125 2063209 http://www.aAlfa Aesar
    3152 3-(boc-amino)CC(C)(C)OC(= 82 2016339 http://www.aAlfa Aesar
    3153 3-(bromomethB(c1cccc(c1)C 215 2053702 http://www.aAlfa Aesar
    3154 3-(bromomethy
    c1cc(cc(c1)C# 94 87776 http://www.aAlfa Aesar
    3155 3-(bromomethy
    c1cc(cc(c1)OC 126 5373900 http://www.aAlfa Aesar
    3156 3-(chlorosulfoc1cc(cc(c1)S( 135 70045 http://www.aAlfa Aesar
    3157 3-(difluoromec1cc(cc(c1)OC 105 736121 http://www. Alfa Aesar
    3158 3-(ethoxycarbB(c1cccc(c1)C 137 2499643 http://www. Alfa Aesar
    3159 3-(hydroxymetB(c1cccc(c1)C 96 2016406 http://www.aAlfa Aesar
    3160 3-(methoxycarB(c1cccc(c1)C 136 2016458 http://www. Alfa Aesar
    3161 3-(methoxycarCOC(=O)c1ccc 37 2015165 http://www.aAlfa Aesar
    3162 3-(methylsulfiCS(=O)c1cccc 111 21242305 http://www. Alfa Aesar
    3163 3-(methylsulfoCS(=O)(=O)c1c 234 191114 http://www. Alfa Aesar
    3164 3-(methylthioB(c1cccc(c1)S 160 2016135 http://www.aAlfa Aesar
    3165 3-(methylthioCSc1cccc(c1)C 128 191063 http://www. Alfa Aesar
    3166 3-(methylthio)CSc1cccc(c1) 79 2019099 http://www. Alfa Aesar
    3167 3-(methylthioCSCCC=O -58 17597 http://www.aAlfa Aesar
    3168 3-(methylthio)CSCCC(=O)O 16 547 http://www.aAlfa Aesar
    3169 3-(phenylsulfoc1ccc(cc1)S( 95 74375 http://www.aAlfa Aesar
    3170 3-(phenylsulf c1ccc(cc1)S(= 116 452964 http://www.aAlfa Aesar
    3171 3-(tert-butyl B(c1cccc(c1)O[ 89 2704806 http://www. Alfa Aesar
    3172 3-(trifluorom c1cc(cc(c1)OC 116 455511 http://www.aAlfa Aesar
    3173 3-(trifluorom B(c1cccc(c1)O 80 2016137 http://www.aAlfa Aesar
    3174 3-(trifluorom c1cc(cc(c1)OC 89 59485 http://www.aAlfa Aesar
    3175 3-(trifluorom c1cc(cc(c1)OC 94 642994 http://www.aAlfa Aesar
    3176 3-(trifluoromec1cc(cc(c1)OC 54 2057600 http://www.aAlfa Aesar
    3177 3-(trifluoromec1cc(c(c(c1)O 59 2059505 http://www. Alfa Aesar
    3178 3'-(trifluorom CC(=O)Nc1cccc 105 9219 http://www.aAlfa Aesar
    3179 3-(trifluoromec1cc(cc(c1)N)C 6 7097 http://www.aAlfa Aesar
    3180 3-(trifluorom c1cc(cc(c1)C(F 124 67115 http://www.aAlfa Aesar
    3181 3-(trifluorom B(c1cccc(c1)C( 164 2016140 http://www.aAlfa Aesar
    3182 3-(trifluorom c1cc(cc(c1)S(= 124 213417 http://www.aAlfa Aesar
    3183 3-(trifluorom c1ccc(cc1)C(c2 63 2057686 http://www.aAlfa Aesar
    3184 3-(trifluoromec1cc(cc(c1)C(F 105 9569 http://www.aAlfa Aesar
    3185 3-(trifluoromec1cc(cc(c1)C(F 16 61101 http://www.aAlfa Aesar
    3186 3-(trifluorom c1ccc(cc1)C(=O 52 62965 http://www.aAlfa Aesar
    3187 3-(trifluoromec1cc(cc(c1)C( 61 453848 http://www.aAlfa Aesar
    3188 3-(trifluoromeC/C(=C/C(=O)O 29 4647493 http://www.aAlfa Aesar
    3189 3-(trifluorom c1cc(cc(c1)O)C -2 7098 http://www.aAlfa Aesar
    3190 3-(trifluoromec1cc(cc(c1)C( 78 61014 http://www.aAlfa Aesar
    3191 3'-(trifluoro CCC(=O)c1cccc 19 120773 http://www.aAlfa Aesar
    3192 3-(trifluoromec1cc(c(c(c1)C( 57 2059509 http://www. Alfa Aesar
    3193 3-(trifluoromec1cc(cc(c1)SC 73 599804 http://www.aAlfa Aesar
    3194 3-(trimethylsilC[Si](C)(C)C# 48 2041604 http://www. Alfa Aesar
    3195 3,3,3-trifluor C(C(=O)O)(C(F) 52 341699 http://www. Alfa Aesar
    3196 3,3,3-trifluor CC(C)(C(=O)O) 70 14643003 http://www. Alfa Aesar
    3197 3,3,3-trifluor C(=O)(C(C(F)(F 81 2007152 http://www.aAlfa Aesar
    3198 3,3,3-trifluoroC(C(=O)O)(C(F 69 214194 http://www.aAlfa Aesar
    3199 3,3,3-trifluor C(C(=O)O)C(F) 9 2058238 http://www.aAlfa Aesar
    3200 3,3,3-triphenyc1ccc(cc1)C(C 182 120459 http://www.aAlfa Aesar
    3201 3,3',4,4'-tetr Cc1ccc(cc1C)c 76 19779 http://www.aAlfa Aesar
    3202 3,3',5,5'-tetr c1c(cc(cc1C(F) 148 2057117 http://www.aAlfa Aesar
    3203 3,3',5,5'-tetr c1c(cc(cc1C(F) 140 453085 http://www.aAlfa Aesar
    3204 3,3',5,5'-tetr Cc1cc(cc(c1N) 170 37605 http://www.aAlfa Aesar
    3205 3,3',5,5'-tetr Cc1cc(cc(c1)c2 48 453765 http://www.aAlfa Aesar
    3206 3,3'-bis(trif c1cc(cc(c1)C(F 101 521429 http://www.aAlfa Aesar
    3207 3,3'-diamino c1cc(cc(c1)N) 150 62360 http://www.aAlfa Aesar
    3208 3,3'-diamino c1cc(cc(c1)N) 82 129206 http://www.aAlfa Aesar
    3209 3,3'-difluoro c1cc(cc(c1)F) 59 503721 http://www.aAlfa Aesar
    3210 3,3'-difluorob c1cc(cc(c1)F)c 8 109680 http://www.aAlfa Aesar
    3211 3,3'-dimethoxCOc1cccc(c1)C 82 110088 http://www.aAlfa Aesar
    3212 3,3-dimethyl- CC(C)(C)C(CO 38 91321 http://www.aAlfa Aesar
    3213 3,3-dimethyl- CC(C)(C)CCO -60 11732 http://www. Alfa Aesar
    3214 3,3-dimethyl- CC(C)(C)C=C -115 10737 http://www.aAlfa Aesar
    3215 3,3-dimethyl- CC(C)(C)C#C -78 12924 http://www.aAlfa Aesar
    3216 3,3-dimethyl- CC(C(C)(C)C)O 5 9650 http://www.aAlfa Aesar
    3217 3,3-dimethylacCC(=CC(=O)O) 67 10468 http://www.aAlfa Aesar
    3218 3,3-dimethylbu
    CC(C)(C)CC(= 6 13438 http://www.aAlfa Aesar
    3219 3,3-dimethylglCC(C)(CC(=O) 101 19739 http://www.aAlfa Aesar
    3220 3,3-dimethylgCC(C)(CC(=O) 124 19970999 http://www.aAlfa Aesar
    3221 3,3-dimethylpCCC(C)(C)CC -135 10755 http://www.aAlfa Aesar
    3222 3,3'-dinitrob c1cc(cc(c1)[N 154 87296 http://www.aAlfa Aesar
    3223 3,3-diphenylpc1ccc(cc1)C(C 27 71998 http://www.aAlfa Aesar
    3224 3,3'-dithiodip C(CSSCCC(=O) 158 85828 http://www.aAlfa Aesar
    3225 3,3-tetramethy
    C1CCC(C1)(CC 180 77162 http://www.aAlfa Aesar
    3226 3,3'-thiodiproC(CSCCC(=O)O 131 7805 http://www.aAlfa Aesar
    3227 3,4-(methylenc1cc2c(cc1CO 53 9900 http://www.aAlfa Aesar
    3228 3,4,5,6-tetrac c1(c(c(nc(c1Cl 172 74581 http://www.aAlfa Aesar
    3229 3',4',5,7-tet COc1ccc(cc1O 196 548072 http://www.aAlfa Aesar
    3230 3,4,5-tribrom c1(c([nH]nc1B 186 545182 http://www.aAlfa Aesar
    3231 3,4,5-tribrom c1c(c(c(cn1)Br 107 471523 http://www. Alfa Aesar
    3232 3,4,5-trichlor c1c(cc(c(c1Cl) 99 11959 http://www.aAlfa Aesar
    3233 3,4,5-trichlor c1c(cc(c(c1Cl)C -10 2015198 http://www.aAlfa Aesar
    3234 3,4,5-trichlor c1c(c(c(cn1)Cl 72 3014435 http://www.aAlfa Aesar
    3235 3,4,5-trichlor c1(c(c(sc1C(=O 39 5373881 http://www.aAlfa Aesar
    3236 3,4,5-trichlor c1(c(c(sc1C(=O 227 3380104 http://www.aAlfa Aesar
    3237 3,4,5-triethoxCCOc1cc(cc(c 112 73476 http://www.aAlfa Aesar
    3238 3,4,5-trifluoroc1c(cc(c(c1F)F 60 2007105 http://www.aAlfa Aesar
    3239 3,4,5-trifluor COc1cc(c(c(c1) 20 2057241 http://www. Alfa Aesar
    3240 3,4,5-trifluo c1c(cc(c(c1F) 25 2057248 http://www.aAlfa Aesar
    3241 3,4,5-trifluor B(c1cc(c(c(c1) 277 2016415 http://www.aAlfa Aesar
    3242 3,4,5-trifluor c1c(cc(c(c1F) 98 745581 http://www.aAlfa Aesar
    3243 3,4,5-trifluor c1c(cc(c(c1F) 46 516201 http://www.aAlfa Aesar
    3244 3,4,5-trifluor c1c(cc(c(c1F) 197 4647466 http://www.aAlfa Aesar
    3245 3,4,5-trifluor c1c(cc(c(c1F)F 54 2058209 http://www.aAlfa Aesar
    3246 3,4,5-trifluor c1c(cc(c(c1F) 31 2058225 http://www. Alfa Aesar
    3247 3',4',5'-trim CC(=O)c1cc(c 81 13706 http://www.aAlfa Aesar
    3248 3,4,5-trimethoCOc1cc(cc(c1 112 29939 http://www.aAlfa Aesar
    3249 3,4,5-trimeth COc1cc(cc(c1 75 6597 http://www.aAlfa Aesar
    3250 3,4,5-trimeth COc1cc(cc(c1 179 17315 http://www.aAlfa Aesar
    3251 3,4,5-trimeth B(c1cc(c(c(c1 245 2016142 http://www.aAlfa Aesar
    3252 3,4,5-trimeth COc1cc(cc(c1 159 69249 http://www.aAlfa Aesar
    3253 3,4,5-trimeth COc1cc(cc(c1 170 8054 http://www.aAlfa Aesar
    3254 3,4,5-trimeth COc1cc(cc(c1 93 15105 http://www.aAlfa Aesar
    3255 3,4,5-trimeth COc1cc(cc(c1 80 70654 http://www.aAlfa Aesar
    3256 3,4,5-trimeth COc1cc(cc(c1 127 6754 http://www.aAlfa Aesar
    3257 3,4,5-trimeth COc1cc(cc(c1 146 62711 http://www.aAlfa Aesar
    3258 3,4,5-trimeth COc1cc(cc(c1 40 451749 http://www.aAlfa Aesar
    3259 3,4,5-trimeth COc1cc(cc(c1 65 106245 http://www.aAlfa Aesar
    3260 3,4,5-trimeth COc1cc(cc(c1 120 63553 http://www.aAlfa Aesar
    3261 3,4,5-trimeth COc1cc(cc(c1 77 24118 http://www.aAlfa Aesar
    3262 3,4,5-trimeth Cc1cc(c(c(c1 36 73027 http://www.aAlfa Aesar
    3263 3,4,5-trimeth Cc1cc(cc(c1C) 106 10246 http://www.aAlfa Aesar
    3264 3,4,6-tri-o-aceCC(=O)OC[C@ 54 599777 http://www.aAlfa Aesar
    3265 3',4',7,8-tet COc1ccc(cc1O 207 3250580 http://www.aAlfa Aesar
    3266 3',4',7-trihyd c1cc(c(cc1c2c 281 4447692 http://www.aAlfa Aesar
    3267 3,4,8,8a-tetr CC12CCC(=O) 49 80553 http://www.aAlfa Aesar
    3268 3,4'-bis(trif c1cc(cc(c1)C(F 94 643186 http://www.aAlfa Aesar
    3269 3,4-diacetamiCC(=O)Nc1ccc 226 2017605 http://www.aAlfa Aesar
    3270 3,4-diaminobec1cc(c(cc1C( 149 3724888 http://www.aAlfa Aesar
    3271 3,4-diaminob c1ccc(cc1)C(= 117 119375 http://www.aAlfa Aesar
    3272 3,4-diaminopyc1cncc(c1N)N 219 5705 http://www.aAlfa Aesar
    3273 3,4-diaminotoCc1ccc(c(c1)N 88 9908 http://www.aAlfa Aesar
    3274 3,4-dibromo-2c1cnc(c(c1Br) 76 21242337 http://www. Alfa Aesar
    3275 3,4-dibromobc1cc(c(cc1C=O 71 540493 http://www.aAlfa Aesar
    3276 3,4-dibromot c1c(c(cs1)Br)B 5 17428 http://www.aAlfa Aesar
    3277 3,4-dibromot Cc1ccc(c(c1)Br -10 31914 http://www.aAlfa Aesar
    3278 3',4'-dichlor CC(=O)c1ccc(c( 74 68350 http://www.aAlfa Aesar
    3279 3,4-dichloroanc1cc(c(cc1N)Cl 72 13860720 http://www.aAlfa Aesar
    3280 3,4-dichloroanCOc1ccc(c(c1)C -8 34344 http://www.aAlfa Aesar
    3281 3,4-dichlorob c1cc(c(cc1C=O 43 21106577 http://www.aAlfa Aesar
    3282 3,4-dichlorob c1cc(c(cc1C=N 122 191467 http://www.aAlfa Aesar
    3283 3,4-dichlorob c1cc(c(cc1C(= 141 121330 http://www.aAlfa Aesar
    3284 3,4-dichlorob B(c1ccc(c(c1)C 272 2016082 http://www.aAlfa Aesar
    3285 3,4-dichlorob c1cc(c(cc1S(=O 21 7105 http://www.aAlfa Aesar
    3286 3,4-dichlorobec1cc(c(cc1C(= 207 5612 http://www.aAlfa Aesar
    3287 3,4-dichlorobec1cc(c(cc1C#N 72 73124 http://www.aAlfa Aesar
    3288 3,4-dichloro c1ccc(cc1)C(=O 102 72694 http://www.aAlfa Aesar
    3289 3,4-dichlorobec1cc(c(cc1C(F) -12 9109 http://www.aAlfa Aesar
    3290 3,4-dichlorobec1cc(c(cc1C(=O 32 68878 http://www.aAlfa Aesar
    3291 3,4-dichlorobec1cc(c(cc1C(= 116 2038822 http://www.aAlfa Aesar
    3292 3,4-dichlorobec1cc(c(cc1CO)C 38 14956 http://www.aAlfa Aesar
    3293 3,4-dichlorobec1cc(c(cc1CCl) -3 7327 http://www.aAlfa Aesar
    3294 3,4-dichlorobec1cc(c(cc1CN= 27 27294 http://www.aAlfa Aesar
    3295 3,4-dichloro-bc1cc(c(cc1/C= 93 4522570 http://www.aAlfa Aesar
    3296 3,4-dichlorocic1cc(c(cc1/C= 219 599521 http://www.aAlfa Aesar
    3297 3,4-dichlorop c1cc(c(cc1O)Cl 66 6988 http://www.aAlfa Aesar
    3298 3,4-dichlorop c1cc(c(cc1N=C 42 7325 http://www.aAlfa Aesar
    3299 3,4-dichlorophc1cc(c(cc1CC( 90 72165 http://www.aAlfa Aesar
    3300 3,4-dichlorophc1cc(c(cc1CC# 40 69151 http://www.aAlfa Aesar
    3301 3,4'-dichloro c1cc(ccc1C(=O 50 69957 http://www.aAlfa Aesar
    3302 3',4'-dichlor CCC(=O)c1ccc( 45 521265 http://www.aAlfa Aesar
    3303 3,4-dichlorot Cc1ccc(c(c1)Cl -15 21106517 http://www.aAlfa Aesar
    3304 3,4-diethoxybCCOc1ccc(cc1 168 71736 http://www.aAlfa Aesar
    3305 3,4-difluoro- COc1c(ccc(c1F 138 21242261 http://www. Alfa Aesar
    3306 3,4-difluoro-2Cc1c(ccc(c1F) 154 14279475 http://www. Alfa Aesar
    3307 3,4-difluoro-2Cc1c(ccc(c1F) 42 21168920 http://www. Alfa Aesar
    3308 3',4'-difluor CC(=O)c1ccc(c 20 109674 http://www.aAlfa Aesar
    3309 3,4-difluoroanc1cc(c(cc1N)F 21 69878 http://www.aAlfa Aesar
    3310 3,4-difluorob c1cc(c(cc1C(= 133 456069 http://www.aAlfa Aesar
    3311 3,4-difluorobec1cc(c(cc1C(= 123 89588 http://www.aAlfa Aesar
    3312 3,4-difluorobec1cc(c(cc1C#N 50 510413 http://www.aAlfa Aesar
    3313 3,4-difluoro c1ccc(cc1)C(= 56 495494 http://www.aAlfa Aesar
    3314 3,4-difluoroci c1cc(c(cc1/C= 195 2015102 http://www.aAlfa Aesar
    3315 3,4-difluoro-dc1cc(c(cc1C[ 233 625030 http://www. Alfa Aesar
    3316 3,4-difluoromac1cc(c(cc1C(C 94 511695 http://www.aAlfa Aesar
    3317 3,4-difluorop c1cc(c(cc1O)F 36 68431 http://www.aAlfa Aesar
    3318 3,4-difluorophc1cc(c(cc1CC( 49 62775 http://www.aAlfa Aesar
    3319 3,4-difluorosalc1cc(c(c(c1C( 178 2039045 http://www. Alfa Aesar
    3320 3,4-dihydro-2 c1cc2c(cc1N) 79 2055987 http://www. Alfa Aesar
    3321 3,4-dihydro-2 c1cc2c(cc1C( 148 2056701 http://www. Alfa Aesar
    3322 3,4-dihydro-2 C1CC=COC1 -70 7789 http://www.aAlfa Aesar
    3323 3,4-dihydro-3-c1ccc2c(c1)N 188 204930 http://www. Alfa Aesar
    3324 3,4-dihydroxyc1cc(c(cc1C= 155 8438 http://www.aAlfa Aesar
    3325 3,4'-dihydrox c1ccc2c(c1)c( 286 600127 http://www. Alfa Aesar
    3326 3',4'-dihydroxc1ccc2c(c1)c( 251 128550 http://www.aAlfa Aesar
    3327 3,4-dihydroxyc1cc(c(cc1CC 129 532 http://www.aAlfa Aesar
    3328 3',4'-dihydro CCC(=O)c1ccc( 146 86900 http://www.aAlfa Aesar
    3329 3,4-dimethoxyCOc1c(=O)c(= 55 109842 http://www.aAlfa Aesar
    3330 3',4'-dimeth CC(=O)c1ccc( 49 21168556 http://www.aAlfa Aesar
    3331 3,4-dimethoxyCOc1ccc(cc1O 88 21347 http://www.aAlfa Aesar
    3332 3,4-dimethoxyB(c1ccc(c(c1) 240 2016446 http://www.aAlfa Aesar
    3333 3,4-dimethoxyCOc1ccc(cc1O 68 2015939 http://www.aAlfa Aesar
    3334 3,4-dimethox COc1ccc(cc1O 145 1255493 http://www.aAlfa Aesar
    3335 3,4-dimethoxyCOc1ccc(cc1O 181 6854 http://www.aAlfa Aesar
    3336 3,4-dimethoxyCOc1ccc(cc1O 67 67407 http://www.aAlfa Aesar
    3337 3,4-dimethoxyCOc1ccc(cc1O 71 69516 http://www.aAlfa Aesar
    3338 3,4-dimethoxyCOc1ccc(cc1O 22 6851 http://www.aAlfa Aesar
    3339 3,4-dimethoxyCOc1ccc(cc1O 140 618889 http://www.aAlfa Aesar
    3340 3,4-dimethox COc1ccc(cc1O 89 4510680 http://www.aAlfa Aesar
    3341 3',4'-dimetho COc1ccc(cc1O 155 600087 http://www.aAlfa Aesar
    3342 3,4-dimethoxyCOc1ccc(cc1 256 8808308 http://www. Alfa Aesar
    3343 3,4-dimethox COc1ccc(cc1O 81 15420 http://www.aAlfa Aesar
    3344 3,4-dimethoxyCOc1ccc(cc1O 48 125142 http://www.aAlfa Aesar
    3345 3,4-dimethoxyCOc1ccc(cc1O 97 6872 http://www.aAlfa Aesar
    3346 3,4-dimethoxyCOc1ccc(cc1O 103 248783 http://www.aAlfa Aesar
    3347 3,4-dimethoxyCOc1ccc(cc1O 64 60093 http://www.aAlfa Aesar
    3348 3,4-dimethoxyCc1ccc(c(c1) 27 61434 http://www.aAlfa Aesar
    3349 3',4'-dimethylCc1ccc(cc1C) 97 67692 http://www.aAlfa Aesar
    3350 3,4-dimethylan
    Cc1ccc(cc1C)N 50 13860491 http://www.aAlfa Aesar
    3351 3,4-dimethyl Cc1ccc(cc1C) 102 20447 http://www.aAlfa Aesar
    3352 3,4-dimethylbB(c1ccc(c(c1) 220 2016100 http://www.aAlfa Aesar
    3353 3,4-dimethylbCc1ccc(cc1C) 166 11576 http://www.aAlfa Aesar
    3354 3,4-dimethylbCc1ccc(cc1C) 66 81133 http://www.aAlfa Aesar
    3355 3,4-dimethyl Cc1ccc(cc1C)C 46 68247 http://www.aAlfa Aesar
    3356 3,4-dimethylbCc1ccc(cc1C) 64 21888 http://www.aAlfa Aesar
    3357 3,4-dimethylpCc1ccc(cc1C) 67 13839105 http://www.aAlfa Aesar
    3358 3,4-dimethylpCc1ccc(cc1C) 163 75214 http://www.aAlfa Aesar
    3359 3,4-dimethylt Cc1c(c(sc1C# 123 2083156 http://www.aAlfa Aesar
    3360 3,4-dinitrobenc1cc(c(cc1C(= 165 10259 http://www.aAlfa Aesar
    3361 3,4-dinitrobenc1cc(c(cc1C#N 90 465136 http://www.aAlfa Aesar
    3362 3,4-dinitrotol Cc1ccc(c(c1)[ 56 11390 http://www.aAlfa Aesar
    3363 3,4-hexanedi CCC(=O)C(=O) -10 56310 http://www.aAlfa Aesar
    3364 3,4-lutidine Cc1ccncc1C -11 10937 http://www.aAlfa Aesar
    3365 3,4-o-isoprop CC1(O[C@@H] 87 5444977 http://www.aAlfa Aesar
    3366 3,4-tolueneditCc1ccc(c(c1)S) 30 9910 http://www.aAlfa Aesar
    3367 3,5,5-trimeth CC1CC(CC(=O) 91 84639 http://www.aAlfa Aesar
    3368 3,5,5-trimethyCC(CC(=O)O)CC -70 82141 http://www.aAlfa Aesar
    3369 3,5,5-trimethyCC1(C(=O)N(C 47 5374 http://www.aAlfa Aesar
    3370 3,5,6-trichloroc1c(c(c(c(c1Cl 210 85289 http://www.aAlfa Aesar
    3371 3',5,7-trihyd COc1ccc(cc1O 230 65234 http://www.aAlfa Aesar
    3372 3,5,7-trihydroc1ccc(cc1)c2c 215 4444935 http://www.aAlfa Aesar
    3373 3',5'-bis(trif CC(=O)Nc1cc(cc 161 631731 http://www.aAlfa Aesar
    3374 3,5-bis(trifl c1c(cc(cc1C(F) 162 453514 http://www.aAlfa Aesar
    3375 3,5-bis(trifl B(c1cc(cc(c1)C 222 137607 http://www.aAlfa Aesar
    3376 3,5-bis(triflu c1c(cc(cc1C(F) 36 454397 http://www.aAlfa Aesar
    3377 3,5-bis(trifl c1c(cc(cc1C(F) 133 90613 http://www.aAlfa Aesar
    3378 3,5-bis(triflu c1c(cc(cc1C(F) 142 12356 http://www.aAlfa Aesar
    3379 3,5-bis(triflu c1c(cc(cc1C(F) 18 87350 http://www.aAlfa Aesar
    3380 3,5-bis(triflu c1c(cc(cc1C(F) 54 109578 http://www.aAlfa Aesar
    3381 3,5-bis(triflu c1c(cc(cc1C(F) 31 110170 http://www.aAlfa Aesar
    3382 3,5-bis(trifl c1c(cc(cc1C(F) 57 454537 http://www.aAlfa Aesar
    3383 3,5-bis(triflu c1c(cc(cc1C(F) 82 4643075 http://www.aAlfa Aesar
    3384 3,5-bis(triflu c1c(cc(cc1C(F) 21 60999 http://www.aAlfa Aesar
    3385 3,5-bis(triflu c1c(cc(cc1C(F) 122 110181 http://www.aAlfa Aesar
    3386 3,5-bis(triflu c1c(cc(cc1C(F) 82 456127 http://www.aAlfa Aesar
    3387 3,5-bis(triflu c1c(cncc1C(F)( 37 2058569 http://www.aAlfa Aesar
    3388 3,5-bis(triflu C=Cc1cc(cc(c1) 8 2053665 http://www.aAlfa Aesar
    3389 3,5-diacetoxy CC(=O)Oc1cc( 159 470116 http://www.aAlfa Aesar
    3390 3',5'-dibenzy CC(=O)c1cc(cc 61 107215 http://www.aAlfa Aesar
    3391 3,5-dibromo-2COc1c(cc(c(n1 86 21242428 http://www. Alfa Aesar
    3392 3',5'-dibromo CC(=O)c1cc(cc 110 239052 http://www.aAlfa Aesar
    3393 3,5-dibromo-2c1c(cnc(c1Br) 210 558011 http://www.aAlfa Aesar
    3394 3,5-dibromo-4c1c(c(c(cn1)B 150 21242362 http://www. Alfa Aesar
    3395 3,5-dibromo- c1c(cc(c(c1Br 181 17097 http://www.aAlfa Aesar
    3396 3,5-dibromo-4c1c(cc(c(c1Br 271 69309 http://www.aAlfa Aesar
    3397 3,5-dibromo-4Cc1cc(c(c(c1)B 71 2080037 http://www.aAlfa Aesar
    3398 3,5-dibromo-4Cc1c(cc(cc1Br 91 5378808 http://www.aAlfa Aesar
    3399 3,5-dibromo-4Cc1c(cc(cc1Br 242 583635 http://www.aAlfa Aesar
    3400 3,5-dibromo- Cc1c(cc(cc1Br 108 50079 http://www.aAlfa Aesar
    3401 3,5-dibromo-4Cc1c(cncc1Br) 106 715849 http://www.aAlfa Aesar
    3402 3,5-dibromobc1c(cc(cc1Br) 91 540514 http://www.aAlfa Aesar
    3403 3,5-dibromobc1c(cc(cc1Br) 182 2017619 http://www.aAlfa Aesar
    3404 3,5-dibromobec1c(cc(cc1Br) 220 11566 http://www.aAlfa Aesar
    3405 3,5-dibromobec1c(cc(cc1Br) 108 5373009 http://www.aAlfa Aesar
    3406 3,5-dibromobc1c(cc(cc1Br) 94 126537 http://www.aAlfa Aesar
    3407 3,5-dibromopyc1c(cncc1Br)B 112 62578 http://www.aAlfa Aesar
    3408 3,5-dibromosac1c(cc(c(c1C= 83 6757 http://www.aAlfa Aesar
    3409 3,5-dibromosalc1c(cc(c(c1C( 226 17440 http://www.aAlfa Aesar
    3410 3,5-dibromot Cc1cc(cc(c1)Br 39 14622 http://www.aAlfa Aesar
    3411 3,5-dichloro-2c1(c(c(nc(c1Cl 25 55212 http://www.aAlfa Aesar
    3412 3,5-dichloro- Cc1ccc(c(c1)C) 57 2017662 http://www.aAlfa Aesar
    3413 3,5-dichloro- c1c(cnc(c1Cl) 101 2050201 http://www.aAlfa Aesar
    3414 3,5-dichloro-2c1c(cnc(c1Cl)F 42 2063399 http://www.aAlfa Aesar
    3415 3',5'-dichlor CC(=O)c1cc(cc 97 454112 http://www.aAlfa Aesar
    3416 3,5-dichloro- c1c(cc(c(c1C= 96 60027 http://www.aAlfa Aesar
    3417 3,5-dichloro- c1c(cc(c(c1S(= 79 81318 http://www.aAlfa Aesar
    3418 3,5-dichloro- Cc1cc(cc(c1I)C 44 2079676 http://www.aAlfa Aesar
    3419 3,5-dichloro- c1c(c[nH]c(=O 180 71807 http://www.aAlfa Aesar
    3420 3,5-dichloro- c1c(cc(c(c1Cl) 119 2017674 http://www.aAlfa Aesar
    3421 3,5-dichloro- c1c(cc(c(c1Cl 268 17704 http://www.aAlfa Aesar
    3422 3,5-dichloro- c1c(c(=O)c(c[n 323 78486 http://www.aAlfa Aesar
    3423 3,5-dichloroanc1c(cc(cc1Cl)C 51 11778 http://www.aAlfa Aesar
    3424 3,5-dichloroanCOc1cc(cc(c1)C 41 33621 http://www.aAlfa Aesar
    3425 3,5-dichlorob c1c(cc(cc1Cl) 63 32882 http://www.aAlfa Aesar
    3426 3,5-dichlorob c1c(cc(cc1Cl) 160 20922 http://www.aAlfa Aesar
    3427 3,5-dichlorob c1c(cc(cc1Cl)C 32 455681 http://www.aAlfa Aesar
    3428 3,5-dichlorob c1c(cc(cc1Cl) 206 2017647 http://www.aAlfa Aesar
    3429 3,5-dichlorobec1c(cc(cc1Cl) 186 5606 http://www.aAlfa Aesar
    3430 3,5-dichlorobec1c(cc(cc1Cl) 66 73125 http://www.aAlfa Aesar
    3431 3,5-dichlorobec1c(cc(cc1Cl)C 26 68674 http://www.aAlfa Aesar
    3432 3,5-dichlorobec1c(cc(cc1Cl)C 78 39404 http://www.aAlfa Aesar
    3433 3,5-dichlorop c1c(cc(cc1Cl)C 66 11083 http://www.aAlfa Aesar
    3434 3,5-dichlorop c1c(cc(cc1Cl) 59 451786 http://www.aAlfa Aesar
    3435 3,5-dichlorop c1c(cc(cc1Cl) 30 85245 http://www.aAlfa Aesar
    3436 3,5-dichlorop c1c(cc(cc1Cl) 46 122382 http://www.aAlfa Aesar
    3437 3,5-dichlorop c1c(cc(cc1Cl) 115 522043 http://www.aAlfa Aesar
    3438 3,5-dichloropyc1c(cncc1Cl)Cl 65 16237 http://www.aAlfa Aesar
    3439 3,5-dichlorosalc1c(cc(c(c1C( 224 9073 http://www.aAlfa Aesar
    3440 3,5-dichlorosuc1c(cc(c(c1Cl 207 80876 http://www.aAlfa Aesar
    3441 3',5'-difluor CC(=O)c1cc(cc 107 2018628 http://www. Alfa Aesar
    3442 3,5-difluoro- B(c1cc(cc(c1O 114 2016353 http://www.aAlfa Aesar
    3443 3,5-difluoro- COc1c(cc(cc1F 35 16499369 http://www. Alfa Aesar
    3444 3,5-difluoro- COc1c(cc(cn1) 38 23347722 http://www. Alfa Aesar
    3445 3,5-difluoro- c1c(cc(c(c1F) 123 8368084 http://www. Alfa Aesar
    3446 3',5'-difluor CCC(=O)c1cc(c 130 453123 http://www.aAlfa Aesar
    3447 3,5-difluoro- COc1c(cc(cc1F 79 2063280 http://www. Alfa Aesar
    3448 3,5-difluoro- COc1c(cc(cc1F 39 11640412 http://www. Alfa Aesar
    3449 3,5-difluoro- COc1c(cc(cc1F 165 2018638 http://www. Alfa Aesar
    3450 3,5-difluoro- COc1c(cc(cc1F 86 8758631 http://www. Alfa Aesar
    3451 3,5-difluoro- COc1c(cc(cc1F 41 16499345 http://www. Alfa Aesar
    3452 3,5-difluoro- COc1c(cc(cc1F 69 16499347 http://www. Alfa Aesar
    3453 3',5'-difluor CC(=O)c1cc(cc 39 452447 http://www.aAlfa Aesar
    3454 3,5-difluoroanc1c(cc(cc1F)F 39 87206 http://www.aAlfa Aesar
    3455 3,5-difluorob c1c(cc(cc1F)F 156 2018562 http://www.aAlfa Aesar
    3456 3,5-difluorob c1c(cc(cc1F)S 159 393677 http://www.aAlfa Aesar
    3457 3,5-difluorobec1c(cc(cc1F)S( 58 2054467 http://www.aAlfa Aesar
    3458 3,5-difluorobec1c(cc(cc1F)F 121 91500 http://www.aAlfa Aesar
    3459 3,5-difluorobec1c(cc(cc1F)F 86 510414 http://www.aAlfa Aesar
    3460 3,5-difluoro c1ccc(cc1)C(= 58 495182 http://www.aAlfa Aesar
    3461 3,5-difluoroci c1c(cc(cc1F)F 205 4524554 http://www.aAlfa Aesar
    3462 3,5-difluoromac1c(cc(cc1F)F 136 511696 http://www.aAlfa Aesar
    3463 3,5-difluorop c1c(cc(cc1F)F 53 68432 http://www.aAlfa Aesar
    3464 3,5-difluorophc1c(cc(cc1F)F 69 128280 http://www.aAlfa Aesar
    3465 3,5-difluorophc1c(cc(cc1F)F 35 452421 http://www.aAlfa Aesar
    3466 3',5'-difluor CCC(=O)c1cc(c 26 128453 http://www.aAlfa Aesar
    3467 3,5-difluorosalc1c(cc(c(c1C( 189 9063669 http://www. Alfa Aesar
    3468 3',5-dihydroxyCOc1ccc(cc1O 191 87743 http://www.aAlfa Aesar
    3469 3',5'-dihydro CC(=O)c1cc(cc 144 93889 http://www.aAlfa Aesar
    3470 3,5-dihydroxyc1c(cc(cc1O) 160 85163 http://www.aAlfa Aesar
    3471 3,5-dihydroxyc1c(cc(cc1O) 257 509643 http://www.aAlfa Aesar
    3472 3,5-dihydroxyc1c(cc(cc1O) 188 79349 http://www.aAlfa Aesar
    3473 3,5-dihydroxyCc1cc(cc(c1)O 107 13839080 http://www.aAlfa Aesar
    3474 3,5-diiodo-4- c1c(cc(c(c1I)O 201 67332 http://www.aAlfa Aesar
    3475 3,5-diiodo-4- c1c(cc(c(c1I)O 204 14774 http://www.aAlfa Aesar
    3476 3,5-diiodosali c1c(cc(c(c1C=O 108 68338 http://www.aAlfa Aesar
    3477 3,5-diiodosalicc1c(cc(c(c1C(= 231 8310 http://www.aAlfa Aesar
    3478 3,5-diisopropylCC(C)c1cc(c(c 117 28345 http://www.aAlfa Aesar
    3479 3',5'-dimetho CC(=O)c1cc(c( 119 16280 http://www.aAlfa Aesar
    3480 3,5-dimethoxyCOc1cc(cc(c1 156 66662 http://www.aAlfa Aesar
    3481 3,5-dimethoxyCOc1cc(cc(c1 129 70471 http://www. Alfa Aesar
    3482 3,5-dimethoxyCc1c(cc(cc1O 213 2993378 http://www.aAlfa Aesar
    3483 3',5'-dimeth CC(=O)c1cc(c 40 86665 http://www.aAlfa Aesar
    3484 3,5-dimethoxyCOc1cc(cc(c1 55 59680 http://www.aAlfa Aesar
    3485 3,5-dimethox COc1cc(cc(c1 46 73763 http://www.aAlfa Aesar
    3486 3,5-dimethox COc1cc(cc(c1 144 65710 http://www.aAlfa Aesar
    3487 3,5-dimethoxyCOc1cc(cc(c1 184 13693 http://www.aAlfa Aesar
    3488 3,5-dimethoxyCOc1cc(cc(c1 88 27407 http://www.aAlfa Aesar
    3489 3,5-dimethoxyCOc1cc(cc(c1) 43 78478 http://www.aAlfa Aesar
    3490 3,5-dimethoxyCOc1cc(cc(c1 48 62918 http://www.aAlfa Aesar
    3491 3,5-dimethox COc1cc(cc(c1 46 9954 http://www.aAlfa Aesar
    3492 3,5-dimethoxyCOc1cc(cc(c1 51 128278 http://www.aAlfa Aesar
    3493 3,5-dimethoxyCOc1cc(cc(c1 103 121945 http://www.aAlfa Aesar
    3494 3,5-dimethoxyCOc1cc(cc(c1 55 122970 http://www.aAlfa Aesar
    3495 3,5-dimethyl- Cc1cc(n[nH]1) 107 5975 http://www.aAlfa Aesar
    3496 3,5-dimethyl- Cc1cc(n(n1)C( 113 63464 http://www.aAlfa Aesar
    3497 3,5-dimethyl- Cc1cc(n(n1)C 109 87016 http://www.aAlfa Aesar
    3498 3,5-dimethyl- Cc1cc(cc(c1O 125 19003 http://www. Alfa Aesar
    3499 3,5-dimethyl- Cc1c(c(n[nH]1 139 87662 http://www.aAlfa Aesar
    3500 3,5-dimethyl- Cc1c(c(on1)C) 54 533605 http://www.aAlfa Aesar
    3501 3,5-dimethyl- Cc1cc(cc(c1I) 130 2017937 http://www.aAlfa Aesar
    3502 3,5-dimethyl-4Cc1cc(cc(c1[N 224 218387 http://www.aAlfa Aesar
    3503 3,5-dimethyl- Cc1cnc(c(c1[N 67 3265344 http://www.aAlfa Aesar
    3504 3',5'-dimethy Cc1cc(cc(c1)C 20 14217 http://www.aAlfa Aesar
    3505 3,5-dimethylaCC12CC3CC(C1 101 2017900 http://www. Alfa Aesar
    3506 3,5-dimethylan
    Cc1cc(cc(c1)N 10 21106578 http://www.aAlfa Aesar
    3507 3,5-dimethyl Cc1cc(cc(c1)C 9 21168812 http://www.aAlfa Aesar
    3508 3,5-dimethylbB(c1cc(cc(c1) 236 2016101 http://www.aAlfa Aesar
    3509 3,5-dimethylbCc1cc(cc(c1)S 93 2017911 http://www.aAlfa Aesar
    3510 3,5-dimethylbCc1cc(cc(c1)C 170 9929 http://www.aAlfa Aesar
    3511 3,5-dimethylbCc1cc(cc(c1)C 38 124675 http://www.aAlfa Aesar
    3512 3,5-dimethyli Cc1cc(on1)C -14 8953 http://www.aAlfa Aesar
    3513 3,5-dimethylisB(c1c(noc1C)C 107 2016098 http://www. Alfa Aesar
    3514 3,5-dimethylisCc1c(c(on1)C) 141 68158 http://www.aAlfa Aesar
    3515 3,5-dimethylisCc1c(c(on1)C) 39 2017990 http://www.aAlfa Aesar
    3516 3,5-dimethylpCc1cc(cc(c1)O 63 13839110 http://www.aAlfa Aesar
    3517 3,5-dimethylpCc1cc(cc(c1)C 101 3936636 http://www.aAlfa Aesar
    3518 3,5-dimethylpCc1cc(cc(c1)C 44 110076 http://www.aAlfa Aesar
    3519 3,5-dinitro-4- c1c(cc(c(c1[N 251 63722 http://www.aAlfa Aesar
    3520 3,5-dinitro-4- c1c(cc(c(c1[N 167 89041 http://www.aAlfa Aesar
    3521 3,5-dinitrobe c1c(cc(cc1[N+ 182 4355 http://www.aAlfa Aesar
    3522 3,5-dinitrobenc1c(cc(cc1[N+ 206 7155 http://www.aAlfa Aesar
    3523 3,5-dinitrobenc1c(cc(cc1[N+ 129 18901 http://www.aAlfa Aesar
    3524 3,5-dinitrobenc1c(cc(cc1[N+] 51 109682 http://www.aAlfa Aesar
    3525 3,5-dinitrobenc1c(cc(cc1[N+ 67 7154 http://www.aAlfa Aesar
    3526 3,5-dinitrosal c1c(cc(c(c1C= 73 68096 http://www.aAlfa Aesar
    3527 3,5-dinitrosalic1c(cc(c(c1C( 171 11380 http://www.aAlfa Aesar
    3528 3,5-diphenyl- c1ccc(cc1)c2c 202 64004 http://www.aAlfa Aesar
    3529 3,5-di-tert-b CC(C)(C)c1cc( 60 599518 http://www.aAlfa Aesar
    3530 3',5'-di-tert- CC(=O)c1cc(c( 147 535622 http://www.aAlfa Aesar
    3531 3,5-di-tert-bu CC(C)(C)c1cc( 105 9850 http://www.aAlfa Aesar
    3532 3,5-di-tert-b CC(C)(C)c1cc( 188 65974 http://www.aAlfa Aesar
    3533 3,5-di-tert-bu CC(C)(C)c1cc( 208 14285 http://www.aAlfa Aesar
    3534 3,5-di-tert-bu CC(C)(C)c1cc( 142 120968 http://www.aAlfa Aesar
    3535 3,5-di-tert-bu CC(C)(C)c1cc( 140 6663 http://www.aAlfa Aesar
    3536 3,5-di-tert-bu CC(C)(C)c1cc( 156 2055482 http://www.aAlfa Aesar
    3537 3,5-di-tert-bu CC(C)(C)c1cc( 111 535032 http://www.aAlfa Aesar
    3538 3,5-di-tert-butCC(C)(C)c1cc(c 56 67951 http://www. Alfa Aesar
    3539 3,5-di-tert-bu CC(C)(C)c1cc( 161 76966 http://www.aAlfa Aesar
    3540 3,5-di-tert-b CC(C)(C)C1=CC 115 69366 http://www.aAlfa Aesar
    3541 3,5-di-tert-bu Cc1cc(cc(c1)C( 32 76516 http://www.aAlfa Aesar
    3542 3,5-lutidine Cc1cc(cnc1)C -9 11077 http://www.aAlfa Aesar
    3543 3,6-dibromo-2Cc1c(ccc(n1)B 38 2043644 http://www. Alfa Aesar
    3544 3,6-dichloro- Cc1cc(nnc1Cl) 87 79323 http://www.aAlfa Aesar
    3545 3,6-dichloropyc1cc(nnc1Cl)C 68 60662 http://www.aAlfa Aesar
    3546 3,6-dichloropyc1c(c(nnc1Cl) 139 383636 http://www.aAlfa Aesar
    3547 3,6-difluorosac1cc(c(c(c1F) 75 11447345 http://www. Alfa Aesar
    3548 3,6-difluorosalc1cc(c(c(c1F) 152 21469693 http://www. Alfa Aesar
    3549 3,6-dihydroxyc1ccc(cc1)c2c 233 600072 http://www. Alfa Aesar
    3550 3,6-dimethyl- Cc1cc(c(c(=O) 210 10437222 http://www. Alfa Aesar
    3551 3,6-dimethyl-4CCC(C)(C#CC( 54 6298 http://www.aAlfa Aesar
    3552 3,6-di-tert-bu CC(C)(C)c1ccc 81 9315549 http://www.aAlfa Aesar
    3553 3,8-diamino-6c1ccc(cc1)c2c 197 93938 http://www.aAlfa Aesar
    3554 3,8-dimethox COc1cccc2c1c 137 5373901 http://www.aAlfa Aesar
    3555 3,9-bis(1,1-d CC(C)(CO)C1O 199 5886014 http://www.aAlfa Aesar
    3556 3-[4-(4-methoCOc1ccc(cc1)c 236 21476913 http://www. Alfa Aesar
    3557 3'-acetamido CC(=O)c1cccc 127 307090 http://www.aAlfa Aesar
    3558 3-acetamidobeCC(=O)Nc1ccc 251 44427 http://www.aAlfa Aesar
    3559 3-acetamidopCC(=O)Nc1ccc 148 11626 http://www.aAlfa Aesar
    3560 3-acetoxy-2-mCc1c(cccc1OC 150 3025966 http://www.aAlfa Aesar
    3561 3-acetoxy-2-mCc1c(cccc1OC( 33 5373916 http://www.aAlfa Aesar
    3562 3-acetyl-2,4- CCOC(=O)c1c(c 142 16056 http://www.aAlfa Aesar
    3563 3-acetyl-2,5- CC(=O)c1cc(sc 38 106264 http://www.aAlfa Aesar
    3564 3-acetyl-2-meCc1c(cc(s1)c2 68 2010737 http://www.aAlfa Aesar
    3565 3-acetyl-5-br CC(=O)c1cc(cn 78 716809 http://www.aAlfa Aesar
    3566 3-acetylacrylicCC(=O)/C=C/C 124 4515976 http://www.aAlfa Aesar
    3567 3-acetylbenzeB(c1cccc(c1)C 203 2016062 http://www.aAlfa Aesar
    3568 3-acetylbenzeCC(=O)c1cccc( 43 2037024 http://www. Alfa Aesar
    3569 3-acetylbenzoCC(=O)c1csc2 64 13678 http://www.aAlfa Aesar
    3570 3-acetylbenzoiCC(=O)c1cccc 164 191058 http://www.aAlfa Aesar
    3571 3-acetylbenzon
    CC(=O)c1cccc 99 72466 http://www.aAlfa Aesar
    3572 3-acetylcoumaCC(=O)c1cc2c 122 69959 http://www.aAlfa Aesar
    3573 3-acetylindoleCC(=O)c1c[nH 189 12275 http://www.aAlfa Aesar
    3574 3-acetylphenyCC(=O)c1cccc 24 454039 http://www.aAlfa Aesar
    3575 3-acetylpyridiCC(=O)c1cccn 12 13856009 http://www.aAlfa Aesar
    3576 3-acetylpyrrolCC(=O)c1cc[n 112 2019424 http://www.aAlfa Aesar
    3577 3-acetylthiop CC(=O)c1ccsc 60 14388 http://www.aAlfa Aesar
    3578 3-amino-1-(4-c1cc(ccc1n2cc 108 10552854 http://www. Alfa Aesar
    3579 3-amino-1-(4-COc1ccc(cc1)n 182 10552848 http://www. Alfa Aesar
    3580 3-amino-1,2,4-c1[nH]nc(n1) 151 1577 http://www.aAlfa Aesar
    3581 3-amino-1h-pyc1c[nH]nc1N 37 67140 http://www.aAlfa Aesar
    3582 3-amino-1h-pyc1c(c(n[nH]1) 175 77125 http://www.aAlfa Aesar
    3583 3-amino-1-phCC(CCc1ccccc -50 28910 http://www.aAlfa Aesar
    3584 3-amino-1-pr C(CN)CO 11 8733 http://www.aAlfa Aesar
    3585 3-amino-2-(tr c1cc(c(nc1)C(F 70 8594917 http://www. Alfa Aesar
    3586 3-amino-2,2-dCC(C)(CN)CO 70 104847 http://www.aAlfa Aesar
    3587 3-amino-2,5,6-c1c(c(c(c(c1F 178 526454 http://www.aAlfa Aesar
    3588 3-amino-2,6-dCc1ccc(c(n1)C 122 69413 http://www.aAlfa Aesar
    3589 3-amino-2-br Cc1cc(c(nc1)B 105 23347312 http://www. Alfa Aesar
    3590 3-amino-2-br c1cc(c(nc1)Br 77 558002 http://www.aAlfa Aesar
    3591 3-amino-2-chlCc1ccnc(c1N)C 66 2037151 http://www. Alfa Aesar
    3592 3-amino-2-chlc1cc(c(nc1)Cl 78 72727 http://www.aAlfa Aesar
    3593 3-amino-2-cycC1CC(=CC(=O) 131 71227 http://www.aAlfa Aesar
    3594 3-amino-2-metCc1c(cccc1N) 187 2015475 http://www.aAlfa Aesar
    3595 3-amino-2-metCc1c(cccn1)N 117 497851 http://www. Alfa Aesar
    3596 3-amino-2-na c1ccc2cc(c(cc 235 71766 http://www.aAlfa Aesar
    3597 3-amino-2-nitc1cc(c(nc1)[N 192 75143 http://www.aAlfa Aesar
    3598 3-amino-2-phc1ccc(cc1)C2 271 256914 http://www.aAlfa Aesar
    3599 3-amino-4,5-dc1ccc(cc1)N2 169 89176 http://www.aAlfa Aesar
    3600 3-amino-4-br c1c(c(n[nH]1) 136 123532 http://www.aAlfa Aesar
    3601 3-amino-4-br Cn1cc(c(n1)N) 98 2016977 http://www.aAlfa Aesar
    3602 3-amino-4-br Cc1c(c(no1)N) 74 2054863 http://www.aAlfa Aesar
    3603 3-amino-4-broc1ccc(cc1)c2c 114 516648 http://www.aAlfa Aesar
    3604 3-amino-4-ch c1cc(c(cc1C(= 165 79569 http://www.aAlfa Aesar
    3605 3-amino-4-chlc1cc(c(cc1C(= 216 68579 http://www.aAlfa Aesar
    3606 3-amino-4-chlc1cncc(c1Cl)N 61 505808 http://www.aAlfa Aesar
    3607 3-amino-4-hy c1cc(c(cc1C( 251 509270 http://www.aAlfa Aesar
    3608 3-amino-4-iodc1cncc(c1I)N 61 715674 http://www. Alfa Aesar
    3609 3-amino-4-meCOc1ccc(cc1N 158 78600 http://www.aAlfa Aesar
    3610 3-amino-4-meCOc1ccc(cc1N 155 8119 http://www.aAlfa Aesar
    3611 3-amino-4-metCOc1ccc(cc1N 62 87542 http://www.aAlfa Aesar
    3612 3-amino-4-metCOc1ccc(cc1N 209 16842 http://www.aAlfa Aesar
    3613 3-amino-4-meCc1ccc(cc1N) 129 79429 http://www.aAlfa Aesar
    3614 3-amino-4-metB(c1ccc(c(c1) 250 2019434 http://www.aAlfa Aesar
    3615 3-amino-4-metCc1ccc(cc1N) 166 68093 http://www.aAlfa Aesar
    3616 3-amino-4-metCc1ccncc1N 104 121583 http://www.aAlfa Aesar
    3617 3-amino-4-phec1ccc(cc1)c2c 172 72003 http://www. Alfa Aesar
    3618 3-amino-5-(2-fc1cc(oc1)c2cc 126 456380 http://www.aAlfa Aesar
    3619 3-amino-5-(tr c1cc2c(cc1C(F 135 15865 http://www. Alfa Aesar
    3620 3-amino-5-(tr c1c(cc(cc1C(F 144 529875 http://www. Alfa Aesar
    3621 3-amino-5,6-diCc1c(nnc(n1)N 211 78628 http://www.aAlfa Aesar
    3622 3-amino-5-broc1c(cnc(c1N)C 131 10594870 http://www. Alfa Aesar
    3623 3-amino-5-chlc1c(cncc1Cl)N 73 714887 http://www. Alfa Aesar
    3624 3-amino-5-metCc1cc(n[nH]1 45 84091 http://www.aAlfa Aesar
    3625 3-amino-5-metCSc1c(c(n[nH 149 643332 http://www.aAlfa Aesar
    3626 3-amino-5-nitc1c(cc(cc1N)[ 216 209097 http://www.aAlfa Aesar
    3627 3-amino-5-phec1ccc(cc1)c2c 126 120419 http://www.aAlfa Aesar
    3628 3-amino-5-terCC(C)(C)c1cc( 77 456025 http://www.aAlfa Aesar
    3629 3-amino-5-terCC(C)(C)c1cc( 112 149904 http://www.aAlfa Aesar
    3630 3-amino-9-ethCCn1c2ccccc2 99 8269 http://www.aAlfa Aesar
    3631 3'-aminoacet CC(=O)c1cccc( 96 21106518 http://www.aAlfa Aesar
    3632 3-aminobenzac1cc(cc(c1)N) 113 1583 http://www.aAlfa Aesar
    3633 3-aminobenzec1cc(cc(c1)S( 141 7099 http://www.aAlfa Aesar
    3634 3-aminobenzhc1cc(cc(c1)N) 92 75940 http://www.aAlfa Aesar
    3635 3-aminobenzoic1cc(cc(c1)N) 175 7141 http://www.aAlfa Aesar
    3636 3-aminobenzon
    c1cc(cc(c1)N) 52 21111842 http://www.aAlfa Aesar
    3637 3-aminobenz c1ccc(cc1)C(= 86 16836 http://www.aAlfa Aesar
    3638 3-aminobenzylc1cc(cc(c1)N) 93 72534 http://www.aAlfa Aesar
    3639 3-aminocarbon
    c1c(cc(cc1C(= 241 15351232 http://www. Alfa Aesar
    3640 3-aminocoumac1ccc2c(c1)cc 136 66824 http://www.aAlfa Aesar
    3641 3-aminophenoc1cc(cc(c1)O) 124 11080 http://www.aAlfa Aesar
    3642 3-aminophenyC#Cc1cccc(c1 27 94504 http://www.aAlfa Aesar
    3643 3-aminophthac1cc2c(c(c1)N 328 10192 http://www.aAlfa Aesar
    3644 3-aminopyridic1cc(cnc1)N 61 21111768 http://www.aAlfa Aesar
    3645 3-aminoquinolc1ccc2c(c1)cc 94 10897 http://www.aAlfa Aesar
    3646 3-aminothiop c1csc(c1N)C( 121 452727 http://www.aAlfa Aesar
    3647 3-anilino-2-c c1ccc(cc1)NC 177 89231 http://www.aAlfa Aesar
    3648 3-benzoyl-1,1,c1ccc(cc1)C(= 39 60910 http://www.aAlfa Aesar
    3649 3-benzoylbenzc1ccc(cc1)C(= 164 91613 http://www.aAlfa Aesar
    3650 3-benzoylpropc1ccc(cc1)C( 117 65703 http://www.aAlfa Aesar
    3651 3-benzoylpyri c1ccc(cc1)C(= 38 20245 http://www.aAlfa Aesar
    3652 3-benzoylthioc1ccc(cc1)C(= 152 279249 http://www. Alfa Aesar
    3653 3-benzylanilinc1ccc(cc1)Cc2 50 273062 http://www.aAlfa Aesar
    3654 3-benzyloxy- COc1ccc(cc1O 62 72856 http://www.aAlfa Aesar
    3655 3-benzyloxy-4COc1ccc(cc1O 180 84885 http://www.aAlfa Aesar
    3656 3-benzyloxyb c1ccc(cc1)COc 56 66938 http://www.aAlfa Aesar
    3657 3-benzyloxybeB(c1cccc(c1)O 123 2016065 http://www.aAlfa Aesar
    3658 3-benzyloxybec1ccc(cc1)COc 134 273402 http://www. Alfa Aesar
    3659 3-benzyloxybec1ccc(cc1)COc 49 66937 http://www. Alfa Aesar
    3660 3-benzyloxyphc1ccc(cc1)COc 50 488077 http://www.aAlfa Aesar
    3661 3-benzyloxyphc1ccc(cc1)COc 49 453438 http://www.aAlfa Aesar
    3662 3-brombenzo c1ccc(cc1)C(= 76 63718 http://www. Alfa Aesar
    3663 3-bromo-2-(brC(C(CBr)C(=O) 100 282302 http://www.aAlfa Aesar
    3664 3-bromo-2,4,5-
    c1c(c(c(c(c1F) 123 2063389 http://www.aAlfa Aesar
    3665 3-bromo-2,4,6Cc1cc(c(c(c1N 36 599774 http://www.aAlfa Aesar
    3666 3-bromo-2,4-dCc1c(c(sc1c2c 34 24589202 http://www. Alfa Aesar
    3667 3-bromo-2,5-dc1c(cnc(c1Br)C 39 14306554 http://www. Alfa Aesar
    3668 3-bromo-2,6-dc1cc(nc(c1Br)C 70 15575555 http://www. Alfa Aesar
    3669 3-bromo-2,6-dc1cc(c(c(c1F) 55 11186536 http://www. Alfa Aesar
    3670 3-bromo-2,6-dCOc1ccc(c(c1 146 2055133 http://www.aAlfa Aesar
    3671 3-bromo-2-chlc1cc(c(nc1)Cl) 55 604131 http://www.aAlfa Aesar
    3672 3-bromo-2-chlc1c(cnc(c1Br) 68 2072556 http://www.aAlfa Aesar
    3673 3-bromo-2-cy c1cc(c(nc1)C# 98 714361 http://www. Alfa Aesar
    3674 3-bromo-2-fluc1cc(c(c(c1)B 169 2017984 http://www. Alfa Aesar
    3675 3-bromo-2-hyd
    Cc1cc(c(nc1)O 157 2955947 http://www.aAlfa Aesar
    3676 3-bromo-2-hyd
    c1cc(c(nc1)O) 187 715125 http://www.aAlfa Aesar
    3677 3-bromo-2-nitc1cc(c(nc1)[N 104 516399 http://www.aAlfa Aesar
    3678 3-bromo-4,5-dc1c(cc(c(c1F)F 68 21242267 http://www. Alfa Aesar
    3679 3-bromo-4-chlc1cc(c(cc1C(= 220 2017231 http://www.aAlfa Aesar
    3680 3-bromo-4-chlc1cc(c(cc1C(F) -23 61303 http://www.aAlfa Aesar
    3681 3-bromo-4-cy c1cncc(c1C#N 93 9249200 http://www. Alfa Aesar
    3682 3'-bromo-4'-f CC(=O)c1ccc(c 56 63680 http://www.aAlfa Aesar
    3683 3-bromo-4-fluc1cc(c(cc1N)B 35 2059521 http://www.aAlfa Aesar
    3684 3-bromo-4-fl c1cc(c(cc1C=O 31 151517 http://www.aAlfa Aesar
    3685 3-bromo-4-fluc1cc(c(cc1C(= 140 63681 http://www.aAlfa Aesar
    3686 3-bromo-4-fluc1cc(c(cc1C#N 56 110173 http://www.aAlfa Aesar
    3687 3-bromo-4-fluc1cc(c(cc1/C= 194 599786 http://www.aAlfa Aesar
    3688 3'-bromo-4'-f CCC(=O)c1ccc( 62 2007020 http://www.aAlfa Aesar
    3689 3-bromo-4-hyCOc1cc(cc(c1 256 642943 http://www.aAlfa Aesar
    3690 3-bromo-4-hyc1cc(c(cc1C=O 127 68785 http://www.aAlfa Aesar
    3691 3-bromo-4-hyd
    c1cc(c(cc1C(= 177 76106 http://www.aAlfa Aesar
    3692 3-bromo-4-hyd
    c1cc(c(cc1C#N 159 67878 http://www.aAlfa Aesar
    3693 3-bromo-4-hyd
    c1cc(c(cc1CO) 130 108498 http://www. Alfa Aesar
    3694 3-bromo-4-meCOc1ccc(cc1B 51 89103 http://www.aAlfa Aesar
    3695 3-bromo-4-meCOc1ccc(cc1B 220 60200 http://www.aAlfa Aesar
    3696 3-bromo-4-met
    COc1ccc(cc1B 122 643189 http://www.aAlfa Aesar
    3697 3-bromo-4-meCOc1ccc(cc1B 61 11438627 http://www. Alfa Aesar
    3698 3-bromo-4-met
    COc1ccc(cc1B 52 455914 http://www.aAlfa Aesar
    3699 3-bromo-4-met
    Cc1ccc(cc1Br) 27 74169 http://www.aAlfa Aesar
    3700 3-bromo-4-met
    Cc1ccc(cc1Br) 209 74124 http://www.aAlfa Aesar
    3701 3-bromo-4-met
    Cc1ccc(cc1Br 41 11544936 http://www. Alfa Aesar
    3702 3-bromo-4-meCc1ccc(cc1Br) 56 8483379 http://www. Alfa Aesar
    3703 3-bromo-4-nitc1cc(c(cc1C(= 202 14317613 http://www. Alfa Aesar
    3704 3-bromo-4-nitc1c[n+](cc(c1[ 153 477342 http://www.aAlfa Aesar
    3705 3-bromo-5-(trc1c(cncc1Br)C( 45 9303111 http://www. Alfa Aesar
    3706 3-bromo-5-chc1c(cc(c(c1C= 86 453297 http://www.aAlfa Aesar
    3707 3-bromo-5-chlc1c(cncc1Br)C 80 526989 http://www. Alfa Aesar
    3708 3-bromo-5-et CCOc1cc(cc(c 142 532424 http://www.aAlfa Aesar
    3709 3-bromo-5-fluCOc1c(cc(cc1B 72 21242264 http://www. Alfa Aesar
    3710 3-bromo-5-fluc1c(cc(cc1F)B 143 2053758 http://www. Alfa Aesar
    3711 3-bromo-5-fluc1c(cncc1Br)F 26 716621 http://www. Alfa Aesar
    3712 3-bromo-5-iodc1c(cc(cc1Br) 220 4354593 http://www.aAlfa Aesar
    3713 3-bromo-5-meCOc1cc(cnc1) 31 713858 http://www. Alfa Aesar
    3714 3-bromo-5-nitc1c(cc(cc1[N+ 160 209091 http://www.aAlfa Aesar
    3715 3-bromo-5-nitc1c(cc(c(c1C= 149 452973 http://www.aAlfa Aesar
    3716 3'-bromoacet CC(=O)c1cccc( 8 15644 http://www.aAlfa Aesar
    3717 3-bromoanilinc1cc(cc(c1)Br 16 13860633 http://www.aAlfa Aesar
    3718 3-bromoanisoCOc1cccc(c1)B 2 16077 http://www.aAlfa Aesar
    3719 3-bromobenzac1cc(cc(c1)Br 20 21106543 http://www.aAlfa Aesar
    3720 3-bromobenzac1cc(cc(c1)Br 72 528574 http://www.aAlfa Aesar
    3721 3-bromobenzac1ccc2c(c1)-c 166 6441 http://www.aAlfa Aesar
    3722 3-bromobenzeB(c1cccc(c1)B 166 2016070 http://www.aAlfa Aesar
    3723 3-bromobenzec1cc(cc(c1)Br 156 2016509 http://www.aAlfa Aesar
    3724 3-bromobenzen
    c1cc(cc(c1)Br) 32 16947 http://www.aAlfa Aesar
    3725 3-bromobenzhc1cc(cc(c1)Br 156 454393 http://www.aAlfa Aesar
    3726 3-bromobenzoi
    c1cc(cc(c1)Br 155 10972 http://www.aAlfa Aesar
    3727 3-bromobenzon
    c1cc(cc(c1)Br 39 21865 http://www.aAlfa Aesar
    3728 3-bromobenzyc1cc(cc(c1)Br) 42 63171 http://www.aAlfa Aesar
    3729 3-bromocatecc1cc(c(c(c1)B 41 24835 http://www. Alfa Aesar
    3730 3-bromochro c1ccc2c(c1)c( 96 454683 http://www.aAlfa Aesar
    3731 3-bromoimidaz
    c1ccn2c(c1)nc 93 290441 http://www. Alfa Aesar
    3732 3-bromo-n,n-dCN(C)c1cccc(c 11 21169887 http://www.aAlfa Aesar
    3733 3-bromophenoc1cc(cc(c1)Br 30 13875441 http://www.aAlfa Aesar
    3734 3-bromophenyl
    c1cc(cc(c1)Br 101 67228 http://www.aAlfa Aesar
    3735 3-bromophenyl
    c1cc(cc(c1)Br 27 33137 http://www.aAlfa Aesar
    3736 3-bromopropio
    C(CBr)C(=O)O 60 11066 http://www.aAlfa Aesar
    3737 3'-bromopropCCC(=O)c1cccc 40 79633 http://www.aAlfa Aesar
    3738 3-bromopyridc1cc(cnc1)Br -27 11783 http://www.aAlfa Aesar
    3739 3-bromopyridic1cc(c[n+](c1) 35 125950 http://www. Alfa Aesar
    3740 3-bromoquinoc1ccc2c(c1)cc 14 20124 http://www.aAlfa Aesar
    3741 3-bromothioph
    c1csc(c1Br)C# 49 2021685 http://www.aAlfa Aesar
    3742 3-bromothiopc1csc(c1Br)C( 78 526523 http://www.aAlfa Aesar
    3743 3-bromothioph
    c1csc(c1Br)C( 196 2021306 http://www.aAlfa Aesar
    3744 3-bromotolueCc1cccc(c1)Br -40 13875392 http://www.aAlfa Aesar
    3745 3-butyn-1-ol C#CCCO -63 12977 http://www.aAlfa Aesar
    3746 3-butyrylcoumCCCC(=O)c1cc 94 2054935 http://www.aAlfa Aesar
    3747 3-carboxy-4-f B(c1ccc(c(c1) 218 2043931 http://www. Alfa Aesar
    3748 3-carboxybenc1cc(cc(c1)C( 174 11580 http://www.aAlfa Aesar
    3749 3-chloro-1,2-bc1ccc2c(c1)c(n 39 519985 http://www.aAlfa Aesar
    3750 3-chloro-1,2- C(C(CCl)O)O -40 7018 http://www.aAlfa Aesar
    3751 3-chloro-1-pr C(CO)CCl -20 11809 http://www.aAlfa Aesar
    3752 3-chloro-2,4,5c1(c(c(c(c(c1F 90 2054245 http://www.aAlfa Aesar
    3753 3-chloro-2,4-dc1cc(c(c(c1C(= 176 2053948 http://www.aAlfa Aesar
    3754 3-chloro-2,6- c1c(c(c(c(c1Br 98 2018146 http://www.aAlfa Aesar
    3755 3-chloro-2,6- Cc1cc(c(c(c1Cl 77 127954 http://www.aAlfa Aesar
    3756 3-chloro-2,6-dc1cc(c(c(c1F)N 47 15661372 http://www. Alfa Aesar
    3757 3-chloro-2,6- c1cc(c(c(c1F)C 45 643464 http://www.aAlfa Aesar
    3758 3-chloro-2,6- c1cc(c(c(c1F)C 135 2053933 http://www.aAlfa Aesar
    3759 3-chloro-2,6-dc1cc(c(c(c1F)C 127 2053950 http://www.aAlfa Aesar
    3760 3-chloro-2,6- COc1c(cc(c(c1 131 2055142 http://www.aAlfa Aesar
    3761 3-chloro-2,6-dCc1ccc(c(c1N) 31 5385887 http://www.aAlfa Aesar
    3762 3-chloro-2-cy c1cc(c(nc1)C# 84 714888 http://www. Alfa Aesar
    3763 3-chloro-2-fluc1c(cc(c(c1C(= 90 2054163 http://www.aAlfa Aesar
    3764 3-chloro-2-fluc1cc(c(c(c1C(F 97 2054166 http://www.aAlfa Aesar
    3765 3-chloro-2-fl c1cc(c(c(c1)Cl 126 451815 http://www.aAlfa Aesar
    3766 3-chloro-2-fluc1cc(c(c(c1)Cl 177 267772 http://www.aAlfa Aesar
    3767 3-chloro-2-fluc1cc(c(c(c1)Cl 42 456305 http://www. Alfa Aesar
    3768 3-chloro-2-fl c1cc(c(c(c1)Cl 38 456064 http://www.aAlfa Aesar
    3769 3-chloro-2-fl c1cc(c(c(c1)Cl 36 2054124 http://www. Alfa Aesar
    3770 3-chloro-2-fluB(c1ccnc(c1Cl 128 21242465 http://www. Alfa Aesar
    3771 3-chloro-2-hy c1cc(c(nc1)O) 181 506051 http://www.aAlfa Aesar
    3772 3-chloro-2-io Cc1cccc(c1I)Cl 27 122035 http://www.aAlfa Aesar
    3773 3'-chloro-2'-mCc1c(cccc1Cl) 156 73974 http://www.aAlfa Aesar
    3774 3-chloro-2-meCc1c(cccc1Cl) 2 6628 http://www.aAlfa Aesar
    3775 3-chloro-2-meCc1c(cccc1Cl) -3 69205 http://www.aAlfa Aesar
    3776 3-chloro-2-meCc1c(cccc1Cl) 71 455980 http://www.aAlfa Aesar
    3777 3-chloro-2-meCc1c(cccc1Cl) 164 74015 http://www.aAlfa Aesar
    3778 3-chloro-2-meCc1c(cccc1Cl) 22 454907 http://www.aAlfa Aesar
    3779 3-chloro-2-meCC(=C)CCl -80 21106501 http://www.aAlfa Aesar
    3780 3-chloro-2-nitc1cc(c(c(c1)C 237 19663 http://www. Alfa Aesar
    3781 3-chloro-2-nitc1cc(c(nc1)[N+ 91 482627 http://www.aAlfa Aesar
    3782 3-chloro-3-meCC(C)(C#C)Cl -61 63845 http://www.aAlfa Aesar
    3783 3-chloro-4-(3-c1cc(cnc1)c2c 56 8663567 http://www. Alfa Aesar
    3784 3-chloro-4-(tr c1cc(c(cc1N)Cl 30 2054252 http://www.aAlfa Aesar
    3785 3-chloro-4-(tr c1cc(c(cc1C#N 40 2054255 http://www.aAlfa Aesar
    3786 3-chloro-4-(tr c1cc(c(cc1N)Cl 43 2018371 http://www.aAlfa Aesar
    3787 3-chloro-4-cy c1cncc(c1C#N) 73 8853653 http://www. Alfa Aesar
    3788 3'-chloro-4'-f CC(=O)Nc1ccc( 118 512166 http://www.aAlfa Aesar
    3789 3'-chloro-4'- CC(=O)c1ccc(c 39 453954 http://www.aAlfa Aesar
    3790 3-chloro-4-fluc1cc(c(cc1N)Cl 46 9327 http://www.aAlfa Aesar
    3791 3-chloro-4-fl c1cc(c(cc1C=O 27 516246 http://www.aAlfa Aesar
    3792 3-chloro-4-fl c1cc(c(cc1C(= 146 2018186 http://www.aAlfa Aesar
    3793 3-chloro-4-fl B(c1ccc(c(c1)C 258 2016404 http://www.aAlfa Aesar
    3794 3-chloro-4-fl c1cc(c(cc1S(= 109 5828174 http://www. Alfa Aesar
    3795 3-chloro-4-fluc1cc(c(cc1C(= 135 454438 http://www.aAlfa Aesar
    3796 3-chloro-4-fluc1cc(c(cc1C#N 70 128369 http://www.aAlfa Aesar
    3797 3-chloro-4-fl c1cc(c(cc1O)Cl 41 68299 http://www.aAlfa Aesar
    3798 3-chloro-4-fluc1cc(c(cc1CC( 57 2054133 http://www. Alfa Aesar
    3799 3-chloro-4-fl c1cc(c(cc1NN) 74 2018237 http://www.aAlfa Aesar
    3800 3-chloro-4'-f c1cc(ccc1C(=O 48 60991 http://www.aAlfa Aesar
    3801 3-chloro-4-fo B(c1ccc(c(c1) 212 21242453 http://www. Alfa Aesar
    3802 3-chloro-4-hy COc1cc(cc(c1 117 3392686 http://www.aAlfa Aesar
    3803 3-chloro-4-hy c1cc(c(cc1C=O 130 16125 http://www.aAlfa Aesar
    3804 3-chloro-4-hy c1cc(c(cc1C(= 169 18708 http://www.aAlfa Aesar
    3805 3-chloro-4-hy c1cc(c(cc1C#N 148 2017425 http://www. Alfa Aesar
    3806 3-chloro-4-iodc1cc(c(cc1N)Cl 68 249198 http://www.aAlfa Aesar
    3807 3'-chloro-4'- CC(=O)c1ccc(c 75 454321 http://www. Alfa Aesar
    3808 3-chloro-4-meCOc1ccc(cc1C 217 148648 http://www.aAlfa Aesar
    3809 3-chloro-4-meCOc1ccc(cc1C 109 3527917 http://www.aAlfa Aesar
    3810 3'-chloro-4'-mCc1ccc(cc1Cl) 104 22007 http://www.aAlfa Aesar
    3811 3-chloro-4-meCc1ccc(cc1Cl) 23 6985 http://www.aAlfa Aesar
    3812 3-chloro-4-meB(c1ccc(c(c1)C 227 3079688 http://www. Alfa Aesar
    3813 3-chloro-4-m Cc1ccc(cc1Cl) 137 225255 http://www. Alfa Aesar
    3814 3-chloro-4-meCc1ccc(cc1Cl) 36 227984 http://www.aAlfa Aesar
    3815 3-chloro-4-meCc1ccc(cc1Cl) 199 71175 http://www.aAlfa Aesar
    3816 3-chloro-4-meCc1ccc(cc1Cl) 52 14163 http://www. Alfa Aesar
    3817 3-chloro-4-meCc1ccc(cc1Cl 22 56566 http://www.aAlfa Aesar
    3818 3-chloro-4-nitc1cc(c(cc1N)C 159 63188 http://www. Alfa Aesar
    3819 3-chloro-4-nitc1cc(c(cc1S(=O 38 21242260 http://www. Alfa Aesar
    3820 3-chloro-5-(tr c1c(cc(cc1C(F 126 3025062 http://www. Alfa Aesar
    3821 3-chloro-5-fl COc1c(cc(cc1C 72 3078668 http://www. Alfa Aesar
    3822 3-chloro-5-fl COc1c(cc(cc1C 38 2543381 http://www. Alfa Aesar
    3823 3'-chloro-5'- CC(=O)c1cc(cc 53 2038291 http://www. Alfa Aesar
    3824 3-chloro-5-fluc1c(cc(cc1F)C 57 2016585 http://www. Alfa Aesar
    3825 3-chloro-5-fluc1c(cc(cc1F)C 84 2016581 http://www. Alfa Aesar
    3826 3-chloro-5-fluc1c(cncc1Cl)F 26 16788555 http://www. Alfa Aesar
    3827 3-chloro-5-meB(c1cc(cc(c1) 187 16498232 http://www. Alfa Aesar
    3828 3-chloro-6-hy c1cc(nnc1NN) 137 91067 http://www.aAlfa Aesar
    3829 3-chloro-6-meCOc1ccc(nn1)C 91 66995 http://www.aAlfa Aesar
    3830 3-chloro-6-meCc1ccc(nn1)Cl 57 197691 http://www.aAlfa Aesar
    3831 3'-chloroacetaCC(=O)Nc1cccc 77 11009 http://www.aAlfa Aesar
    3832 3-chloroanilinc1cc(cc(c1)Cl) -10 13869451 http://www.aAlfa Aesar
    3833 3-chlorobenz c1cc(cc(c1)Cl 17 21111819 http://www.aAlfa Aesar
    3834 3-chlorobenz c1cc(cc(c1)Cl 135 62467 http://www.aAlfa Aesar
    3835 3-chlorobenzeB(c1cccc(c1)C 183 2016075 http://www.aAlfa Aesar
    3836 3-chlorobenz c1cc(cc(c1)Cl 146 453031 http://www.aAlfa Aesar
    3837 3-chlorobenzec1cc(cc(c1)Cl) 21 16916 http://www.aAlfa Aesar
    3838 3-chlorobenzhc1cc(cc(c1)Cl 158 66893 http://www.aAlfa Aesar
    3839 3-chlorobenzoc1ccc2c(c1)c(c 113 453494 http://www.aAlfa Aesar
    3840 3-chlorobenzoc1ccc2c(c1)c( 235 527678 http://www.aAlfa Aesar
    3841 3-chlorobenzoc1ccc2c(c1)c( 266 272231 http://www.aAlfa Aesar
    3842 3-chlorobenzoc1cc(cc(c1)Cl 157 434 http://www.aAlfa Aesar
    3843 3-chlorobenzon
    c1cc(cc(c1)Cl 41 12474 http://www.aAlfa Aesar
    3844 3-chlorobenz c1ccc(cc1)C(= 83 59487 http://www.aAlfa Aesar
    3845 3-chlorobenzot
    c1cc(cc(c1)Cl) -56 7096 http://www.aAlfa Aesar
    3846 3-chlorobenzoy
    c1cc(cc(c1)Cl 81 124240 http://www.aAlfa Aesar
    3847 3-chlorocoumc1ccc2c(c1)cc 123 86777 http://www. Alfa Aesar
    3848 3-chlorophenoc1cc(cc(c1)Cl) 32 13875432 http://www.aAlfa Aesar
    3849 3-chlorophenoc1cc(cc(c1)Cl 108 11013 http://www.aAlfa Aesar
    3850 3-chlorophenoc1cc(cc(c1)Cl 29 125848 http://www.aAlfa Aesar
    3851 3-chlorophenyc1cc(cc(c1)Cl -4 16972 http://www.aAlfa Aesar
    3852 3-chlorophenylc1cc(cc(c1)Cl 79 15092 http://www.aAlfa Aesar
    3853 3-chlorophenylc1cc(cc(c1)Cl 12 66365 http://www.aAlfa Aesar
    3854 3-chlorophenyc1cc(cc(c1)Cl) 71 2038561 http://www.aAlfa Aesar
    3855 3-chloropropioC(CCl)C(=O)O 39 7611 http://www.aAlfa Aesar
    3856 3-chloropropioC(CCl)C#N -51 10498 http://www.aAlfa Aesar
    3857 3-chloropropioC(CCl)C(=O)Cl -32 62573 http://www.aAlfa Aesar
    3858 3'-chloroprop CCC(=O)c1cccc 46 510345 http://www.aAlfa Aesar
    3859 3-chlorothiop c1csc(c1Cl)C( 186 611195 http://www.aAlfa Aesar
    3860 3-chlorotolue Cc1cccc(c1)Cl -48 13875230 http://www.aAlfa Aesar
    3861 3-cyano-2-flu c1cc(c(nc1)F) 29 2063397 http://www.aAlfa Aesar
    3862 3-cyano-2-phec1ccc(cc1)Oc2 108 75999 http://www.aAlfa Aesar
    3863 3-cyano-4-flu c1cc(c(cc1S(= 69 2059148 http://www.aAlfa Aesar
    3864 3-cyano-4-metCc1ccncc1C#N 43 198210 http://www.aAlfa Aesar
    3865 3-cyano-5-metCc1cc(cnc1)C 84 553424 http://www.aAlfa Aesar
    3866 3-cyanobenzac1cc(cc(c1)C 77 21112367 http://www.aAlfa Aesar
    3867 3-cyanobenzec1cc(cc(c1)S( 152 2087149 http://www. Alfa Aesar
    3868 3-cyanobenzen
    c1cc(cc(c1)S( 50 2080072 http://www.aAlfa Aesar
    3869 3-cyanobenzoic1cc(cc(c1)C( 222 15088 http://www.aAlfa Aesar
    3870 3-cyanophenylc1cc(cc(c1)N 53 2015117 http://www.aAlfa Aesar
    3871 3-cyanophenylc1cc(cc(c1)N 65 69043 http://www.aAlfa Aesar
    3872 3-cyanopyridi c1cc(cnc1)C# 50 78 http://www.aAlfa Aesar
    3873 3-cyanopyridi c1cc(c[n+](c1 177 76396 http://www.aAlfa Aesar
    3874 3-cyclohexeneC1CC(CC=C1) 2 21106029 http://www.aAlfa Aesar
    3875 3-cyclohexeneC1CC(CC=C1)C 17 19664 http://www.aAlfa Aesar
    3876 3-cyclohexylprC1CCC(CC1)CC 16 62903 http://www.aAlfa Aesar
    3877 3-decanone CCCCCCCC(=O -4 12987 http://www.aAlfa Aesar
    3878 3-diethoxyphoCCOP(=O)(OCC 74 3500129 http://www. Alfa Aesar
    3879 3-dimethylamiCN(C)c1nc(=S) 176 2029009 http://www.aAlfa Aesar
    3880 3-dimethylamCN(C)CCCO -35 69110 http://www.aAlfa Aesar
    3881 3-dimethylamiCN(C)c1cccc(c 151 60201 http://www.aAlfa Aesar
    3882 3-dimethylamCN(C)c1cccc(c 82 7143 http://www.aAlfa Aesar
    3883 3-ethoxy-2-ni CCOc1cccnc1[ 30 47763 http://www.aAlfa Aesar
    3884 3-ethoxy-4-h CCOc1cc(ccc1 77 8154 http://www.aAlfa Aesar
    3885 3-ethoxy-4-m CCOc1cc(ccc1 52 214032 http://www.aAlfa Aesar
    3886 3-ethoxy-4-meCCOc1cc(ccc1 158 2101170 http://www.aAlfa Aesar
    3887 3'-ethoxyacetaCCOc1cccc(c1 97 11082 http://www.aAlfa Aesar
    3888 3-ethoxybenz CCOc1cccc(c1 139 97814 http://www.aAlfa Aesar
    3889 3-ethoxybenzeB(c1cccc(c1)O 144 2054329 http://www.aAlfa Aesar
    3890 3-ethoxybenz CCOc1cccc(c1 103 124719 http://www.aAlfa Aesar
    3891 3-ethoxybenzoCCOc1cccc(c1 136 11628 http://www.aAlfa Aesar
    3892 3-ethoxyphenCCOc1cccc(c1 30 62517 http://www.aAlfa Aesar
    3893 3-ethoxysalic CCOc1cccc(c1 67 61425 http://www.aAlfa Aesar
    3894 3-ethoxythiopCCOc1ccsc1C( 122 2057928 http://www.aAlfa Aesar
    3895 3-ethyl-3-pen CCC(CC)(CC)O -13 11210 http://www.aAlfa Aesar
    3896 3-ethyl-5-meth
    CCc1c(c(on1) 123 1554050 http://www. Alfa Aesar
    3897 3-ethylamino CCNc1cc(ccc1 88 8121 http://www.aAlfa Aesar
    3898 3-ethylphenolCCc1cccc(c1) -4 11604 http://www.aAlfa Aesar
    3899 3-ethylpyridinCCc1cccnc1 -77 21105905 http://www.aAlfa Aesar
    3900 3-ethylrhodanCCN1C(=O)CS 38 74094 http://www.aAlfa Aesar
    3901 3-ethyltoluen CCc1cccc(c1)C -96 11603 http://www.aAlfa Aesar
    3902 3-ethynylpyri C#Cc1cccnc1 40 161680 http://www. Alfa Aesar
    3903 3-fluoro-1,2- Cc1c(c(ccc1[N 41 21168875 http://www. Alfa Aesar
    3904 3-fluoro-2-(tr c1cc(c(c(c1)F) 42 2055176 http://www. Alfa Aesar
    3905 3-fluoro-2-hy c1cc(c(nc1)O) 159 2063505 http://www. Alfa Aesar
    3906 3-fluoro-2-meCOc1c(cccc1F 113 2019003 http://www. Alfa Aesar
    3907 3-fluoro-2-metCc1c(cccc1F)N 7 251695 http://www.aAlfa Aesar
    3908 3-fluoro-2-meCc1c(cccc1F) 47 2059481 http://www. Alfa Aesar
    3909 3-fluoro-4-(tr c1cc(c(cc1N)F) 56 2017596 http://www.aAlfa Aesar
    3910 3-fluoro-4-(tr c1cc(c(cc1C(= 175 599767 http://www.aAlfa Aesar
    3911 3-fluoro-4-(tr c1cc(c(cc1C#N) 47 2019182 http://www.aAlfa Aesar
    3912 3-fluoro-4-(t c1ccc(cc1)C(=O 66 2019185 http://www. Alfa Aesar
    3913 3-fluoro-4-(tr c1cc(c(cc1CO)F 30 2019194 http://www.aAlfa Aesar
    3914 3-fluoro-4-(tr c1cc(c(cc1CBr) 26 2019206 http://www.aAlfa Aesar
    3915 3'-fluoro-4'-( CCC(=O)c1ccc( 37 2019246 http://www.aAlfa Aesar
    3916 3-fluoro-4-fo B(c1ccc(c(c1) 240 2058903 http://www.aAlfa Aesar
    3917 3'-fluoro-4'- CC(=O)c1ccc(c 128 2018967 http://www.aAlfa Aesar
    3918 3-fluoro-4-hy c1cc(c(cc1C=O 123 510448 http://www.aAlfa Aesar
    3919 3-fluoro-4-hy c1cc(c(cc1C#N 134 2063088 http://www. Alfa Aesar
    3920 3-fluoro-4-hy c1cc(c(cc1CC( 132 61329 http://www.aAlfa Aesar
    3921 3-fluoro-4-iodc1cncc(c1I)F 88 9173828 http://www. Alfa Aesar
    3922 3'-fluoro-4'- CC(=O)c1ccc(c 92 87427 http://www.aAlfa Aesar
    3923 3-fluoro-4-meCOc1ccc(cc1F 82 505120 http://www.aAlfa Aesar
    3924 3-fluoro-4-m COc1ccc(cc1F 35 61015 http://www.aAlfa Aesar
    3925 3-fluoro-4-meB(c1ccc(c(c1) 238 2062358 http://www.aAlfa Aesar
    3926 3-fluoro-4-m COc1ccc(cc1F 126 21328678 http://www. Alfa Aesar
    3927 3-fluoro-4-meCOc1ccc(cc1F) 79 2054936 http://www. Alfa Aesar
    3928 3-fluoro-4-meCOc1ccc(cc1F 211 2015200 http://www.aAlfa Aesar
    3929 3-fluoro-4-meCOc1ccc(cc1F 99 2054944 http://www.aAlfa Aesar
    3930 3-fluoro-4-meCOc1ccc(cc1F) 70 2059490 http://www. Alfa Aesar
    3931 3-fluoro-4-meCOc1ccc(cc1F 45 2054949 http://www. Alfa Aesar
    3932 3-fluoro-4-meCOc1ccc(cc1F) 37 1553310 http://www. Alfa Aesar
    3933 3-fluoro-4-meCOc1ccc(cc1F 48 120026 http://www. Alfa Aesar
    3934 3'-fluoro-4'- Cc1ccc(cc1F)C 33 2054964 http://www.aAlfa Aesar
    3935 3-fluoro-4-metCc1ccc(cc1F)N 33 9563 http://www.aAlfa Aesar
    3936 3-fluoro-4-meB(c1ccc(c(c1) 234 2062819 http://www.aAlfa Aesar
    3937 3-fluoro-4-meCc1ccc(cc1F)S 48 2058849 http://www.aAlfa Aesar
    3938 3-fluoro-4-meCc1ccc(cc1F)C 170 61006 http://www.aAlfa Aesar
    3939 3-fluoro-4-meCc1ccc(cc1F) 47 508610 http://www.aAlfa Aesar
    3940 3-fluoro-4-meCc1ccc(cc1F) 35 2054985 http://www.aAlfa Aesar
    3941 3-fluoro-4-meCc1ccc(cc1F) 106 2055013 http://www. Alfa Aesar
    3942 3-fluoro-4-nit c1cc(c(cc1N)F 160 67934 http://www. Alfa Aesar
    3943 3-fluoro-4-nit c1cc(c(cc1S(= 46 21328649 http://www. Alfa Aesar
    3944 3-fluoro-4-nit c1cc(c(cc1C(= 175 200913 http://www. Alfa Aesar
    3945 3-fluoro-4-ni c1cc(c(cc1CBr 47 2055055 http://www. Alfa Aesar
    3946 3-fluoro-4-ni c1cc(c(cc1O)F 92 454399 http://www.aAlfa Aesar
    3947 3-fluoro-4-nit Cc1ccc(c(c1)F 53 61281 http://www.aAlfa Aesar
    3948 3-fluoro-5-(t c1c(cc(cc1C(F) 116 2019176 http://www.aAlfa Aesar
    3949 3-fluoro-5-(tr c1c(cc(cc1C(F 104 452897 http://www.aAlfa Aesar
    3950 3-fluoro-5-hy c1c(cncc1F)O 163 2043604 http://www. Alfa Aesar
    3951 3-fluoro-5-meCc1cc(cc(c1)F 142 2058702 http://www. Alfa Aesar
    3952 3'-fluoroacetaCC(=O)Nc1cccc 88 9218 http://www.aAlfa Aesar
    3953 3'-fluoroacet CC(=O)c1cccc( -3 9573 http://www.aAlfa Aesar
    3954 3-fluoroanisolCOc1cccc(c1)F -35 9581 http://www.aAlfa Aesar
    3955 3-fluorobenz c1cc(cc(c1)F) 131 61315 http://www.aAlfa Aesar
    3956 3-fluorobenzeB(c1cccc(c1)F 214 2015748 http://www.aAlfa Aesar
    3957 3-fluorobenzec1cc(cc(c1)S(= 7 2016013 http://www.aAlfa Aesar
    3958 3-fluorobenzoic1cc(cc(c1)F) 123 9574 http://www.aAlfa Aesar
    3959 3-fluorobenzon
    c1cc(cc(c1)F) -16 61197 http://www.aAlfa Aesar
    3960 3-fluorobenz c1ccc(cc1)C(= 50 2059583 http://www. Alfa Aesar
    3961 3-fluorobenzoy
    c1cc(cc(c1)F)C -30 66969 http://www.aAlfa Aesar
    3962 3-fluorocatec c1cc(c(c(c1)F 72 61083 http://www.aAlfa Aesar
    3963 3-fluoro-l-tyr c1cc(c(cc1C[ 261 558483 http://www.aAlfa Aesar
    3964 3-fluoromandec1cc(cc(c1)F) 96 221089 http://www. Alfa Aesar
    3965 3-fluorophenoc1cc(cc(c1)F) 12 9360 http://www.aAlfa Aesar
    3966 3-fluorophenylc1cc(cc(c1)F) 46 60937 http://www.aAlfa Aesar
    3967 3-fluoropyridic1cc(c[n+](c1) 67 109704 http://www. Alfa Aesar
    3968 3-fluorosalicy c1cc(c(c(c1)F 69 510930 http://www.aAlfa Aesar
    3969 3-fluorosalicylc1cc(c(c(c1)F 147 236230 http://www. Alfa Aesar
    3970 3-fluorotolue Cc1cccc(c1)F -87 13875376 http://www.aAlfa Aesar
    3971 3-formylbenzeB(c1cccc(c1)C 111 2016108 http://www.aAlfa Aesar
    3972 3-furoic acid c1cocc1C(=O) 122 9849 http://www.aAlfa Aesar
    3973 3-furonitrile c1cocc1C#N 29 90982 http://www.aAlfa Aesar
    3974 3h-1,2-benzodc1ccc2c(c1)C 105 2279124 http://www.aAlfa Aesar
    3975 3-heptanone CCCCC(=O)CC -37 7514 http://www.aAlfa Aesar
    3976 3-hexadecanoCCCCCCCCCCC 43 79201 http://www.aAlfa Aesar
    3977 3-hexanone CCCC(=O)CC -55 11025 http://www.aAlfa Aesar
    3978 3-hydroxy-2,2CC(C)(CO)C(= 124 70909 http://www.aAlfa Aesar
    3979 3-hydroxy-2', COc1ccc2c(c1) 202 21242483 http://www. Alfa Aesar
    3980 3-hydroxy-2,4c1c(c(c(c(c1B 121 173834 http://www.aAlfa Aesar
    3981 3-hydroxy-2,4c1c(c(c(c(c1B 147 133896 http://www.aAlfa Aesar
    3982 3-hydroxy-2,4,c1c(c(c(c(c1I) 213 87235 http://www.aAlfa Aesar
    3983 3-hydroxy-2-i c1cc(c(nc1)I)O 193 87714 http://www.aAlfa Aesar
    3984 3-hydroxy-2-mCc1c(c(=O)cco 163 8066 http://www.aAlfa Aesar
    3985 3-hydroxy-2-mCc1c(cccc1O) 144 220829 http://www.aAlfa Aesar
    3986 3-hydroxy-2-mCc1c(cccn1)O 168 63884 http://www.aAlfa Aesar
    3987 3-hydroxy-2-nc1ccc2cc(c(cc 220 6837 http://www.aAlfa Aesar
    3988 3-hydroxy-2-nc1cc(c(c(c1)O 179 258859 http://www.aAlfa Aesar
    3989 3-hydroxy-2-nc1cc(c(nc1)[N 71 25180 http://www.aAlfa Aesar
    3990 3-hydroxy-3- CC(=NO)C(C)( 85 310459 http://www.aAlfa Aesar
    3991 3-hydroxy-4', COc1ccc(cc1)c 198 21242431 http://www. Alfa Aesar
    3992 3-hydroxy-4-i c1cc(c(cc1C(= 227 643948 http://www. Alfa Aesar
    3993 3-hydroxy-4- COc1ccc(cc1O 114 11629 http://www.aAlfa Aesar
    3994 3-hydroxy-4-mCOc1ccc(cc1O 253 12055 http://www.aAlfa Aesar
    3995 3-hydroxy-4-mCOc1ccc(cc1O 136 70467 http://www.aAlfa Aesar
    3996 3-hydroxy-4-mCc1ccc(cc1O) 210 61787 http://www.aAlfa Aesar
    3997 3-hydroxy-4-nc1cc(c(cc1C(= 234 62477 http://www.aAlfa Aesar
    3998 3-hydroxy-5-(tc1c(cc(cc1C(F 192 2063289 http://www. Alfa Aesar
    3999 3-hydroxy-5- COc1cccc2c1c( 175 600088 http://www. Alfa Aesar
    4000 3-hydroxy-5-mCc1cc(cnc1)O 138 195319 http://www. Alfa Aesar
    4001 3-hydroxy-5-pc1ccc(cc1)C2 187 2508701 http://www. Alfa Aesar
    4002 3-hydroxy-6-mCc1ccc(c(n1)[ 107 76499 http://www.aAlfa Aesar
    4003 3'-hydroxy-6- Cc1ccc2c(c1)c 205 9251091 http://www. Alfa Aesar
    4004 3'-hydroxyac CC(=O)c1cccc( 95 8174 http://www.aAlfa Aesar
    4005 3-hydroxyadam
    C1C2CC3(CC1C 127 379723 http://www. Alfa Aesar
    4006 3-hydroxyadam
    C1C2CC3(CC1C 205 2018184 http://www.aAlfa Aesar
    4007 3-hydroxybenc1cc(cc(c1)O) 104 21105795 http://www.aAlfa Aesar
    4008 3-hydroxybenzB(c1cccc(c1)O 209 2016111 http://www.aAlfa Aesar
    4009 3-hydroxybenc1cc(cc(c1)O) 158 72179 http://www.aAlfa Aesar
    4010 3-hydroxybenzc1cc(cc(c1)O) 202 7142 http://www.aAlfa Aesar
    4011 3-hydroxybenzc1cc(cc(c1)O) 80 12821 http://www.aAlfa Aesar
    4012 3-hydroxybenc1ccc(cc1)C(= 114 74922 http://www.aAlfa Aesar
    4013 3-hydroxybenzc1cc(cc(c1)O) 71 100 http://www.aAlfa Aesar
    4014 3-hydroxybutyCC(CC(=O)O)O 38 428 http://www. Alfa Aesar
    4015 3-hydroxydip c1ccc(cc1)Nc2 80 21106124 http://www.aAlfa Aesar
    4016 3'-hydroxyfla c1ccc2c(c1)C( 140 2773622 http://www.aAlfa Aesar
    4017 3-hydroxyflav c1ccc(cc1)c2c 170 10871 http://www.aAlfa Aesar
    4018 3-hydroxyphen
    c1cc(cc(c1)O) 130 11624 http://www.aAlfa Aesar
    4019 3-hydroxypipeC1CC(CNC1)O 58 21784 http://www.aAlfa Aesar
    4020 3-hydroxypropi
    C(CO)C#N -46 7720 http://www.aAlfa Aesar
    4021 3-hydroxypyric1cc(cnc1)O 127 7683 http://www.aAlfa Aesar
    4022 3-indazolinon c1ccc2c(c1)c( 250 73841 http://www.aAlfa Aesar
    4023 3-iodo-1,2,4, Cc1cc(c(c(c1C) 79 67564 http://www.aAlfa Aesar
    4024 3-iodo-4-methCOc1ccc(cc1I) 240 542232 http://www.aAlfa Aesar
    4025 3-iodo-4-methCc1ccc(cc1I)N 36 106238 http://www.aAlfa Aesar
    4026 3-iodo-4-methCc1ccc(cc1I)C 208 540171 http://www.aAlfa Aesar
    4027 3-iodoaniline c1cc(cc(c1)I)N 23 11768 http://www.aAlfa Aesar
    4028 3-iodobenzal c1cc(cc(c1)I) 56 221355 http://www.aAlfa Aesar
    4029 3-iodobenzoicc1cc(cc(c1)I) 187 11563 http://www.aAlfa Aesar
    4030 3-iodobenzonit
    c1cc(cc(c1)I) 40 127332 http://www.aAlfa Aesar
    4031 3-iodobenzotrc1cc(cc(c1)I)C( -8 61185 http://www.aAlfa Aesar
    4032 3-iodobenzoylc1cc(cc(c1)I)C 24 66971 http://www.aAlfa Aesar
    4033 3-iodobenzyl c1cc(cc(c1)I)C 50 2040110 http://www.aAlfa Aesar
    4034 3-iodophenol c1cc(cc(c1)I)O 41 11769 http://www.aAlfa Aesar
    4035 3-iodophenyl c1cc(cc(c1)I) 46 133165 http://www.aAlfa Aesar
    4036 3-iodophenylac1cc(cc(c1)I) 130 3095012 http://www.aAlfa Aesar
    4037 3-iodophenylac1cc(cc(c1)I) 34 2040117 http://www.aAlfa Aesar
    4038 3-iodopropionC(CI)C(=O)O 82 8524 http://www.aAlfa Aesar
    4039 3-iodopyridin c1cc(cnc1)I 55 63879 http://www.aAlfa Aesar
    4040 3-iodotolueneCc1cccc(c1)I -27 11765 http://www.aAlfa Aesar
    4041 3-isopropylbeB(c1cccc(c1)C 78 2053894 http://www.aAlfa Aesar
    4042 3-maleimidoprC1CC(=O)N(C 169 3811455 http://www. Alfa Aesar
    4043 3-mercapto-1,c1[nH]nc(n1)S 221 2005993 http://www.aAlfa Aesar
    4044 3-mercapto-4-Cn1cnnc1S 168 1054997 http://www.aAlfa Aesar
    4045 3-mercaptoproC(CS)C(=O)O 18 6267 http://www.aAlfa Aesar
    4046 3-methoxy-2(1COc1ccc[nH]c 115 80065 http://www.aAlfa Aesar
    4047 3-methoxy-2,4,
    COc1c(c(cc(c1 115 2015732 http://www.aAlfa Aesar
    4048 3-methoxy-2-nCOc1cccc(c1[N 256 70989 http://www.aAlfa Aesar
    4049 3-methoxy-4-m
    Cc1ccc(cc1OC 58 25942 http://www. Alfa Aesar
    4050 3-methoxy-4- B(c1ccc(c(c1) 193 21242518 http://www. Alfa Aesar
    4051 3-methoxy-4-m
    Cc1ccc(cc1OC 159 73609 http://www.aAlfa Aesar
    4052 3-methoxy-4-nCOc1cc(ccc1[N 233 71103 http://www.aAlfa Aesar
    4053 3-methoxy-5- Cc1cc(cc(c1)O 63 69135 http://www. Alfa Aesar
    4054 3'-methoxyac CC(=O)c1cccc -7 21111758 http://www.aAlfa Aesar
    4055 3-methoxybenCOc1cccc(c1) 133 88942 http://www.aAlfa Aesar
    4056 3-methoxybenB(c1cccc(c1)O 160 2016122 http://www.aAlfa Aesar
    4057 3-methoxybenCOc1cccc(c1) 132 10437594 http://www. Alfa Aesar
    4058 3-methoxybenCOc1cccc(c1) 92 72141 http://www.aAlfa Aesar
    4059 3-methoxybenz
    COc1cccc(c1) 106 10977 http://www.aAlfa Aesar
    4060 3-methoxybenz
    COc1cccc(c1) 23 66355 http://www.aAlfa Aesar
    4061 3-methoxycatCOc1cccc(c1O 42 13033 http://www.aAlfa Aesar
    4062 3-methoxypheCOc1cccc(c1) -18 8657 http://www.aAlfa Aesar
    4063 3-methoxyphen
    COc1cccc(c1) 118 67524 http://www.aAlfa Aesar
    4064 3-methoxyphen
    COc1cccc(c1) 70 14948 http://www.aAlfa Aesar
    4065 3-methoxyprop
    COCCC#N -63 54991 http://www.aAlfa Aesar
    4066 3-methyl-1,2-CC(=C=C)C -114 11222 http://www.aAlfa Aesar
    4067 3-methyl-1-buCC(C)CCO -117 29000 http://www.aAlfa Aesar
    4068 3-methyl-1h-pCc1ccn(n1)C( 125 211943 http://www.aAlfa Aesar
    4069 3-methyl-1-p CCC(C)C=C -154 12429 http://www.aAlfa Aesar
    4070 3-methyl-1-phCc1ccn(n1)c2c 37 63948 http://www.aAlfa Aesar
    4071 3-methyl-1-phCC1=NN(C(=O) 129 3881 http://www.aAlfa Aesar
    4072 3-methyl-2(1hCc1c(=O)[nH] 271 24580 http://www. Alfa Aesar
    4073 3-methyl-2,4, Cc1c(cc(c(c1B 101 127471 http://www.aAlfa Aesar
    4074 3-methyl-2-b CC(C)C(=O)C -92 10777 http://www.aAlfa Aesar
    4075 3-methyl-2-buCC(=CC=O)C -20 54980 http://www.aAlfa Aesar
    4076 3-methyl-2-cyCC1=CC(=O)C 2 16723 http://www.aAlfa Aesar
    4077 3-methyl-2-furCc1ccoc1C(=O 135 70504 http://www.aAlfa Aesar
    4078 3-methyl-2-niCc1cccc(c1[N+ 50 71615 http://www.aAlfa Aesar
    4079 3-methyl-2-niCc1cccc(c1[N+ 222 20277 http://www.aAlfa Aesar
    4080 3-methyl-2-pyCC1=NNC(=O) 222 7632 http://www.aAlfa Aesar
    4081 3-methyl-2-pyCc1ccc[nH]c1 140 63658 http://www.aAlfa Aesar
    4082 3-methyl-4-niCc1c(c[nH]n1) 133 71580 http://www. Alfa Aesar
    4083 3-methyl-4-nitCc1cc(ccc1[N+ 135 11405 http://www.aAlfa Aesar
    4084 3-methyl-4-niCc1cc(ccc1[N+ 49 71650 http://www.aAlfa Aesar
    4085 3-methyl-4-niCc1cc(ccc1[N+ 159 518002 http://www.aAlfa Aesar
    4086 3-methyl-4-niCc1cc(ccc1[N+ 148 2556589 http://www.aAlfa Aesar
    4087 3-methyl-4-niCc1cc(ccc1[N+ 218 17348 http://www.aAlfa Aesar
    4088 3-methyl-4-nitCc1cc(ccc1[N+ 81 2080146 http://www.aAlfa Aesar
    4089 3-methyl-4-niCc1cc(ccc1[N+ 128 16475 http://www.aAlfa Aesar
    4090 3-methyl-4-phCc1c(c[nH]n1) 142 123118 http://www.aAlfa Aesar
    4091 3-methyl-5-niCc1cc(cnc1)[N 96 219278 http://www. Alfa Aesar
    4092 3-methyl-5-phCc1cc([nH]n1) 126 17727 http://www. Alfa Aesar
    4093 3'-methylace Cc1cccc(c1)C( -9 21168813 http://www.aAlfa Aesar
    4094 3-methyladipiCC(CCC(=O)O) 100 11789 http://www.aAlfa Aesar
    4095 3-methylbenzeB(c1cccc(c1)C 161 2015712 http://www.aAlfa Aesar
    4096 3-methylbenzCc1csc2c1ccc -40 66452 http://www.aAlfa Aesar
    4097 3-methylbenzoCc1c2ccccc2s 149 2060089 http://www.aAlfa Aesar
    4098 3-methylbenzCc1c2ccccc2s 89 453506 http://www.aAlfa Aesar
    4099 3-methylbenzoCc1c2ccccc2s 243 717966 http://www.aAlfa Aesar
    4100 3-methylbenzoCc1ccc2c3ccc 76 6539 http://www.aAlfa Aesar
    4101 3-methylbenzoCc1c2ccccc2o 196 522150 http://www.aAlfa Aesar
    4102 3-methylbipheCc1cccc(c1)c2 5 12045 http://www.aAlfa Aesar
    4103 3-methylcatecCc1cccc(c1O) 65 333 http://www.aAlfa Aesar
    4104 3-methylcycloCC1CCCC(=O) 58 2568901 http://www.aAlfa Aesar
    4105 3-methylcycloCC1CCC(=O)C 105 55153 http://www.aAlfa Aesar
    4106 3-methylcycl CC1CCC(=O)C -58 14885 http://www.aAlfa Aesar
    4107 3-methylflavon
    Cc1c(=O)c2ccc 235 69462 http://www.aAlfa Aesar
    4108 3-methylglutarCC(CC(=O)O)C 86 11781 http://www.aAlfa Aesar
    4109 3-methylglutaCC(CC(=O)O)C 46 19971001 http://www.aAlfa Aesar
    4110 3-methylhept CCCCC(C)CC -121 11035 http://www.aAlfa Aesar
    4111 3-methylhippuCc1cccc(c1)C 139 89642 http://www. Alfa Aesar
    4112 3-methylindolCc1c[nH]c2c1 96 6480 http://www.aAlfa Aesar
    4113 3-methylisoxazCc1c(con1)C( 186 3781864 http://www.aAlfa Aesar
    4114 3-methylpent CCC(C)CC -118 7010 http://www.aAlfa Aesar
    4115 3-methylpheno
    Cc1cccc(c1)O 104 66842 http://www.aAlfa Aesar
    4116 3-methylpiperCC1CCCNC1 -24 71413 http://www.aAlfa Aesar
    4117 3-methylpyridCc1cccnc1C(= 120 11430269 http://www. Alfa Aesar
    4118 3-methylquinoCc1cc2ccccc2 15 11432 http://www.aAlfa Aesar
    4119 3-methylquinoCc1cc2ccccc2[ 89 5384376 http://www.aAlfa Aesar
    4120 3-methylsalicyCc1cccc(c1O) 165 6482 http://www.aAlfa Aesar
    4121 3-methylstyreCc1cccc(c1)C= -82 7248 http://www.aAlfa Aesar
    4122 3-methylthio Cc1ccsc1 -69 21111820 http://www.aAlfa Aesar
    4123 3-methylthio Cc1ccsc1C(=O 124 511245 http://www.aAlfa Aesar
    4124 3-methylthiopCc1ccsc1C(=O 147 81494 http://www.aAlfa Aesar
    4125 3-methylvaleriCCC(C)CC(=O) -42 7469 http://www.aAlfa Aesar
    4126 3-n-hexadecylCCCCCCCCCCC 28 2050140 http://www. Alfa Aesar
    4127 3-n-hexylthio-CCCCCCSc1nc[ 67 2096497 http://www.aAlfa Aesar
    4128 3-nitro-4-(1-pc1cc(c(cc1C= 52 2018725 http://www.aAlfa Aesar
    4129 3-nitro-4-(1-pc1cc(c(cc1C= 103 521191 http://www.aAlfa Aesar
    4130 3-nitro-5-(tri c1c(cc(cc1N)[N 79 2056041 http://www. Alfa Aesar
    4131 3-nitro-5-(tri c1c(cc(cc1C(F 130 535883 http://www.aAlfa Aesar
    4132 3-nitro-5-(tri c1c(cc(cc1[N+] 91 2037015 http://www. Alfa Aesar
    4133 3'-nitroacetanCC(=O)Nc1cccc 152 28947 http://www.aAlfa Aesar
    4134 3'-nitroaceto CC(=O)c1cccc( 78 21106145 http://www.aAlfa Aesar
    4135 3-nitro-alpha-c1cc(cc(c1)[N 99 15257861 http://www.aAlfa Aesar
    4136 3-nitroaniline c1cc(cc(c1)[N 113 7145 http://www.aAlfa Aesar
    4137 3-nitrobenzal c1cc(cc(c1)[N 58 7169 http://www.aAlfa Aesar
    4138 3-nitrobenzal c1cc(cc(c1)[N 124 189942 http://www.aAlfa Aesar
    4139 3-nitrobenza c1cc(cc(c1)[N 142 11202219 http://www.aAlfa Aesar
    4140 3-nitrobenzenc1cc(cc(c1)S( 61 8163 http://www.aAlfa Aesar
    4141 3-nitrobenzhyc1cc(cc(c1)[N 154 2540238 http://www.aAlfa Aesar
    4142 3-nitrobenzoicc1cc(cc(c1)[N 142 8183 http://www.aAlfa Aesar
    4143 3-nitrobenzonic1cc(cc(c1)[N 116 11582 http://www.aAlfa Aesar
    4144 3-nitrobenzotrc1cc(cc(c1)[N+ -5 7108 http://www.aAlfa Aesar
    4145 3-nitrobenzoylc1cc(cc(c1)[N 33 8181 http://www.aAlfa Aesar
    4146 3-nitrobenzyl c1cc(cc(c1)[N 31 62479 http://www.aAlfa Aesar
    4147 3-nitrobenzyl c1cc(cc(c1)[N 58 69973 http://www.aAlfa Aesar
    4148 3-nitrobenzyl c1cc(cc(c1)[N+ 45 11581 http://www.aAlfa Aesar
    4149 3-nitrobiphenc1ccc(cc1)c2c 59 15596 http://www.aAlfa Aesar
    4150 3-nitrochalco c1ccc(cc1)C(= 146 4520653 http://www.aAlfa Aesar
    4151 3-nitroimidazoc1ccn2c(c1)nc 205 228056 http://www. Alfa Aesar
    4152 3-nitro-o-xyle Cc1cccc(c1C)[ 14 6483 http://www.aAlfa Aesar
    4153 3-nitrophenolc1cc(cc(c1)O) 96 10664 http://www.aAlfa Aesar
    4154 3-nitrophenyl c1cc(cc(c1)[N 52 69290 http://www.aAlfa Aesar
    4155 3-nitrophenyl c1cc(cc(c1)[N 57 17985 http://www.aAlfa Aesar
    4156 3-nitrophenylac1cc(cc(c1)[N 119 15089 http://www.aAlfa Aesar
    4157 3-nitrophthal c1cc2c(c(c1)[ 219 11286 http://www.aAlfa Aesar
    4158 3-nitrophthaloc1cc(c(c(c1)[ 164 142803 http://www.aAlfa Aesar
    4159 3'-nitropropi CCC(=O)c1cccc 101 78563 http://www.aAlfa Aesar
    4160 3-nitropyridinc1cc(cnc1)[N+ 40 121289 http://www.aAlfa Aesar
    4161 3-nitrostyreneC=Cc1cccc(c1) -5 61789 http://www.aAlfa Aesar
    4162 3-nitrotoluen Cc1cccc(c1)[N 16 21106146 http://www.aAlfa Aesar
    4163 3-nonanone CCCCCCC(=O) -8 55177 http://www.aAlfa Aesar
    4164 3-noradamanta
    C1C2CC3CC1C 106 2015630 http://www.aAlfa Aesar
    4165 3-n-propyl-2- CCCC1=NNC(= 208 236724 http://www.aAlfa Aesar
    4166 3-octanol CCCCCC(CC)O -45 11043 http://www.aAlfa Aesar
    4167 3-octanone CCCCCC(=O)C -23 215929 http://www.aAlfa Aesar
    4168 3-octyne CCCCC#CCC -104 76541 http://www.aAlfa Aesar
    4169 3-oxo-3-(2-thic1cc(sc1)C(= 134 125139 http://www.aAlfa Aesar
    4170 3-oxopentanen
    CCC(=O)CC#N 29 8096004 http://www. Alfa Aesar
    4171 3-pentanol CCC(CC)O -8 10947 http://www.aAlfa Aesar x out of range and 1- and 2-pentanol much
    4172 3-pentanone CCC(=O)CC -39 7016 http://www.aAlfa Aesar
    4173 3-phenoxy-1,2c1ccc(cc1)OC 58 10399 http://www.aAlfa Aesar
    4174 3-phenoxyanilc1ccc(cc1)Oc2 36 21170956 http://www.aAlfa Aesar
    4175 3-phenoxybenc1ccc(cc1)Oc2 13 35088 http://www.aAlfa Aesar
    4176 3-phenoxybenB(c1cccc(c1)O 141 8306089 http://www. Alfa Aesar
    4177 3-phenoxybenz
    c1ccc(cc1)Oc2 148 18409 http://www.aAlfa Aesar
    4178 3-phenoxybenz
    c1ccc(cc1)Oc2 6 24499 http://www.aAlfa Aesar
    4179 3-phenoxyphec1ccc(cc1)Oc2 42 12312 http://www.aAlfa Aesar
    4180 3-phenoxyphen
    c1ccc(cc1)Oc2 89 125050 http://www.aAlfa Aesar
    4181 3-phenoxyprop
    c1ccc(cc1)OC 98 73626 http://www.aAlfa Aesar
    4182 3-phenyl-1-prc1ccc(cc1)CC -18 13871718 http://www.aAlfa Aesar
    4183 3-phenyl-2-oxc1ccc(cc1)N2 121 120315 http://www.aAlfa Aesar
    4184 3-phenyl-4(3hc1ccc(cc1)n2 139 686709 http://www.aAlfa Aesar
    4185 3-phenyl-5-is c1ccc(cc1)c2c 152 494387 http://www.aAlfa Aesar
    4186 3-phenylazo-2CC(=O)C(C(=O 87 21161672 http://www.aAlfa Aesar
    4187 3-phenylbutyriCC(CC(=O)O)c 38 19513 http://www.aAlfa Aesar
    4188 3-phenylglutarc1ccc(cc1)C( 142 70219 http://www.aAlfa Aesar
    4189 3-phenylphthac1ccc(cc1)C2 117 86062 http://www.aAlfa Aesar
    4190 3-phenylprop c1ccc(cc1)CC -42 7421 http://www.aAlfa Aesar
    4191 3-phenylpropic1ccc(cc1)CC 49 10181339 http://www.aAlfa Aesar
    4192 3-phenylpropio
    c1ccc(cc1)CC -2 12061 http://www.aAlfa Aesar
    4193 3-phenylpropic1ccc(cc1)CCC -7 58333 http://www.aAlfa Aesar
    4194 3-phosphonopr
    C(CP(=O)(O)O 164 1619 http://www.aAlfa Aesar
    4195 3-phthalimidoc1ccc2c(c1)C 152 69310 http://www.aAlfa Aesar
    4196 3-picoline Cc1cccnc1 -18 21106520 http://www.aAlfa Aesar
    4197 3-picoline n-oCc1ccc[n+](c1 38 13258 http://www.aAlfa Aesar
    4198 3-piperidinemC1CC(CNC1)C 60 96573 http://www.aAlfa Aesar
    4199 3-pyridineacec1cc(cnc1)CC 123 490949 http://www.aAlfa Aesar
    4200 3-pyridinemetc1cc(cnc1)CO -7 7229 http://www.aAlfa Aesar
    4201 3-pyridyloxyacc1cc(cnc1)OC 211 2411397 http://www.aAlfa Aesar
    4202 3-quinuclidinoC1CN2CCC1C( 221 14640 http://www.aAlfa Aesar
    4203 3-sulfolene C1C=CCS1(=O 65 6253 http://www.aAlfa Aesar
    4204 3-tert-butyl-1 CC(C)(C)C1=N 149 2017372 http://www.aAlfa Aesar
    4205 3-tert-butyl-1 CC(C)(C)C1=N 111 214965 http://www.aAlfa Aesar
    4206 3-tert-butyl-2 CC(C)(C)C1=N 210 453953 http://www.aAlfa Aesar
    4207 3-tert-butylp CC(C)(C)c1ccc 45 10966 http://www.aAlfa Aesar
    4208 3-tert-butyltoCc1cccc(c1)C( -41 31082 http://www. Alfa Aesar
    4209 3-thiopheneacc1cscc1CC(=O 79 21886 http://www.aAlfa Aesar
    4210 3-undecanoneCCCCCCCCC(= 9 67735 http://www.aAlfa Aesar
    4211 3-vinylbenzenB(c1cccc(c1)C 128 3569774 http://www.aAlfa Aesar
    4212 3-vinylbenzoicC=Cc1cccc(c1 95 3637837 http://www. Alfa Aesar
    4213 4-(1,2,4-triaz c1cc(ccc1n2c 255 98851 http://www.aAlfa Aesar
    4214 4'-(1,2,4-triaz CC(=O)Nc1ccc 285 3301108 http://www.aAlfa Aesar
    4215 4-(1,3-dithiol c1cc(ccc1C2S 118 88056 http://www.aAlfa Aesar
    4216 4-(1-bromoethCC(c1ccc(cc1) 156 4319786 http://www.aAlfa Aesar
    4217 4-(1h-pyrazol-c1cc(ccc1C#N 141 2017561 http://www. Alfa Aesar
    4218 4'-(1-imidazo CC(=O)c1ccc(c 116 74287 http://www.aAlfa Aesar
    4219 4-(1-imidazol c1cc(ccc1n2c 206 74286 http://www.aAlfa Aesar
    4220 4'-(1-piperaz CC(=O)c1ccc( 96 87795 http://www.aAlfa Aesar
    4221 4-(1-piperazinc1cc(ccc1N2C 221 83482 http://www.aAlfa Aesar
    4222 4-(1-piperidinyc1cc(ccc1N)N 27 366101 http://www.aAlfa Aesar
    4223 4'-(1-pyrroli CC(=O)c1ccc( 129 643356 http://www.aAlfa Aesar
    4224 4-(1-pyrrolid c1cc(ccc1C=O 84 93925 http://www.aAlfa Aesar
    4225 4-(1-pyrrolidi c1cnccc1N2C 56 68092 http://www.aAlfa Aesar
    4226 4-(2,2,2-trim CC(C)(C)C(=O) 136 377809 http://www. Alfa Aesar
    4227 4-(2,4-dichlo c1cc(c(cc1Cl) 169 1414955 http://www.aAlfa Aesar
    4228 4-(2,4-dimethCc1ccc(c(c1)C 151 644196 http://www.aAlfa Aesar
    4229 4-(2-aminoethc1cc(ccc1CCN 151 148392 http://www.aAlfa Aesar
    4230 4-(2-aminoethC1COCCN1CC 24 361265 http://www.aAlfa Aesar
    4231 4-(2-carboxyeB(c1ccc(cc1)C 147 3088392 http://www.aAlfa Aesar
    4232 4-(2-carboxyvB(c1ccc(cc1)/ 193 4450249 http://www.aAlfa Aesar
    4233 4-(2-chloroethc1cc(ccc1CCCl 188 80047 http://www.aAlfa Aesar
    4234 4-(2-chlorophc1ccc(c(c1)Oc 82 38283 http://www. Alfa Aesar
    4235 4-(2-chlorophc1ccc(c(c1)NC 138 626337 http://www.aAlfa Aesar
    4236 4-(2-hydroxyeC1COCCN1CC 2 55110 http://www.aAlfa Aesar
    4237 4-(2-hydroxyec1cnccc1CCO 9 65753 http://www.aAlfa Aesar
    4238 4-(2-methoxyeCOCCc1ccc(cc 44 83524 http://www.aAlfa Aesar
    4239 4-(2-methylphCc1ccccc1NC( 147 644198 http://www.aAlfa Aesar
    4240 4-(2-pyridyl)- CC(C)(C#Cc1c 83 608910 http://www.aAlfa Aesar
    4241 4-(2-pyridylazCN(C)c1ccc(c 109 20475144 http://www.aAlfa Aesar
    4242 4-(2-thiazolyl c1cc(ccc1c2nc 164 10349660 http://www. Alfa Aesar
    4243 4-(2-thienyl)- CC(=O)C=Cc1c 24 643094 http://www.aAlfa Aesar
    4244 4-(2-thienyl)a c1cc(sc1)c2cc 76 915013 http://www. Alfa Aesar
    4245 4-(3,4-dimethCOc1ccc(cc1O 62 286661 http://www. Alfa Aesar
    4246 4-(3-chlorophc1cc(cc(c1)Cl 132 616480 http://www.aAlfa Aesar
    4247 4-(3-pyridyl) c1cc(cnc1)c2c 55 2925122 http://www. Alfa Aesar
    4248 4-(4-acetamidCC(=O)Nc1ccc( 250 453479 http://www. Alfa Aesar
    4249 4-(4-benzylox c1ccc(cc1)CO 115 21242303 http://www. Alfa Aesar
    4250 4'-(4-bromop CC(=O)c1ccc(c 126 72099 http://www.aAlfa Aesar
    4251 4-(4-chlorobe c1cc(ccc1C(=O 108 88958 http://www.aAlfa Aesar
    4252 4-(4-chlorophc1cc(ccc1C2( 139 35086 http://www.aAlfa Aesar
    4253 4-(4-ethylphe CCc1ccc(cc1) 130 2509590 http://www.aAlfa Aesar
    4254 4-(4-fluorobenc1cc(ccc1C(= 143 600476 http://www. Alfa Aesar
    4255 4-(4-fluorobenc1cc(ccc1C(=O 86 5385890 http://www.aAlfa Aesar
    4256 4-(4-fluorophec1cc(ccc1CCC 45 61799 http://www. Alfa Aesar
    4257 4-(4-hydroxy- CC(=O)CCc1cc 41 28952 http://www.aAlfa Aesar
    4258 4-(4-hydroxypCC(=O)CCc1cc 82 20347 http://www.aAlfa Aesar
    4259 4'-(4-methoxyp
    COc1ccc(cc1)c 162 547869 http://www.aAlfa Aesar
    4260 4-(4-methoxy CC(=O)CCc1cc 8 54968 http://www.aAlfa Aesar
    4261 4-(4-methyl-1-CN1CCN(CC1)c 92 644315 http://www. Alfa Aesar
    4262 4'-(4-methylphCc1ccc(cc1)c2 169 128890 http://www.aAlfa Aesar
    4263 4-(4-methylphCc1ccc(cc1)N 136 644197 http://www.aAlfa Aesar
    4264 4-(4-morpholin
    c1cc(ccc1N)N 131 68175 http://www.aAlfa Aesar
    4265 4-(4-morpholic1cc(ccc1CN2 181 613267 http://www. Alfa Aesar
    4266 4-(4-nitrobenzc1cc(ccc1Cc2c 71 13506 http://www.aAlfa Aesar
    4267 4'-(4-nitrobe CC(=O)c1ccc(c 130 2080052 http://www.aAlfa Aesar
    4268 4-(4-nitroben c1cc(ccc1COc2 130 642990 http://www.aAlfa Aesar
    4269 4-(4-nitrophenc1cc(ccc1c2cs 209 487473 http://www.aAlfa Aesar
    4270 4-(4-nitrophe c1cc(ccc1N2C 150 23557 http://www.aAlfa Aesar
    4271 4-(4-piperidi c1cc(ccc1C(= 228 21242750 http://www. Alfa Aesar
    4272 4-(5-iodo-2-p c1cc(ncc1I)N 133 2074241 http://www. Alfa Aesar
    4273 4-(6-chloro-4 c1c(ncnc1Cl) 150 696261 http://www. Alfa Aesar
    4274 4-(aminomethy
    C1CNCCC1CN 24 21997 http://www.aAlfa Aesar
    4275 4-(aminomethy
    c1cnccc1CN -8 69736 http://www.aAlfa Aesar
    4276 4-(benzylaminc1ccc(cc1)CNc 84 7355 http://www.aAlfa Aesar
    4277 4-(benzyloxycB(c1ccc(cc1)C 190 2053673 http://www. Alfa Aesar
    4278 4-(benzyloxycc1ccc(cc1)CO 163 4347391 http://www. Alfa Aesar
    4279 4-(benzyloxycc1ccc(cc1)CO 82 13890972 http://www. Alfa Aesar
    4280 4-(boc-amino)CC(C)(C)OC(= 81 9078535 http://www. Alfa Aesar
    4281 4-(boc-amino)CC(C)(C)OC(= 164 631962 http://www. Alfa Aesar
    4282 4-(boc-amino)CC(C)(C)OC(= 149 8165792 http://www. Alfa Aesar
    4283 4-(bromoacetyc1cc(ccc1C#N 94 89097 http://www.aAlfa Aesar
    4284 4-(bromomethB(c1ccc(cc1)C 148 2017280 http://www.aAlfa Aesar
    4285 4-(bromomethy
    c1cc(ccc1CBr) 74 2016161 http://www.aAlfa Aesar
    4286 4-(bromomethy
    c1cc(ccc1CBr) 225 21185 http://www.aAlfa Aesar
    4287 4-(bromomethy
    c1cc(ccc1CBr 115 78472 http://www.aAlfa Aesar
    4288 4-(bromomethy
    c1cc(ccc1CC( 179 3714315 http://www. Alfa Aesar
    4289 4-(chloroacet C1COCCN1C(= 29 66659 http://www.aAlfa Aesar
    4290 4-(chloromethc1cc(ccc1CCl) 201 66841 http://www.aAlfa Aesar
    4291 4-(chloromethc1cc(ccc1CCl) 79 63315 http://www.aAlfa Aesar
    4292 4-(chloromethc1cc(ccc1CCl 33 2015121 http://www.aAlfa Aesar
    4293 4-(chlorosulfoc1cc(ccc1C(=O 230 74348 http://www.aAlfa Aesar
    4294 4-(cyanoacetyC1COCCN1C(= 87 199598 http://www.aAlfa Aesar
    4295 4-(cyanomethyB(c1ccc(cc1)C 198 2053761 http://www.aAlfa Aesar
    4296 4-(dibenzylamB(c1ccc(cc1)N 186 13923126 http://www. Alfa Aesar
    4297 4-(difluoromec1cc(ccc1C(=O 170 644419 http://www.aAlfa Aesar
    4298 4-(dimethylamCc1c(c(=O)n(n 107 5787 http://www.aAlfa Aesar
    4299 4-(dimethylamCN(C)c1ccncc 112 13646 http://www. Alfa Aesar
    4300 4-(di-n-propylCCCN(CCC)S(=O 60 2017215 http://www. Alfa Aesar
    4301 4-(ethoxycarbB(c1ccc(cc1)C 139 2016102 http://www. Alfa Aesar
    4302 4-(ethoxycarbCCOC(=O)c1cc 30 512709 http://www.aAlfa Aesar
    4303 4-(ethoxycarbCCOC(=O)c1cc 54 64164 http://www.aAlfa Aesar
    4304 4-(ethylsulfo B(c1ccc(cc1)S 137 2053837 http://www.aAlfa Aesar
    4305 4-(ethylthio) B(c1ccc(cc1)S 105 2016105 http://www.aAlfa Aesar
    4306 4-(hydroxymetB(c1ccc(cc1)C 280 2016450 http://www.aAlfa Aesar
    4307 4-(hydroxymetc1cc(ccc1CO) 181 68837 http://www.aAlfa Aesar
    4308 4-(hydroxymetc1cc(ccc1CO) 112 168582 http://www.aAlfa Aesar
    4309 4-(hydroxymetc1cc(ccc1CC( 133 2532496 http://www. Alfa Aesar
    4310 4-(methoxycarB(c1ccc(cc1)C 223 2016121 http://www. Alfa Aesar
    4311 4-(methoxycarCOC(=O)c1ccc 48 121646 http://www.aAlfa Aesar
    4312 4-(methylaminCNc1ccc(cc1) 159 59723 http://www.aAlfa Aesar
    4313 4-(methylaminCNc1ccncc1 126 109718 http://www.aAlfa Aesar
    4314 4-(methylsulf B(c1ccc(cc1)S 170 2053947 http://www.aAlfa Aesar
    4315 4-(methylsulf B(c1ccc(cc1)S 200 2016116 http://www.aAlfa Aesar
    4316 4-(methylsulf CS(=O)(=O)c1c 161 2016888 http://www. Alfa Aesar
    4317 4-(methylsulfoCS(=O)(=O)c1c 273 70071 http://www. Alfa Aesar
    4318 4-(methylsulf CS(=O)(=O)c1c 93 109952 http://www. Alfa Aesar
    4319 4-(methylsulfoCS(=O)(=O)c1c 136 497626 http://www.aAlfa Aesar
    4320 4-(methylsulf CS(=O)(=O)Nc 194 2015955 http://www.aAlfa Aesar
    4321 4'-(methylthi CC(=O)c1ccc(c 81 67082 http://www.aAlfa Aesar
    4322 4-(methylthioCSc1ccc(cc1) 6 69432 http://www.aAlfa Aesar
    4323 4-(methylthioB(c1ccc(cc1)S 210 2015721 http://www.aAlfa Aesar
    4324 4-(methylthioCSc1ccc(cc1)C 195 75095 http://www.aAlfa Aesar
    4325 4-(methylthio)CSc1ccc(cc1) 62 513730 http://www.aAlfa Aesar
    4326 4-(methylthio)CSc1ccc(cc1) 42 515467 http://www.aAlfa Aesar
    4327 4-(methylthioCc1cc(ccc1SC 56 17367 http://www.aAlfa Aesar
    4328 4-(methylthioCSc1ccc(cc1)O 86 13466 http://www. Alfa Aesar
    4329 4-(methylthioCSc1ccc(cc1) 50 452862 http://www.aAlfa Aesar
    4330 4-(methylthio)CSc1ccc(cc1) 100 4164252 http://www. Alfa Aesar
    4331 4-(methylthioCSc1ccc(cc1)S 13 120643 http://www.aAlfa Aesar
    4332 4-(n-nitrosomc1cc(cnc1)C( 64 11655258 http://www.aAlfa Aesar
    4333 4-(n-nonyloxyCCCCCCCCCOc1 143 123456 http://www.aAlfa Aesar
    4334 4-(n-octyloxy CCCCCCCCOc1c 80 69824 http://www.aAlfa Aesar
    4335 4'-(phenyleth CC(=O)c1ccc(c 101 2059548 http://www.aAlfa Aesar
    4336 4-(phenylsulfoc1ccc(cc1)S(= 102 543430 http://www.aAlfa Aesar
    4337 4-(p-tolyl)butyCc1ccc(cc1)C 57 70651 http://www.aAlfa Aesar
    4338 4-(tert-butox CC(C)(C)Oc1cc 152 2054033 http://www. Alfa Aesar
    4339 4-(trifluoroac c1cc(ccc1C(=O 178 126668 http://www.aAlfa Aesar
    4340 4-(trifluorom c1cc(ccc1C(=O 156 61328 http://www.aAlfa Aesar
    4341 4-(trifluorom B(c1ccc(cc1)O 123 2016138 http://www.aAlfa Aesar
    4342 4-(trifluorom c1cc(ccc1OC(F 147 2057498 http://www.aAlfa Aesar
    4343 4-(trifluorom c1cc(ccc1C(=O 153 60933 http://www.aAlfa Aesar
    4344 4-(trifluorom c1cc(ccc1CBr) 23 125972 http://www.aAlfa Aesar
    4345 4-(trifluorom c1cc(ccc1O)OC 18 63207 http://www.aAlfa Aesar
    4346 4-(trifluorom c1cc(ccc1N=C= -29 83329 http://www.aAlfa Aesar
    4347 4-(trifluoromec1cc(ccc1CC(= 87 2057603 http://www.aAlfa Aesar
    4348 4-(trifluoromec1cc(ccc1CC#N 29 125868 http://www.aAlfa Aesar
    4349 4'-(trifluorom CC(=O)Nc1ccc( 152 61004 http://www.aAlfa Aesar
    4350 4'-(trifluoro CC(=O)c1ccc(c 32 62931 http://www.aAlfa Aesar
    4351 4-(trifluoromec1cc(ccc1C(F)( 7 9570 http://www.aAlfa Aesar
    4352 4-(trifluorom c1cc(ccc1C=O) 2 61311 http://www.aAlfa Aesar
    4353 4-(trifluorom c1cc(ccc1C(=O 184 67257 http://www.aAlfa Aesar
    4354 4-(trifluorom B(c1ccc(cc1)C( 240 2016141 http://www.aAlfa Aesar
    4355 4-(trifluorom c1cc(ccc1C(F) 180 63210 http://www.aAlfa Aesar
    4356 4-(trifluoromec1cc(ccc1C(F)( 31 2057681 http://www.aAlfa Aesar
    4357 4-(trifluorom c1cc(ccc1C(=O 119 454157 http://www.aAlfa Aesar
    4358 4-(trifluorom c1ccc(cc1)C(c2 60 227215 http://www.aAlfa Aesar
    4359 4-(trifluoromec1cc(ccc1C(=O 221 9572 http://www.aAlfa Aesar
    4360 4-(trifluoromec1cc(ccc1C#N) 38 61310 http://www.aAlfa Aesar
    4361 4-(trifluorom c1ccc(cc1)C(=O 118 62966 http://www.aAlfa Aesar
    4362 4-(trifluoromec1cc(ccc1C(=O) -3 60927 http://www.aAlfa Aesar
    4363 4-(trifluoromec1cc(ccc1CO)C 19 61003 http://www.aAlfa Aesar
    4364 4-(trifluorom c1cc(ccc1CBr)C 31 109684 http://www.aAlfa Aesar
    4365 4'-(trifluorom c1ccc(c(c1)c2c 169 49895 http://www.aAlfa Aesar
    4366 4-(trifluoromec1cc(ccc1C(C( 130 144290 http://www.aAlfa Aesar
    4367 4-(trifluoromec1cncc(c1C(F) 148 2057827 http://www.aAlfa Aesar
    4368 4-(trifluoromec1cc(ccc1C(F) 41 120836 http://www.aAlfa Aesar
    4369 4-(trifluoromec1cc(ccc1CC(= 80 105768 http://www.aAlfa Aesar
    4370 4-(trifluoromec1cc(ccc1CC#N 45 67895 http://www.aAlfa Aesar
    4371 4-(trifluorom c1cc(ccc1C(F) 62 119976 http://www.aAlfa Aesar
    4372 4'-(trifluoro CCC(=O)c1ccc( 36 120322 http://www.aAlfa Aesar
    4373 4-(trifluoromec1cc(ccc1C#N) 90 2058098 http://www.aAlfa Aesar
    4374 4'-(trifluoro CC(=O)c1ccc(c 30 2058112 http://www. Alfa Aesar
    4375 4-(trifluorom c1cc(ccc1C=O) 30 2058118 http://www.aAlfa Aesar
    4376 4-(trifluoromec1cc(ccc1C(=O 161 2058128 http://www.aAlfa Aesar
    4377 4-(trifluoromec1cc(ccc1CO)S 52 2058140 http://www.aAlfa Aesar
    4378 4-(trifluorom c1cc(ccc1CBr)S 55 2058152 http://www.aAlfa Aesar
    4379 4-(trifluoromec1cc(ccc1O)SC 59 3041851 http://www.aAlfa Aesar
    4380 4-(trimethylsi C[Si](C)(C)C# 156 13306547 http://www. Alfa Aesar
    4381 4,16-dibromo[c1cc2c(cc1CCc 251 4371983 http://www.aAlfa Aesar
    4382 4',4''(5'')-di CC(C)(C)c1cc 110 2791554 http://www.aAlfa Aesar
    4383 4,4'-(hexaflu c1cc(ccc1C(c2c 160 66498 http://www.aAlfa Aesar
    4384 4,4'-(hexafluoc1cc2c(cc1C(c 246 63843 http://www.aAlfa Aesar
    4385 4,4',4''-trichl c1cc(ccc1C(c2c 96 68855 http://www.aAlfa Aesar
    4386 4,4,4-trifluor c1cc(oc1)C(=O 21 60915 http://www.aAlfa Aesar
    4387 4,4,4-trifluor C(C(=O)O)C(C(F 87 14510 http://www.aAlfa Aesar
    4388 4,4,4-trifluor CC(CC(=O)O)(C 40 119944 http://www.aAlfa Aesar
    4389 4,4,4-trifluoroC(CC(F)(F)F)C 31 2057378 http://www.aAlfa Aesar
    4390 4,4',4''-trimet COc1ccc(cc1)C 79 68856 http://www.aAlfa Aesar
    4391 4,4',4''-trimet Cc1ccc(cc1)C( 95 69191 http://www.aAlfa Aesar
    4392 4,4'-bipyridin c1cnccc1c2cc 113 21105699 http://www.aAlfa Aesar
    4393 4,4'-bis(2,5-d Cc1cc(c(cc1)C 198 4946143 http://www.aAlfa Aesar
    4394 4,4-bis(4-hydrCC(CCC(=O)O)( 173 60518 http://www.aAlfa Aesar
    4395 4,4'-bis(diet CCN(CC)c1ccc( 94 60030 http://www.aAlfa Aesar
    4396 4,4'-diacetox CC(=O)Oc1ccc( 164 525308 http://www.aAlfa Aesar
    4397 4,4'-diacetylb CC(=O)c1ccc(c 192 266507 http://www.aAlfa Aesar
    4398 4,4'-diaminobc1cc(ccc1C(=O 201 63112 http://www.aAlfa Aesar
    4399 4,4'-diaminodc1cc(ccc1N)S( 177 2849 http://www.aAlfa Aesar
    4400 4,4'-diamino c1cc(ccc1Cc2c 90 7296 http://www.aAlfa Aesar
    4401 4,4''-diamino-c1cc(ccc1c2cc 247 94708 http://www.aAlfa Aesar
    4402 4,4-dibromo-3CC1=NNC(=O)C 131 312096 http://www.aAlfa Aesar
    4403 4,4'-dibromobc1cc(ccc1C(=O 225 87051 http://www.aAlfa Aesar
    4404 4,4'-dibromo c1cc(ccc1C(=O 174 65700 http://www.aAlfa Aesar
    4405 4,4'-dibromobc1cc(ccc1c2cc 167 6843 http://www.aAlfa Aesar
    4406 4,4'-dichloro c1cc(ccc1C(c2c 92 6766 http://www.aAlfa Aesar
    4407 4,4'-dichloro c1cc(ccc1C(=O 145 6767 http://www.aAlfa Aesar
    4408 4,4'-dichloro c1cc(ccc1C(=O 30 2005972 http://www.aAlfa Aesar
    4409 4,4'-dichloroc c1cc(ccc1/C=C 158 4526150 http://www.aAlfa Aesar
    4410 4,4'-difluorob c1cc(ccc1C(c2 47 109671 http://www.aAlfa Aesar
    4411 4,4'-difluorob c1cc(ccc1C(=O 121 109694 http://www.aAlfa Aesar
    4412 4,4'-difluoro c1cc(ccc1C(=O 108 9206 http://www.aAlfa Aesar
    4413 4,4'-difluorob c1cc(ccc1c2cc 88 21169511 http://www.aAlfa Aesar
    4414 4,4-difluorocyC1CC(CCC1C(= 106 2059372 http://www. Alfa Aesar
    4415 4,4-difluoroc C1CC(CCC1=O) 39 11235605 http://www. Alfa Aesar
    4416 4,4'-dihydro c1cc(ccc1C(=O 223 62365 http://www.aAlfa Aesar
    4417 4,4'-dihydrox c1cc(ccc1c2cc 282 6845 http://www.aAlfa Aesar
    4418 4,4'-dihydrox c1cc(ccc1Cc2c 161 11614 http://www.aAlfa Aesar
    4419 4,4'-diiodobipc1cc(ccc1c2ccc 207 68825 http://www.aAlfa Aesar
    4420 4,4'-diisopropCC(C)c1ccc(cc 66 453244 http://www.aAlfa Aesar
    4421 4,4'-dimethoxCOc1ccc(cc1)C 70 62967 http://www.aAlfa Aesar
    4422 4,4'-dimetho COc1ccc(cc1)C 144 6765 http://www.aAlfa Aesar
    4423 4,4'-dimethoxCOc1ccc(cc1)/ 101 4526784 http://www.aAlfa Aesar
    4424 4,4'-dimethoxCOc1ccc(cc1) 102 7290 http://www.aAlfa Aesar
    4425 4,4'-dimethoxyCOc1ccc(cc1)C 124 87430 http://www.aAlfa Aesar
    4426 4,4-dimethyl- CC1(CN(NC1=O 170 68367 http://www.aAlfa Aesar
    4427 4,4'-dimethyl-Cc1ccnc(c1)c2 174 13699 http://www.aAlfa Aesar
    4428 4,4-dimethyl- CC1(COC(=N1) 22 255125 http://www.aAlfa Aesar
    4429 4,4-dimethyl- CN(C)C(=S)NN 145 2015476 http://www.aAlfa Aesar
    4430 4,4'-dimethyl Cc1ccc(cc1)C( 71 245962 http://www.aAlfa Aesar
    4431 4,4'-dimethylbCc1ccc(cc1)C( 103 69442 http://www.aAlfa Aesar
    4432 4,4'-dimethy Cc1ccc(cc1)C( 94 62363 http://www.aAlfa Aesar
    4433 4,4'-dimethyl Cc1ccc(cc1)c2 120 11447 http://www.aAlfa Aesar
    4434 4,4-dimethylcCC1(CCC(=O)C 42 121805 http://www. Alfa Aesar
    4435 4,4''-dinitro- c1cc(ccc1c2cc 278 91648 http://www.aAlfa Aesar
    4436 4,4'-di-n-nonyCCCCCCCCCc1c 62 3491647 http://www. Alfa Aesar
    4437 4,4'-dipheno c1ccc(cc1)Oc2 149 76447 http://www.aAlfa Aesar
    4438 4,4'-dipheny c1ccc(cc1)c2c 238 198831 http://www.aAlfa Aesar
    4439 4,4'-dipyridyl c1cnccc1SSc2 76 68355 http://www.aAlfa Aesar
    4440 4,4'-di-tert-b CC(C)(C)c1ccc( 128 66804 http://www.aAlfa Aesar
    4441 4,4'-di-tert- CC(C)(C)c1ccc 72 1318898 http://www.aAlfa Aesar
    4442 4,4'-methylene
    CC(C)(C)c1cc(c 156 8069 http://www.aAlfa Aesar
    4443 4,4'-methylene
    CN(C)c1ccc(cc 87 21106506 http://www.aAlfa Aesar
    4444 4,4'-oxybis(bec1cc(ccc1C(= 331 67729 http://www.aAlfa Aesar
    4445 4,4'-thiodiphec1cc(ccc1O)Sc 153 16612 http://www.aAlfa Aesar
    4446 4,5,6,7-tetra c1c2c([nH]n1 82 67855 http://www.aAlfa Aesar
    4447 4',5,7-trihydr c1cc(ccc1C2C 250 907 http://www.aAlfa Aesar
    4448 4',5,7-trihydr c1cc(ccc1c2co 300 4444448 http://www.aAlfa Aesar
    4449 4,5-bis(diphe CC1(c2cccc(c2 226 551930 http://www. Alfa Aesar
    4450 4,5-bis(di-te CC1(c2cccc(c2 155 13508225 http://www. Alfa Aesar
    4451 4,5-dibromo-2-
    c1c(c(oc1C(=O 171 3405307 http://www.aAlfa Aesar
    4452 4',5'-dibromofc1ccc2c(c1)C( 272 11198 http://www.aAlfa Aesar
    4453 4,5-dibromo-oCc1cc(c(cc1C) 86 31635 http://www.aAlfa Aesar
    4454 4,5-dibromot c1c(sc(c1Br)B 80 711233 http://www.aAlfa Aesar
    4455 4,5-dibromothc1c(c(sc1C(=O 230 72802 http://www.aAlfa Aesar
    4456 4,5-dibromothc1c(c(sc1S(=O) 77 455999 http://www.aAlfa Aesar
    4457 4,5-dibromoveCOc1cc(c(cc1O 91 2038792 http://www.aAlfa Aesar
    4458 4,5-dichloro- Cc1nc(c(n1C)C 54 5380990 http://www.aAlfa Aesar
    4459 4,5-dichloro- Cn1cnc(c1Cl)C 54 514242 http://www.aAlfa Aesar
    4460 4,5-dichloro-2c1c(c(cc(c1Cl) 181 73215 http://www.aAlfa Aesar
    4461 4,5-dichloroi c1[nH]c(c(n1)C 181 123480 http://www.aAlfa Aesar
    4462 4,5-dichloropyc1c(c(c(=O)[nH 202 66001 http://www.aAlfa Aesar
    4463 4,5-dicyanoimc1[nH]c(c(n1 175 63894 http://www.aAlfa Aesar
    4464 4,5-difluoro-2c1c(c(cc(c1F) 162 16179979 http://www. Alfa Aesar
    4465 4,5-difluoro- COc1cc(c(cc1C 99 11248870 http://www. Alfa Aesar
    4466 4,5-difluoro- COc1cc(c(cc1C 42 16499480 http://www. Alfa Aesar
    4467 4,5-difluoro-2Cc1cc(c(cc1N) 57 18980630 http://www. Alfa Aesar
    4468 4,5-difluoro-2Cc1cc(c(cc1C( 120 15875671 http://www. Alfa Aesar
    4469 4,5-difluoro-2c1c(c(cc(c1F) 165 3429033 http://www. Alfa Aesar
    4470 4,5-difluorosac1c(c(cc(c1F) 70 13820050 http://www. Alfa Aesar
    4471 4',5-dihydrox COc1cc(c2c(=O 289 4444936 http://www.aAlfa Aesar
    4472 4,5-dimethoxyCOc1cc(c(cc1O 194 71040 http://www.aAlfa Aesar
    4473 4,5-dimethoxyCOc1cc(c(cc1O 146 59486 http://www.aAlfa Aesar
    4474 4,5-dimethoxyCOc1cc(c(cc1O 207 238321 http://www.aAlfa Aesar
    4475 4,5-dimethoxyCOc1cc(c(cc1 111 193626 http://www. Alfa Aesar
    4476 4,5-dimethox COc1cc(cc(c1 64 2058373 http://www.aAlfa Aesar
    4477 4,5-dimethyl-2Cc1cc(c(cc1C) 141 73488 http://www.aAlfa Aesar
    4478 4,5-dimethylt Cc1cc(sc1C)C 209 2050136 http://www. Alfa Aesar
    4479 4,5-diphenyl-1c1ccc(cc1)c2c 93 190909 http://www.aAlfa Aesar
    4480 4,5-diphenyl- c1ccc(cc1)c2c 253 746071 http://www.aAlfa Aesar
    4481 4,5-diphenyli c1ccc(cc1)c2c 232 62792 http://www.aAlfa Aesar
    4482 4,6-bis(diphe c1ccc(cc1)P(c 259 2505435 http://www. Alfa Aesar
    4483 4,6-diamino-2CSc1nc(cc(n1 189 63670 http://www.aAlfa Aesar
    4484 4,6'-dibromo-2c1cc(ncc1c2cc 129 21242445 http://www. Alfa Aesar
    4485 4,6-dibromo-2c1c(c(c(c(c1Br 97 2057247 http://www.aAlfa Aesar
    4486 4,6-dibromopyc1c(ncnc1Br)B 51 14260163 http://www. Alfa Aesar
    4487 4,6-dichloro- CSc1nc(cc(n1)C 40 72730 http://www.aAlfa Aesar
    4488 4,6-dichloro- Cc1c(ncnc1Cl) 58 715411 http://www. Alfa Aesar
    4489 4,6-dichlorop c1c(ncnc1Cl)C 66 64105 http://www.aAlfa Aesar
    4490 4,6-dichlororec1c(c(cc(c1O)C 115 60631 http://www.aAlfa Aesar
    4491 4,6-dichlorosac1c(cc(c(c1O) 52 460501 http://www. Alfa Aesar
    4492 4,6-diisopropyCC(C)c1cc2c(c 147 539755 http://www.aAlfa Aesar
    4493 4,6-dimethoxyCOc1cc(nc(n1 131 732447 http://www. Alfa Aesar
    4494 4,6-diphenyl- c1ccc(cc1)c2c 137 261880 http://www.aAlfa Aesar
    4495 4,6-diphenylthc1ccc(cc1)C2= 227 643128 http://www.aAlfa Aesar
    4496 4,7-dichlorois c1cc(c2c(c1Cl 248 2016537 http://www.aAlfa Aesar
    4497 4,7-dichloroquc1cc2c(ccnc2c 85 6604 http://www.aAlfa Aesar
    4498 4',7-dimethoxCOc1ccc(cc1) 162 120191 http://www.aAlfa Aesar
    4499 4,7-dimethyl- Cc1ccnc2c1cc 194 65628 http://www.aAlfa Aesar
    4500 4,8-dichloro-2c1cc2c(cc(nc2c 62 2018530 http://www.aAlfa Aesar
    4501 4-[2-(4-morphC1COCCN1CCN 166 643341 http://www.aAlfa Aesar
    4502 4-[2-(4-nitro c1cc(ccc1[N+ 80 700613 http://www. Alfa Aesar
    4503 4-[3-(4-morphC1COCCN1CCC 136 1414321 http://www.aAlfa Aesar
    4504 4-[3-(trifluor c1cc(cc(c1)NC 121 644541 http://www.aAlfa Aesar
    4505 4-[3-(trifluor c1cc(cc(c1)C( 93 67798 http://www. Alfa Aesar
    4506 4-[4-(trifluo c1cc(ccc1OC2 72 10800646 http://www. Alfa Aesar
    4507 4-[4-(trifluor c1cc(ccc1C(F) 167 2057997 http://www.aAlfa Aesar
    4508 4'-acetamido Cc1cc(ccc1C( 139 2019023 http://www. Alfa Aesar
    4509 4-acetamido-2Cc1cc(ccc1C# 163 2019022 http://www. Alfa Aesar
    4510 4'-acetamido CC(=O)c1ccc(c 140 2914972 http://www.aAlfa Aesar
    4511 4-acetamido-3CC(=O)Nc1ccc( 226 66399 http://www.aAlfa Aesar
    4512 4-acetamido-9CC(=O)Nc1ccc 263 205245 http://www.aAlfa Aesar
    4513 4'-acetamido CC(=O)c1ccc( 169 68441 http://www.aAlfa Aesar
    4514 4-acetamidoanCc1c(c(=O)n(n 202 59166 http://www.aAlfa Aesar
    4515 4-acetamidobCC(=O)Nc1ccc 156 66572 http://www.aAlfa Aesar
    4516 4-acetamidobeCC(=O)Nc1ccc( 109 4303479 http://www.aAlfa Aesar
    4517 4-acetamidobu
    CC(=O)NCCCC 130 17180 http://www.aAlfa Aesar
    4518 4-acetamidopCC(=O)Nc1ccc 170 1906 http://www.aAlfa Aesar
    4519 4-acetamidopiCC(=O)NC1CC 141 1194499 http://www. Alfa Aesar
    4520 4-acetoxy-3- CC(=O)Oc1ccc 76 55171 http://www.aAlfa Aesar
    4521 4-acetoxy-3-mCC(=O)Oc1ccc 195 4510830 http://www.aAlfa Aesar
    4522 4'-acetoxyac CC(=O)c1ccc( 53 74935 http://www.aAlfa Aesar
    4523 4-acetoxybenzCC(=O)Oc1ccc 194 15983 http://www.aAlfa Aesar
    4524 4-acetoxybiphCC(=O)Oc1ccc( 88 306959 http://www.aAlfa Aesar
    4525 4-acetoxystyr CC(=O)Oc1ccc 8 68330 http://www.aAlfa Aesar
    4526 4-acetyl-4-metCC(=O)C(C)(C 123 360681 http://www.aAlfa Aesar
    4527 4-acetyl-5-meCc1c(cnn1c2c 104 72451 http://www.aAlfa Aesar
    4528 4-acetylbenzeCC(=O)c1ccc(c 84 234148 http://www. Alfa Aesar
    4529 4-acetylbenzoiCC(=O)c1ccc( 210 10986 http://www.aAlfa Aesar
    4530 4-acetylbenzon
    CC(=O)c1ccc( 57 66663 http://www.aAlfa Aesar
    4531 4-acetylbiphe CC(=O)c1ccc(c 120 6846 http://www.aAlfa Aesar
    4532 4-acetylbutyriCC(=O)CCCC( 12 17383 http://www.aAlfa Aesar
    4533 4-acetylphenoCC(=O)c1ccc( 173 67230 http://www.aAlfa Aesar
    4534 4-acetylphenyCC(=O)c1ccc( 34 89849 http://www.aAlfa Aesar
    4535 4-acetylphenyCC(=O)c1ccc( 79 212230 http://www.aAlfa Aesar
    4536 4-acetylpyridiCC(=O)c1ccnc 15 13644 http://www.aAlfa Aesar
    4537 4-acryloylmorC=CC(=O)N1C -8 89164 http://www.aAlfa Aesar
    4538 4-amino-1,2,4-c1nncn1N 86 10951 http://www.aAlfa Aesar
    4539 4-amino-1,3,5Cc1c(c(n(n1)C 102 141942 http://www.aAlfa Aesar
    4540 4-amino-1-bocCC(C)(C)OC(= 46 1064946 http://www. Alfa Aesar
    4541 4-amino-1-butC(CCO)CN 17 24099 http://www.aAlfa Aesar
    4542 4-amino-1h-pyc1c(cn[nH]1)N 75 70416 http://www. Alfa Aesar
    4543 4-amino-1-phec1ccc(cc1)n2c 216 4713 http://www.aAlfa Aesar
    4544 4-amino-2-(meCSc1ncc(c(n1 242 261012 http://www.aAlfa Aesar
    4545 4-amino-2-(tric1cc(c(cc1N)C 138 455494 http://www.aAlfa Aesar
    4546 4-amino-2,2,6CC1(CC(CC(N1 17 34423 http://www.aAlfa Aesar
    4547 4-amino-2,3,5,c1(c(c(c(c(c1F 183 63526 http://www.aAlfa Aesar
    4548 4-amino-2,3,5,c1(c(c(nc(c1F) 86 1066929 http://www.aAlfa Aesar
    4549 4-amino-2,5-dic1c(c(cc(c1F) 93 2017584 http://www.aAlfa Aesar
    4550 4'-amino-2',6 CC(=O)Nc1c(cc 248 21242113 http://www.aAlfa Aesar
    4551 4-amino-2,6- c1c(cc(c(c1Br 196 62324 http://www.aAlfa Aesar
    4552 4-amino-2,6-dc1c(cc(c(c1Cl) 167 72291 http://www.aAlfa Aesar
    4553 4-amino-2,6-dc1c(cc(nc1Cl)C 174 121311 http://www.aAlfa Aesar
    4554 4-amino-2,6-dCc1cc(nc(n1)C 185 61354 http://www.aAlfa Aesar
    4555 4-amino-2-br c1cnc(cc1N)Br 98 307340 http://www.aAlfa Aesar
    4556 4'-amino-2'-chCC(=O)Nc1ccc 132 227556 http://www.aAlfa Aesar
    4557 4-amino-2-chlc1cc(c(cc1N)C 118 80062 http://www.aAlfa Aesar
    4558 4-amino-2-chlc1cc(c(cc1N)C 152 69983 http://www.aAlfa Aesar
    4559 4-amino-2-chlc1cnc(cc1N)Cl 93 76163 http://www.aAlfa Aesar
    4560 4-amino-2-chlc1c(c(nc(n1)C 244 2079879 http://www.aAlfa Aesar
    4561 4-amino-2-fluc1cc(c(cc1N)F 210 267526 http://www. Alfa Aesar
    4562 4-amino-2-fluc1cc(c(cc1N)F 171 2017600 http://www. Alfa Aesar
    4563 4-amino-2-metCc1cc(c2cccc 164 73183 http://www.aAlfa Aesar
    4564 4-amino-2-nitc1cc(c(cc1N)[ 129 2661194 http://www. Alfa Aesar
    4565 4-amino-3-(tric1cc(c(cc1C#N 62 2059721 http://www.aAlfa Aesar
    4566 4-amino-3-(tr c1cncc(c1N)C( 100 2062954 http://www.aAlfa Aesar
    4567 4-amino-3,5-dc1c(cc(c(c1Cl 118 455957 http://www.aAlfa Aesar
    4568 4-amino-3,5-dc1c(c(c(cn1)Cl 161 81137 http://www.aAlfa Aesar
    4569 4-amino-3,5-dc1c(cc(c(c1F) 149 2059004 http://www. Alfa Aesar
    4570 4-amino-3,5-diCc1nnc(n1N)C 198 200096 http://www.aAlfa Aesar
    4571 4-amino-3-br c1cncc(c1N)Br 67 24307 http://www.aAlfa Aesar
    4572 4-amino-3-chlCc1cc(cc(c1N) 129 2016994 http://www.aAlfa Aesar
    4573 4-amino-3-chlc1cc(c(cc1C#N 101 453492 http://www.aAlfa Aesar
    4574 4-amino-3-chlc1cncc(c1N)Cl 51 505742 http://www. Alfa Aesar
    4575 4-amino-3-ethCCc1cc(ccc1N 63 2017023 http://www.aAlfa Aesar
    4576 4-amino-3-fluc1cc(c(cc1C(= 215 9577 http://www. Alfa Aesar
    4577 4-amino-3-fluc1cc(c(cc1C#N 89 2037195 http://www. Alfa Aesar
    4578 4-amino-3-fluc1cc(c(cc1O)F 139 2017601 http://www. Alfa Aesar
    4579 4-amino-3-metCOc1cc(ccc1N 187 254036 http://www. Alfa Aesar
    4580 4-amino-3-metCc1cc(ccc1N) 170 68122 http://www.aAlfa Aesar
    4581 4-amino-3-metCc1cc(ccc1N) 94 5373889 http://www.aAlfa Aesar
    4582 4-amino-3-meCc1cc(ccc1N) 178 16838 http://www.aAlfa Aesar
    4583 4-amino-3-nitc1cc(c(cc1C#N 160 518003 http://www.aAlfa Aesar
    4584 4-amino-3-ni c1ccc(cc1)C(= 140 518940 http://www.aAlfa Aesar
    4585 4-amino-3-nitc1cc(c(cc1O)[ 151 2988001 http://www.aAlfa Aesar
    4586 4-amino-3-nitc1cncc(c1N)[N 203 477586 http://www.aAlfa Aesar
    4587 4-amino-3-pe CC(=CC(=O)C) 39 120620 http://www.aAlfa Aesar
    4588 4-amino-4'-chc1cc(ccc1N)Oc 102 7297 http://www.aAlfa Aesar
    4589 4-amino-5-broc1c(c(cnc1Cl) 128 21242442 http://www. Alfa Aesar
    4590 4-amino-5-chlCc1c(c(nc(n1) 165 516229 http://www.aAlfa Aesar
    4591 4-amino-6-hydc1c(ncnc1O)N 263 64106 http://www.aAlfa Aesar
    4592 4'-aminoacetaCC(=O)Nc1ccc 163 10297844 http://www.aAlfa Aesar
    4593 4'-aminoacet CC(=O)c1ccc(c 106 21108576 http://www.aAlfa Aesar
    4594 4-aminoantipyCc1c(c(=O)n(n 108 2066 http://www.aAlfa Aesar
    4595 4-aminobenzac1cc(ccc1C(= 183 68568 http://www.aAlfa Aesar
    4596 4'-aminobenzac1ccc(cc1)C(= 129 78657 http://www.aAlfa Aesar
    4597 4-aminobenzhc1cc(ccc1C(= 228 20160 http://www.aAlfa Aesar
    4598 4-aminobenzoic1cc(ccc1C(= 188 953 http://www.aAlfa Aesar
    4599 4-aminobenzon
    c1cc(ccc1C#N 85 12822 http://www.aAlfa Aesar
    4600 4-aminobenz c1ccc(cc1)C(= 123 13707 http://www.aAlfa Aesar
    4601 4-aminobenzylc1cc(ccc1CO) 61 62540 http://www.aAlfa Aesar
    4602 4-aminoindol c1cc(c2cc[nH] 108 507117 http://www.aAlfa Aesar
    4603 4-amino-n-bocCC(C)(C)OC(= 125 2042212 http://www. Alfa Aesar
    4604 4-amino-n-met
    CNS(=O)(=O)C 141 2058391 http://www.aAlfa Aesar
    4605 4-aminophenoc1cc(ccc1N)O 188 392 http://www.aAlfa Aesar
    4606 4-aminophenylc1cc(ccc1CC# 44 69446 http://www.aAlfa Aesar
    4607 4-aminophthac1cc2c(cc1N) 290 65747 http://www.aAlfa Aesar
    4608 4-aminophthalc1cc(c(cc1N) 181 83536 http://www.aAlfa Aesar
    4609 4-aminopyridic1cnccc1N 159 1664 http://www.aAlfa Aesar
    4610 4-aminopyridic1cncc(c1N)C 110 2041764 http://www. Alfa Aesar
    4611 4-aminopyrid c1cncc(c1N)C 168 8972046 http://www. Alfa Aesar
    4612 4-aminopyrimc1cncnc1N 150 62181 http://www. Alfa Aesar
    4613 4-aminopyrimic1c(c(ncn1)N 255 644271 http://www.aAlfa Aesar
    4614 4-aminostyre C=Cc1ccc(cc1 24 66344 http://www.aAlfa Aesar
    4615 4-anilino-1-m CN1CCC(CC1)N 84 80907 http://www. Alfa Aesar
    4616 4-azabenzimidc1cc2c(nc1)nc 148 60828 http://www.aAlfa Aesar
    4617 4-benzoyl-3-mCc1c(c(=O)n([ 91 315052 http://www.aAlfa Aesar
    4618 4-benzoyl-4'- c1ccc(cc1)C(= 157 420226 http://www.aAlfa Aesar
    4619 4-benzoylbenzc1ccc(cc1)C(= 199 62362 http://www.aAlfa Aesar
    4620 4-benzoylbiphc1ccc(cc1)c2c 101 67593 http://www.aAlfa Aesar
    4621 4-benzoylbutyr
    c1ccc(cc1)C( 127 66547 http://www.aAlfa Aesar
    4622 4-benzoylpyri c1ccc(cc1)C(= 70 24905 http://www.aAlfa Aesar
    4623 4-benzyl-3-th c1ccc(cc1)CN 130 644200 http://www.aAlfa Aesar
    4624 4-benzyl-4-hyc1ccc(cc1)CC 80 88623 http://www.aAlfa Aesar
    4625 4-benzylanilinc1ccc(cc1)Cc2 37 21170117 http://www.aAlfa Aesar
    4626 4-benzylbiphec1ccc(cc1)Cc2 86 62389 http://www.aAlfa Aesar
    4627 4-benzyloxy-1c1ccc(cc1)COc 34 11299866 http://www. Alfa Aesar
    4628 4-benzyloxy-2c1ccc(cc1)COc 167 11329698 http://www. Alfa Aesar
    4629 4-benzyloxy- c1ccc(cc1)COc 79 487889 http://www.aAlfa Aesar
    4630 4-benzyloxy-2c1ccc(cc1)COc 196 2843274 http://www.aAlfa Aesar
    4631 4-benzyloxy- COc1cc(ccc1C 96 3500124 http://www.aAlfa Aesar
    4632 4-benzyloxy-3Cc1cc(cc(c1OC 159 2015755 http://www.aAlfa Aesar
    4633 4-benzyloxy-3B(c1ccc(c(c1) 130 2019419 http://www.aAlfa Aesar
    4634 4'-benzyloxy CC(=O)c1ccc(c 86 89635 http://www.aAlfa Aesar
    4635 4-benzyloxy- COc1cc(ccc1O 63 68034 http://www.aAlfa Aesar
    4636 4-benzyloxy-3COc1cc(ccc1O 72 89264 http://www. Alfa Aesar
    4637 4-benzyloxy-3COc1cc(ccc1OC 123 598805 http://www.aAlfa Aesar
    4638 4-benzyloxy-3COc1cc(ccc1O 192 4650166 http://www.aAlfa Aesar
    4639 4-benzyloxy-3COc1cc(ccc1O 69 263115 http://www.aAlfa Aesar
    4640 4-benzyloxy-5c1ccc(cc1)CO 107 21242456 http://www. Alfa Aesar
    4641 4-benzyloxy-5c1ccc(cc1)CO 107 21242425 http://www. Alfa Aesar
    4642 4-benzyloxy-5CN1CCN(CC1)c 63 21242319 http://www. Alfa Aesar
    4643 4-benzyloxy-5c1ccc(cc1)COc 115 8908270 http://www. Alfa Aesar
    4644 4'-benzyloxy CC(=O)c1ccc( 92 214504 http://www.aAlfa Aesar
    4645 4-benzyloxyb c1ccc(cc1)COc 72 70486 http://www.aAlfa Aesar
    4646 4-benzyloxybeB(c1ccc(cc1)O 196 2016066 http://www.aAlfa Aesar
    4647 4-benzyloxybec1ccc(cc1)COc 189 66514 http://www.aAlfa Aesar
    4648 4-benzyloxybec1ccc(cc1)COc 97 488007 http://www.aAlfa Aesar
    4649 4-benzyloxyb c1ccc(cc1)COc 82 403220 http://www.aAlfa Aesar
    4650 4-benzyloxybec1ccc(cc1)COc 86 63233 http://www.aAlfa Aesar
    4651 4-benzyloxycac1ccc(cc1)CO 120 643878 http://www. Alfa Aesar
    4652 4-benzyloxyinc1ccc(cc1)COc 60 79817 http://www.aAlfa Aesar
    4653 4-benzyloxyp c1ccc(cc1)COc 120 7356 http://www.aAlfa Aesar
    4654 4-benzyloxyphc1ccc(cc1)CO 140 490059 http://www.aAlfa Aesar
    4655 4-benzyloxyphc1ccc(cc1)COc 64 2017190 http://www.aAlfa Aesar
    4656 4-benzyloxyphc1ccc(cc1)COc 68 456042 http://www.aAlfa Aesar
    4657 4'-benzyloxy CCC(=O)c1ccc 100 70620 http://www.aAlfa Aesar
    4658 4-benzyloxypyc1ccc(cc1)COc 174 261125 http://www.aAlfa Aesar
    4659 4-benzylphenoc1ccc(cc1)Cc2 83 21159439 http://www.aAlfa Aesar
    4660 4-benzylphenyc1ccc(cc1)Cc2 36 519441 http://www.aAlfa Aesar
    4661 4-benzylpiperc1ccc(cc1)CC 7 29432 http://www.aAlfa Aesar
    4662 4-benzylpyrid c1ccc(cc1)Cc2 10 15603 http://www.aAlfa Aesar
    4663 4-biphenylacetc1ccc(cc1)c2c 161 3215 http://www.aAlfa Aesar
    4664 4-biphenylacetc1ccc(cc1)c2c 95 32982 http://www.aAlfa Aesar
    4665 4-biphenylcarbc1ccc(cc1)c2c 194 65558 http://www.aAlfa Aesar
    4666 4-biphenylmec1ccc(cc1)c2c 101 18105 http://www.aAlfa Aesar
    4667 4-bromo-1,2- c1cc(c(cc1Br)C 24 13881395 http://www.aAlfa Aesar
    4668 4-bromo-1,2-dc1cc(c(cc1Br)F -4 60994 http://www.aAlfa Aesar
    4669 4-bromo-1,3,5Cc1c(c(n(n1)C 35 452858 http://www.aAlfa Aesar
    4670 4-bromo-1-fluc1cc(c(cc1Br)[ 19 2017999 http://www.aAlfa Aesar
    4671 4-bromo-2-(1hc1cc(c(cc1Br) 162 18338435 http://www. Alfa Aesar
    4672 4-bromo-2-(2-CC(=Cc1cc(cs1 89 2014182 http://www.aAlfa Aesar
    4673 4-bromo-2-(5-c1cc(c(cc1Br) 211 18317080 http://www. Alfa Aesar
    4674 4'-bromo-2'-(tCC(=O)Nc1ccc( 136 2018085 http://www.aAlfa Aesar
    4675 4-bromo-2-(trc1cc(c(cc1Br) 53 9954833 http://www. Alfa Aesar
    4676 4-bromo-2-(trc1cc(c(cc1Br)C 56 2058857 http://www.aAlfa Aesar
    4677 4-bromo-2-(trc1cc(c(cc1Br)C 84 125971 http://www. Alfa Aesar
    4678 4-bromo-2,2-dc1ccc(cc1)C(C 68 87189 http://www.aAlfa Aesar
    4679 4-bromo-2,3,5c1(c(c(c(c(c1F 144 263312 http://www. Alfa Aesar
    4680 4-bromo-2,3-dB(c1ccc(c(c1F 225 2053713 http://www.aAlfa Aesar
    4681 4-bromo-2,3-dCc1c(c(c(cc1B 153 2055014 http://www.aAlfa Aesar
    4682 4-bromo-2,5-dc1(c(c(sc1Cl)C 69 452962 http://www.aAlfa Aesar
    4683 4-bromo-2,5-dc1c(c(cc(c1F)B 75 2053706 http://www.aAlfa Aesar
    4684 4-bromo-2,5-dCOc1cc(c(cc1F 63 2007097 http://www.aAlfa Aesar
    4685 4-bromo-2,5-dc1c(c(cc(c1S( 165 2053714 http://www. Alfa Aesar
    4686 4-bromo-2,5-dc1c(c(cc(c1S(= 35 499611 http://www.aAlfa Aesar
    4687 4-bromo-2,5-dc1c(c(cc(c1F)B 52 5381032 http://www. Alfa Aesar
    4688 4-bromo-2,5- COc1cc(c(cc1 134 680141 http://www.aAlfa Aesar
    4689 4-bromo-2,6-dc1c(cc(c(c1Cl) 87 62881 http://www.aAlfa Aesar
    4690 4-bromo-2,6-dc1c(cc(c(c1Cl) 45 2019102 http://www.aAlfa Aesar
    4691 4-bromo-2,6-dc1c(cc(c(c1F)N 64 530429 http://www.aAlfa Aesar
    4692 4-bromo-2,6-dc1c(cc(c(c1F) 78 2053711 http://www. Alfa Aesar
    4693 4-bromo-2,6-dc1c(cc(c(c1F) 203 2053719 http://www. Alfa Aesar
    4694 4-bromo-2,6-dc1c(cc(c(c1F) 81 2037676 http://www. Alfa Aesar
    4695 4-bromo-2,6-dc1c(cc(c(c1F)O 50 2017963 http://www.aAlfa Aesar
    4696 4-bromo-2,6-dCc1cc(cc(c1N) 50 81756 http://www.aAlfa Aesar
    4697 4-bromo-2,6- Cc1cc(cc(c1O) 76 16030 http://www.aAlfa Aesar
    4698 4-bromo-2,6-dCc1cc(cc(c1N 61 3630715 http://www.aAlfa Aesar
    4699 4-bromo-2,6-dCc1cc(cc(c1N= 80 455903 http://www.aAlfa Aesar
    4700 4-bromo-2,6-dCc1c(cc(cc1[N 87 13737029 http://www. Alfa Aesar
    4701 4-bromo-2,6-dCC(C)(C)c1cc( 83 63993 http://www.aAlfa Aesar
    4702 4-bromo-2-chc1cc(c(cc1Br)C 34 2017234 http://www.aAlfa Aesar
    4703 4-bromo-2-chlCc1cc(cc(c1N) 39 2050128 http://www.aAlfa Aesar
    4704 4'-bromo-2'-c CC(=O)Nc1ccc( 152 530408 http://www.aAlfa Aesar
    4705 4-bromo-2-chlc1cc(c(cc1Br)C 70 530410 http://www.aAlfa Aesar
    4706 4-bromo-2-chc1cc(c(cc1Br) 174 2016508 http://www.aAlfa Aesar
    4707 4-bromo-2-chlc1cc(c(cc1Br)C 79 2016510 http://www.aAlfa Aesar
    4708 4-bromo-2-chlc1cc(c(cc1Br) 173 97867 http://www.aAlfa Aesar
    4709 4-bromo-2-chlc1cc(c(cc1Br) 70 5373990 http://www.aAlfa Aesar
    4710 4-bromo-2-chc1cc(c(cc1Br)C 49 18707 http://www.aAlfa Aesar
    4711 4-bromo-2-chlc1cc(c(cc1Br) 46 2017238 http://www.aAlfa Aesar
    4712 4-bromo-2-chlc1cnc(cc1Br)C 19 3073072 http://www. Alfa Aesar
    4713 4'-bromo-2'-etCCc1cc(ccc1N 143 2016919 http://www.aAlfa Aesar
    4714 4-bromo-2-fluc1cc(c(cc1Br)F 48 2006649 http://www.aAlfa Aesar
    4715 4-bromo-2-fluo
    c1c(c(cc(c1N)F 36 5381036 http://www. Alfa Aesar
    4716 4-bromo-2-fluCOc1c(cc(cc1F 55 484342 http://www. Alfa Aesar
    4717 4'-bromo-2'-flCC(=O)Nc1ccc( 156 60914 http://www.aAlfa Aesar
    4718 4-bromo-2-fluc1cc(c(cc1Br) 40 109672 http://www.aAlfa Aesar
    4719 4-bromo-2-fl c1cc(c(cc1Br) 61 126613 http://www.aAlfa Aesar
    4720 4-bromo-2-fl c1cc(c(cc1Br) 152 2053750 http://www. Alfa Aesar
    4721 4-bromo-2-fluB(c1ccc(cc1F) 240 2053752 http://www.aAlfa Aesar
    4722 4-bromo-2-fluc1cc(c(cc1Br) 65 2017981 http://www.aAlfa Aesar
    4723 4-bromo-2-fluc1cc(c(cc1Br) 212 267527 http://www.aAlfa Aesar
    4724 4-bromo-2-fluc1cc(c(cc1Br) 71 643169 http://www.aAlfa Aesar
    4725 4-bromo-2-fluc1cc(c(cc1Br)F 25 2015784 http://www.aAlfa Aesar
    4726 4-bromo-2-fluc1cc(c(cc1Br) 32 2015785 http://www.aAlfa Aesar
    4727 4-bromo-2-fluc1cc(c(cc1Br) 35 2015437 http://www.aAlfa Aesar
    4728 4-bromo-2-fluc1ccc(cc1)c2c 40 454503 http://www.aAlfa Aesar
    4729 4-bromo-2-fluc1cc(c(cc1Br) 219 599788 http://www.aAlfa Aesar
    4730 4-bromo-2-fu c1c(coc1C=O) 56 2037770 http://www. Alfa Aesar
    4731 4'-bromo-2'-hCc1cc(c(cc1Br 88 21242529 http://www. Alfa Aesar
    4732 4-bromo-2-hyd
    c1cnc(cc1Br)O 203 713822 http://www. Alfa Aesar
    4733 4-bromo-2-meCOc1cc(ccc1C 68 10630860 http://www. Alfa Aesar
    4734 4-bromo-2-meCOc1cc(ccc1O 35 230271 http://www.aAlfa Aesar
    4735 4-bromo-2-met
    Cc1cc(cc(c1N) 145 455937 http://www.aAlfa Aesar
    4736 4'-bromo-2'-mCc1cc(ccc1NC 156 192955 http://www.aAlfa Aesar
    4737 4-bromo-2-met
    Cc1cc(ccc1N)B 58 10943 http://www.aAlfa Aesar
    4738 4-bromo-2-met
    Cc1cc(ccc1OC 68 528776 http://www.aAlfa Aesar
    4739 4-bromo-2-met
    Cc1cc(ccc1C(= 183 89955 http://www.aAlfa Aesar
    4740 4-bromo-2-met
    Cc1cc(ccc1C# 64 127267 http://www.aAlfa Aesar
    4741 4-bromo-2-meCc1cc(ccc1O)B 64 16011 http://www. Alfa Aesar
    4742 4-bromo-2-met
    Cc1cc(ccc1N= 49 2017281 http://www.aAlfa Aesar
    4743 4-bromo-2-met
    Cc1cc(ccc1N= 45 79371 http://www.aAlfa Aesar
    4744 4-bromo-2-nitc1cc(c(cc1Br) 112 63320 http://www.aAlfa Aesar
    4745 4-bromo-2-nitc1cc(c(cc1Br) 167 3002916 http://www. Alfa Aesar
    4746 4-bromo-2-nitc1cc(c(cc1Br) 92 22779 http://www. Alfa Aesar
    4747 4-bromo-2-nitCc1ccc(cc1[N+ 47 110140 http://www.aAlfa Aesar
    4748 4'-bromo-3'-(tCC(=O)Nc1ccc( 118 608011 http://www.aAlfa Aesar
    4749 4-bromo-3-(trc1cc(c(cc1N)C( 48 61169 http://www.aAlfa Aesar
    4750 4-bromo-3-(trc1cc(c(cc1S(= 187 2058645 http://www.aAlfa Aesar
    4751 4-bromo-3,5-dc1c(cc(c(c1F)B 100 2017933 http://www. Alfa Aesar
    4752 4-bromo-3,5-dCOc1cc(c(c(c1 28 2007098 http://www.aAlfa Aesar
    4753 4-bromo-3,5-dc1c(cc(c(c1F)B 74 5509972 http://www. Alfa Aesar
    4754 4-bromo-3,5-dc1c(cc(c(c1O) 270 77604 http://www.aAlfa Aesar
    4755 4-bromo-3,5-dCOc1cc(cc(c1 256 2054435 http://www.aAlfa Aesar
    4756 4-bromo-3,5-dCc1c(c(n[nH]1 121 69387 http://www.aAlfa Aesar
    4757 4-bromo-3,5- Cc1cc(cc(c1Br 115 73975 http://www.aAlfa Aesar
    4758 4'-bromo-3'-c CC(=O)Nc1ccc( 124 2027769 http://www.aAlfa Aesar
    4759 4-bromo-3-chlc1cc(c(cc1N)Cl 64 80207 http://www.aAlfa Aesar
    4760 4-bromo-3-chlc1cc(c(cc1C(= 222 13921727 http://www. Alfa Aesar
    4761 4-bromo-3-chc1cc(c(cc1O)Cl 66 5381170 http://www.aAlfa Aesar
    4762 4'-bromo-3-c c1cc(ccc1C(=O 60 86469 http://www.aAlfa Aesar
    4763 4-bromo-3-cy c1cncc(c1Br) 121 11349139 http://www. Alfa Aesar
    4764 4'-bromo-3'-flCC(=O)Nc1ccc( 151 2053737 http://www.aAlfa Aesar
    4765 4-bromo-3-fluc1cc(c(cc1N)F 68 717948 http://www.aAlfa Aesar
    4766 4-bromo-3-fluCOc1ccc(c(c1) 218 2949462 http://www. Alfa Aesar
    4767 4-bromo-3-fl c1cc(c(cc1S(= 139 2058660 http://www.aAlfa Aesar
    4768 4-bromo-3-fluc1cc(c(cc1C(= 212 2053760 http://www.aAlfa Aesar
    4769 4-bromo-3-meCOc1cc(ccc1B 98 5381236 http://www.aAlfa Aesar
    4770 4-bromo-3-meCOc1cc(ccc1B 79 308792 http://www. Alfa Aesar
    4771 4-bromo-3-met
    Cc1c(c[nH]n1) 75 75563 http://www.aAlfa Aesar
    4772 4'-bromo-3'-mCc1cc(ccc1Br 103 645319 http://www.aAlfa Aesar
    4773 4-bromo-3-met
    Cc1cc(ccc1Br) 81 21844 http://www.aAlfa Aesar
    4774 4-bromo-3-meCc1cc(ccc1Br) 180 5383811 http://www.aAlfa Aesar
    4775 4-bromo-3-meCc1cc(ccc1Br) 151 2019050 http://www. Alfa Aesar
    4776 4-bromo-3-met
    Cc1cc(ccc1Br) 59 2019136 http://www.aAlfa Aesar
    4777 4-bromo-3-met
    Cc1cc(ccc1Br) 217 74125 http://www.aAlfa Aesar
    4778 4-bromo-3-met
    Cc1cc(ccc1Br 53 2019128 http://www.aAlfa Aesar
    4779 4-bromo-3-met
    Cc1cc(ccc1Br) 26 5384444 http://www.aAlfa Aesar
    4780 4-bromo-3-meCc1cc(ccc1Br) 59 65689 http://www.aAlfa Aesar
    4781 4'-bromo-3'-nCC(=O)c1ccc(c 119 79155 http://www.aAlfa Aesar
    4782 4-bromo-3-nitCOc1ccc(c(c1) 31 71612 http://www.aAlfa Aesar
    4783 4-bromo-3-nitCc1ccc(c(c1)[ 31 71549 http://www.aAlfa Aesar
    4784 4'-bromo-4-c c1cc(ccc1C(=O 37 70689 http://www.aAlfa Aesar
    4785 4-bromo-4'-hyc1cc(ccc1c2cc 166 85808 http://www.aAlfa Aesar
    4786 4-bromo-4'-teCC(C)(C)c1ccc 142 8146981 http://www. Alfa Aesar
    4787 4-bromo-5-fluCc1cc(c(cc1[N 61 2059599 http://www. Alfa Aesar
    4788 4'-bromoacetaCC(=O)Nc1ccc( 169 7399 http://www.aAlfa Aesar
    4789 4'-bromoacet CC(=O)c1ccc(c 51 7186 http://www.aAlfa Aesar
    4790 4-bromoanilinc1cc(ccc1N)Br 63 7519 http://www.aAlfa Aesar
    4791 4-bromoanisoCOc1ccc(cc1)B 11 13881571 http://www.aAlfa Aesar
    4792 4-bromobenzac1cc(ccc1C=O) 57 63906 http://www.aAlfa Aesar
    4793 4-bromobenz c1cc(ccc1C(=O 192 62884 http://www.aAlfa Aesar
    4794 4-bromobenzeB(c1ccc(cc1)B 284 71906 http://www.aAlfa Aesar
    4795 4-bromobenzec1cc(ccc1S(=O 166 62897 http://www.aAlfa Aesar
    4796 4-bromobenzen
    c1cc(ccc1S(=O 75 7118 http://www.aAlfa Aesar
    4797 4-bromobenzhc1cc(ccc1C(= 168 20861 http://www.aAlfa Aesar
    4798 4-bromobenzoi
    c1cc(ccc1C(=O 256 10980 http://www.aAlfa Aesar
    4799 4-bromobenzon
    c1cc(ccc1C#N) 113 11662 http://www.aAlfa Aesar
    4800 4-bromobenz c1ccc(cc1)C(= 81 6763 http://www.aAlfa Aesar
    4801 4-bromobenzoy
    c1cc(ccc1C(=O 40 61790 http://www.aAlfa Aesar
    4802 4-bromobenzyl
    c1cc(ccc1CO)B 78 63307 http://www.aAlfa Aesar
    4803 4-bromobenzyc1cc(ccc1CBr) 62 61802 http://www.aAlfa Aesar
    4804 4-bromobenzyl
    c1cc(ccc1CCl) 40 61803 http://www.aAlfa Aesar
    4805 4-bromobenzyc1cc(ccc1CS)B 27 238537 http://www. Alfa Aesar
    4806 4-bromobiphec1ccc(cc1)c2c 90 6834 http://www.aAlfa Aesar
    4807 4-bromobutyriC(CC(=O)O)CB 32 68318 http://www.aAlfa Aesar
    4808 4-bromocroton
    c1ccc(cc1)C( 90 5382495 http://www.aAlfa Aesar
    4809 4-bromodiphen
    c1ccc(cc1)Oc2 18 7284 http://www.aAlfa Aesar
    4810 4-bromoindolc1cc2c(cc[nH] 17 589198 http://www.aAlfa Aesar
    4811 4-bromoisophtc1cc(c(cc1C(= 299 73409 http://www.aAlfa Aesar
    4812 4-bromoisoquic1ccc2c(c1)cn 41 66385 http://www.aAlfa Aesar
    4813 4-bromomande
    c1cc(ccc1C(C( 117 88403 http://www.aAlfa Aesar
    4814 4-bromomethyl
    c1cc(c(cc1C(= 131 116908 http://www.aAlfa Aesar
    4815 4-bromomethyCOc1cc2c(cc( 202 114199 http://www.aAlfa Aesar
    4816 4-bromo-n,n-dCCN(CC)c1ccc( 34 21159579 http://www.aAlfa Aesar
    4817 4-bromo-n,n-dCN(C)c1ccc(cc 54 13873600 http://www.aAlfa Aesar
    4818 4-bromopheneCCOc1ccc(cc1 4 21111894 http://www.aAlfa Aesar
    4819 4-bromophenoc1cc(ccc1O)Br 64 13842573 http://www.aAlfa Aesar
    4820 4-bromophenyc1cc(ccc1N=C 41 68133 http://www.aAlfa Aesar
    4821 4-bromophenyl
    c1cc(ccc1N=C= 58 15317 http://www.aAlfa Aesar
    4822 4-bromophenyl
    CS(=O)(=O)c1c 102 69460 http://www.aAlfa Aesar
    4823 4-bromophenyl
    c1cc(ccc1CC(= 117 67229 http://www.aAlfa Aesar
    4824 4-bromophenyl
    c1cc(ccc1CC# 47 25968 http://www.aAlfa Aesar
    4825 4-bromophenyC#Cc1ccc(cc1) 66 120370 http://www.aAlfa Aesar
    4826 4-bromophthalc1cc(c(cc1Br) 163 73472 http://www.aAlfa Aesar
    4827 4'-bromopropCCC(=O)c1ccc( 46 59691 http://www.aAlfa Aesar
    4828 4-bromostyreC=Cc1ccc(cc1) 5 15431 http://www.aAlfa Aesar
    4829 4-bromothioan
    CSc1ccc(cc1)B 39 59428 http://www.aAlfa Aesar
    4830 4-bromothiopc1c(csc1C=O)B 46 79204 http://www.aAlfa Aesar
    4831 4-bromothiopc1cc(ccc1S)Br 75 59439 http://www.aAlfa Aesar
    4832 4-bromotolueCc1ccc(cc1)Br 28 13875258 http://www.aAlfa Aesar
    4833 4-bromo-transc1ccc(cc1)/C= 139 4524368 http://www. Alfa Aesar
    4834 4'-bromovale CCCCC(=O)c1cc 35 73735 http://www.aAlfa Aesar
    4835 4-carboxybenc1cc(ccc1C=O 245 11591 http://www.aAlfa Aesar
    4836 4-chloro-2-(1hc1cc(c(cc1Cl) 157 10819312 http://www. Alfa Aesar
    4837 4-chloro-2-(5-c1cc(c(cc1Cl) 202 10728533 http://www. Alfa Aesar
    4838 4-chloro-2-(mCSc1nccc(n1)C -2 87661 http://www.aAlfa Aesar
    4839 4-chloro-2-(tr c1cc(c(cc1Cl)C 9 61276 http://www.aAlfa Aesar
    4840 4-chloro-2-(t B(c1ccc(cc1C(F 181 2043933 http://www. Alfa Aesar
    4841 4-chloro-2-(tr c1cc(c(cc1Cl) 89 2526962 http://www. Alfa Aesar
    4842 4-chloro-2-(tr c1ccc2c(c1)c(c 32 2018367 http://www.aAlfa Aesar
    4843 4'-chloro-2,2':c1ccnc(c1)c2c 150 581106 http://www.aAlfa Aesar
    4844 4-chloro-2,5- COc1cc(c(cc1C 120 21398 http://www.aAlfa Aesar
    4845 4-chloro-2,5-dCc1cc(c(cc1Cl 92 11352506 http://www. Alfa Aesar
    4846 4-chloro-2,5- Cc1cc(c(cc1Cl 191 2017416 http://www.aAlfa Aesar
    4847 4-chloro-2,5- Cc1cc(c(cc1Cl 49 59985 http://www.aAlfa Aesar
    4848 4-chloro-2,6- c1c(nc(nc1Cl) 201 60757 http://www.aAlfa Aesar
    4849 4-chloro-2,6- Cc1c(c(c(c(c1B 159 5875278 http://www.aAlfa Aesar
    4850 4-chloro-2,6- c1c(cc(c(c1Br) 93 543184 http://www.aAlfa Aesar
    4851 4-chloro-2,6-dc1c(cc(c(c1F)C 102 16499368 http://www. Alfa Aesar
    4852 4-chloro-2,6-dCc1cc(cc(c1N) 48 4250033 http://www.aAlfa Aesar
    4853 4-chloro-2,6- Cc1cc(cc(c1O) 82 63912 http://www.aAlfa Aesar
    4854 4-chloro-2-fluc1c(cc(c(c1F)N 40 2054062 http://www.aAlfa Aesar
    4855 4'-chloro-2'-f CC(=O)Nc1ccc( 156 745600 http://www.aAlfa Aesar
    4856 4-chloro-2-fl c1cc(c(cc1Cl) 59 2007023 http://www.aAlfa Aesar
    4857 4-chloro-2-fl c1cc(c(cc1Cl)F 36 2059102 http://www.aAlfa Aesar
    4858 4-chloro-2-fluc1cc(c(cc1Cl) 205 89574 http://www.aAlfa Aesar
    4859 4-chloro-2-fluc1cc(c(cc1Cl) 60 84539 http://www.aAlfa Aesar
    4860 4-chloro-2-fluc1cc(c(cc1Cl) 215 4757997 http://www.aAlfa Aesar
    4861 4-chloro-2-fluc1cc(c(cc1Cl) 39 2018231 http://www. Alfa Aesar
    4862 4'-chloro-2'- CC(=O)c1ccc(c 29 901670 http://www. Alfa Aesar
    4863 4-chloro-2-hy c1cnc(cc1Cl)O 178 2038371 http://www. Alfa Aesar
    4864 4-chloro-2-iodc1cc(c(cc1Cl)I 40 2038375 http://www.aAlfa Aesar
    4865 4-chloro-2-io COc1ccc(cc1I) 46 2079691 http://www.aAlfa Aesar
    4866 4-chloro-2-is Cc1cc(c(cc1Cl 60 6716 http://www.aAlfa Aesar
    4867 4-chloro-2-meCOc1cc(ccc1C 147 84565 http://www.aAlfa Aesar
    4868 4-chloro-2-meCOc1cc(ccc1C 47 2787453 http://www. Alfa Aesar
    4869 4-chloro-2-m COc1cc(ccc1O 17 26091 http://www.aAlfa Aesar
    4870 4-chloro-2-met
    Cc1cc(cc(c1N) 122 158601 http://www.aAlfa Aesar
    4871 4'-chloro-2'-mCc1cc(ccc1NC( 140 71212 http://www.aAlfa Aesar
    4872 4-chloro-2-meCc1cc(ccc1OC) 34 69204 http://www.aAlfa Aesar
    4873 4-chloro-2-meB(c1ccc(cc1C) 194 4196741 http://www.aAlfa Aesar
    4874 4-chloro-2-meCc1cc(ccc1C(= 172 309089 http://www. Alfa Aesar
    4875 4-chloro-2-meCc1cc(ccc1CO) 62 2038429 http://www. Alfa Aesar
    4876 4-chloro-2-meCc1cc(ccc1O)C 47 14165 http://www.aAlfa Aesar
    4877 4-chloro-2-meCc1cc(ccc1N= 38 125396 http://www.aAlfa Aesar
    4878 4-chloro-2-meCc1cc(ccc1N=C 34 81267 http://www.aAlfa Aesar
    4879 4-chloro-2-meCc1cc(c2ccccc 25 70361 http://www.aAlfa Aesar
    4880 4-chloro-2-nitc1cc(c(cc1Cl) 116 6713 http://www.aAlfa Aesar
    4881 4-chloro-2-nitCOc1ccc(cc1[N 98 59998 http://www.aAlfa Aesar
    4882 4-chloro-2-nitc1cc(c(cc1Cl) 144 72684 http://www.aAlfa Aesar
    4883 4-chloro-2-ni c1cc(c(cc1Cl) 87 6714 http://www.aAlfa Aesar
    4884 4-chloro-2-ni Cc1ccc(cc1[N+ 36 6709 http://www.aAlfa Aesar
    4885 4-chloro-3-(tr c1cc(c(cc1C#N 37 16499393 http://www. Alfa Aesar
    4886 4-chloro-3-(tr c1cc(c(cc1CC( 62 16499382 http://www. Alfa Aesar
    4887 4'-chloro-3'- CC(=O)c1ccc(c( 62 2054260 http://www.aAlfa Aesar
    4888 4-chloro-3-(tr c1cc(c(cc1N)C( 37 60896 http://www.aAlfa Aesar
    4889 4-chloro-3-(tr c1cc(c(cc1C(=O 164 2054266 http://www.aAlfa Aesar
    4890 4-chloro-3-(tr c1cc(c(cc1C#N) 66 2018140 http://www.aAlfa Aesar
    4891 4-chloro-3-(tr c1cc(c(cc1CO)C 45 2058371 http://www.aAlfa Aesar
    4892 4-chloro-3-(t c1cc(c(cc1CBr) 38 2058374 http://www. Alfa Aesar
    4893 4-chloro-3-(tr c1cc(c(cc1O)C( 44 72719 http://www.aAlfa Aesar
    4894 4-chloro-3-(tr c1cc(c(cc1N=C 35 2015068 http://www.aAlfa Aesar
    4895 4-chloro-3-(tr c1cc(c(cc1CC( 83 2759227 http://www. Alfa Aesar
    4896 4-chloro-3,5- Cc1cc(cc(c1Cl 114 21106017 http://www.aAlfa Aesar
    4897 4-chloro-3,5-dc1c(cc(c(c1[N 161 8074 http://www.aAlfa Aesar
    4898 4-chloro-3,5-dc1c(cc(c(c1[N 141 15209 http://www.aAlfa Aesar
    4899 4-chloro-3,5-dc1c(cc(c(c1[N+ 56 9426 http://www.aAlfa Aesar
    4900 4-chloro-3-fluc1cc(c(cc1N)F) 60 2018177 http://www. Alfa Aesar
    4901 4-chloro-3-fl c1cc(c(cc1C=O 47 2007099 http://www.aAlfa Aesar
    4902 4-chloro-3-fluc1cc(c(cc1C(= 192 2018199 http://www. Alfa Aesar
    4903 4-chloro-3-fluc1cc(c(cc1C#N 80 2018202 http://www.aAlfa Aesar
    4904 4-chloro-3-fl c1cc(c(cc1CBr) 32 2063279 http://www. Alfa Aesar
    4905 4-chloro-3-fluc1cc(c(cc1/C= 243 4647160 http://www. Alfa Aesar
    4906 4-chloro-3-fl c1cc(c(cc1O)F) 52 2006656 http://www.aAlfa Aesar
    4907 4-chloro-3-io c1cc(c(cc1O)I) 76 16036504 http://www.aAlfa Aesar
    4908 4-chloro-3-meCOc1cc(ccc1Cl 80 10629121 http://www. Alfa Aesar
    4909 4-chloro-3-meCc1cc(ccc1Cl) 84 22006 http://www.aAlfa Aesar
    4910 4-chloro-3-meB(c1ccc(c(c1)C 240 3014531 http://www.aAlfa Aesar
    4911 4-chloro-3-meCc1cc(ccc1Cl) 214 249257 http://www.aAlfa Aesar
    4912 4-chloro-3-meCc1cc(ccc1Cl) 66 21106018 http://www.aAlfa Aesar
    4913 4-chloro-3-nitc1c[nH]c(=O)c 223 452950 http://www.aAlfa Aesar
    4914 4'-chloro-3'- CC(=O)c1ccc(c 98 71903 http://www.aAlfa Aesar
    4915 4-chloro-3-nitc1cc(c(cc1N)[ 103 11967 http://www.aAlfa Aesar
    4916 4-chloro-3-nitCOc1ccc(c(c1) 44 23485 http://www.aAlfa Aesar
    4917 4-chloro-3-ni c1cc(c(cc1C=O 63 77115 http://www.aAlfa Aesar
    4918 4-chloro-3-ni c1cc(c(cc1C(= 152 25995 http://www.aAlfa Aesar
    4919 4-chloro-3-nitc1cc(c(cc1S(=O 60 7047 http://www.aAlfa Aesar
    4920 4-chloro-3-nitc1cc(c(cc1C(= 182 7044 http://www.aAlfa Aesar
    4921 4-chloro-3-nitc1cc(c(cc1C#N 100 13066 http://www.aAlfa Aesar
    4922 4-chloro-3-ni c1ccc(cc1)C(= 105 38087 http://www.aAlfa Aesar
    4923 4-chloro-3-nitc1cc(c(cc1C(F) -3 8151 http://www.aAlfa Aesar
    4924 4-chloro-3-nitc1cc(c(cc1CO) 63 83011 http://www.aAlfa Aesar
    4925 4-chloro-3-nitc1cc(c(cc1/C= 187 599596 http://www.aAlfa Aesar
    4926 4-chloro-3-ni c1cc(c(cc1O)[ 127 62344 http://www.aAlfa Aesar
    4927 4-chloro-3-ni c1cc(c(cc1N=C 66 125664 http://www.aAlfa Aesar
    4928 4-chloro-3-nitc1cc(c(cc1N=C 66 128423 http://www.aAlfa Aesar
    4929 4-chloro-3-nitc1cncc(c1Cl)[ 32 2017467 http://www.aAlfa Aesar
    4930 4-chloro-3-ni Cc1ccc(c(c1)[N 7 6710 http://www.aAlfa Aesar
    4931 4-chloro-3-su c1cc(c(cc1C(= 258 13909 http://www.aAlfa Aesar
    4932 4-chloro-4'-f c1cc(ccc1C(=O 6 18603 http://www.aAlfa Aesar
    4933 4-chloro-4'- c1cc(ccc1C(=O 180 110099 http://www.aAlfa Aesar
    4934 4-chloro-4'-h c1cc(ccc1C(= 113 73608 http://www.aAlfa Aesar
    4935 4-chloro-4'- COc1ccc(cc1) 32 87037 http://www.aAlfa Aesar
    4936 4-chloro-5,6, c1nc2c(c3c(s2 96 609578 http://www. Alfa Aesar
    4937 4-chloro-5-ni c1c2c(cc(c1[N 201 2079842 http://www.aAlfa Aesar
    4938 4-chloro-5-phc1ccc(cc1)c2c 130 618021 http://www. Alfa Aesar
    4939 4-chloro-6-(1-c1c(ncnc1Cl) 79 519720 http://www. Alfa Aesar
    4940 4-chloro-6-(1-c1c(ncnc1Cl) 97 20194163 http://www. Alfa Aesar
    4941 4-chloro-6,7- c1nc2c(c3c(s2 105 690690 http://www. Alfa Aesar
    4942 4-chloro-6,7- COc1cc2c(cc1 186 2049889 http://www. Alfa Aesar
    4943 4-chloro-6-meCc1cc(c(cc1N 62 3358597 http://www.aAlfa Aesar
    4944 4-chloro-7-ni c1cc(c2c(c1[N 98 23406 http://www.aAlfa Aesar
    4945 4-chloro-8-(tr c1cc2c(ccnc2c( 81 81487 http://www.aAlfa Aesar
    4946 4'-chloroacetaCC(=O)Nc1ccc( 179 10411 http://www.aAlfa Aesar
    4947 4'-chloroacet CC(=O)c1ccc(c 19 13835126 http://www.aAlfa Aesar
    4948 4-chloro-alph CC(C)(c1ccc(c 127 72622 http://www.aAlfa Aesar
    4949 4-chloro-alph CC(c1ccc(cc1) 57 92600 http://www.aAlfa Aesar
    4950 4-chloro-alphac1cc(ccc1CS(= 95 197740 http://www. Alfa Aesar
    4951 4-chloroanilinc1cc(ccc1N)Cl 70 13869339 http://www.aAlfa Aesar
    4952 4-chloroaniso COc1ccc(cc1)C -18 11667 http://www.aAlfa Aesar
    4953 4-chlorobenz c1cc(ccc1C=O) 47 21106019 http://www.aAlfa Aesar
    4954 4-chlorobenz c1cc(ccc1C(=O 178 11587 http://www.aAlfa Aesar
    4955 4-chlorobenzeB(c1ccc(cc1)C 273 66902 http://www.aAlfa Aesar
    4956 4-chlorobenzec1cc(ccc1Cl)[ 185 4256138 http://www.aAlfa Aesar x metal - AL
    4957 4-chlorobenz c1cc(ccc1S(=O 146 60188 http://www.aAlfa Aesar
    4958 4-chlorobenzec1cc(ccc1S(=O 52 7120 http://www.aAlfa Aesar
    4959 4-chlorobenzhc1cc(ccc1C(=O 164 10359 http://www.aAlfa Aesar
    4960 4-chlorobenzhc1ccc(cc1)C(c 60 8094 http://www.aAlfa Aesar
    4961 4-chlorobenzilc1ccc(cc1)C(= 67 81055 http://www.aAlfa Aesar
    4962 4-chlorobenzoc1cc(ccc1C(=O 241 6079 http://www.aAlfa Aesar
    4963 4-chlorobenzon
    c1cc(ccc1C#N) 92 11663 http://www.aAlfa Aesar
    4964 4-chlorobenz c1ccc(cc1)C(= 76 8331 http://www.aAlfa Aesar
    4965 4-chlorobenzoc1cc(ccc1C(Cl) 6 20002 http://www.aAlfa Aesar
    4966 4-chlorobenzot
    c1cc(ccc1C(F)( -36 7116 http://www.aAlfa Aesar
    4967 4-chlorobenzoc1cc(ccc1C(=O 12 8187 http://www.aAlfa Aesar
    4968 4-chlorobenzoy
    c1cc(ccc1C(=O 130 121941 http://www.aAlfa Aesar
    4969 4-chlorobenzyc1cc(ccc1CO)C 70 12823 http://www.aAlfa Aesar
    4970 4-chlorobenzyc1cc(ccc1CBr) 49 62538 http://www.aAlfa Aesar
    4971 4-chlorobenzylc1cc(ccc1CCl)C 28 7437 http://www.aAlfa Aesar
    4972 4-chlorobenzyc1cc(ccc1CS)C 20 72625 http://www.aAlfa Aesar
    4973 4'-chlorobuty CCCC(=O)c1ccc 36 63504 http://www.aAlfa Aesar
    4974 4-chlorobutyryC(CC(=O)Cl)CC -49 70739 http://www.aAlfa Aesar
    4975 4'-chlorochal c1ccc(cc1)/C= 99 4526147 http://www.aAlfa Aesar
    4976 4-chlorochalc c1ccc(cc1)C(= 115 4526154 http://www.aAlfa Aesar
    4977 4-chlorocinn c1cc(ccc1/C=C 213 4516368 http://www.aAlfa Aesar
    4978 4-chlorodiphec1ccc(cc1)S(= 92 6369 http://www.aAlfa Aesar
    4979 4-chloro-D-phc1cc(ccc1C[C 260 580818 http://www. Alfa Aesar
    4980 4-chloromande
    c1cc(ccc1C(C( 120 9877 http://www.aAlfa Aesar
    4981 4-chloro-n-meCNC(=O)c1cc(c 42 1218485 http://www. Alfa Aesar
    4982 4-chloro-o-phc1cc(c(cc1Cl) 72 6993 http://www.aAlfa Aesar
    4983 4-chlorophenoc1cc(ccc1O)Cl 41 13875219 http://www.aAlfa Aesar
    4984 4-chlorophenoc1cc(ccc1OCC 159 24438 http://www.aAlfa Aesar
    4985 4-chlorophenoc1cc(ccc1OCC 47 270915 http://www.aAlfa Aesar
    4986 4-chlorophenyc1cc(ccc1C(=O 30 73214 http://www.aAlfa Aesar
    4987 4-chlorophenyc1cc(ccc1N=C 30 7408 http://www.aAlfa Aesar
    4988 4-chlorophenyc1cc(ccc1N=C= 45 15622 http://www.aAlfa Aesar
    4989 4-chlorophenyCS(=O)(=O)c1c 97 7117 http://www.aAlfa Aesar
    4990 4-chlorophenylc1cc(ccc1CC(= 105 15093 http://www.aAlfa Aesar
    4991 4-chlorophenylc1cc(ccc1CC#N 30 211145 http://www.aAlfa Aesar
    4992 4-chlorophenyC#Cc1ccc(cc1) 45 63306 http://www. Alfa Aesar
    4993 4'-chloroprop CCC(=O)c1ccc( 35 21278 http://www.aAlfa Aesar
    4994 4-chlororesorcc1cc(c(cc1O)O 107 1668 http://www.aAlfa Aesar
    4995 4-chlorostyre C=Cc1ccc(cc1) -16 13465 http://www.aAlfa Aesar
    4996 4-chlorothienoc1cnc(c2c1scc 99 11268986 http://www. Alfa Aesar
    4997 4-chlorothiop c1cc(ccc1S)Cl 50 7527 http://www.aAlfa Aesar
    4998 4-chlorotolue Cc1ccc(cc1)Cl 8 13875160 http://www.aAlfa Aesar
    4999 4'-chlorovale CCCCC(=O)c1cc 31 81878 http://www.aAlfa Aesar
    5000 4-cholesten-3C[C@H](CCCC 80 82602 http://www.aAlfa Aesar
    5001 4-chromanol c1ccc2c(c1)C 40 83854 http://www.aAlfa Aesar
    5002 4-chromanon c1ccc2c(c1)C 38 61418 http://www.aAlfa Aesar
    5003 4-cumylphenoCC(C)(c1ccccc 72 11249 http://www.aAlfa Aesar
    5004 4-cyano-2,2-dCCC(CC)(CCC# 97 68727 http://www. Alfa Aesar
    5005 4-cyano-2-flu c1cc(c(cc1C#N 216 513467 http://www.aAlfa Aesar
    5006 4-cyano-2-flu c1cnc(cc1C#N 32 10175054 http://www. Alfa Aesar
    5007 4-cyano-2-iodc1cnc(cc1C#N) 79 21472622 http://www. Alfa Aesar
    5008 4-cyano-3-iodc1cncc(c1C#N) 121 11632464 http://www. Alfa Aesar
    5009 4-cyano-4-(3- CN1CCC(CC1)( 45 71888 http://www. Alfa Aesar
    5010 4-cyano-4-(4- c1cc(ccc1C2( 93 82901 http://www. Alfa Aesar
    5011 4-cyano-4'-et CCc1ccc(cc1)c 75 84742 http://www.aAlfa Aesar
    5012 4-cyano-4'-n- CCCCCCCc1ccc 31 149039 http://www.aAlfa Aesar
    5013 4-cyano-4'-n- CCCCCCCOc1cc 54 94048 http://www.aAlfa Aesar
    5014 4-cyano-4'-n- CCCCCc1ccc(c 23 83347 http://www.aAlfa Aesar
    5015 4-cyano-4'-n- CCCCCOc1ccc( 48 94047 http://www.aAlfa Aesar
    5016 4-cyano-4''-n-CCCCCc1ccc(cc 129 94527 http://www.aAlfa Aesar
    5017 4-cyano-4'-n- CCCc1ccc(cc1) 65 84743 http://www.aAlfa Aesar
    5018 4-cyano-4-ph c1ccc(cc1)C2 115 82429 http://www.aAlfa Aesar
    5019 4'-cyanoacetan
    CC(=O)Nc1ccc 205 34195 http://www.aAlfa Aesar
    5020 4-cyanobenzac1cc(ccc1C=O 101 59433 http://www.aAlfa Aesar
    5021 4-cyanobenzac1cc(ccc1C#N 227 68899 http://www.aAlfa Aesar
    5022 4-cyanobenzec1cc(ccc1C#N 170 69032 http://www. Alfa Aesar
    5023 4-cyanobenzen
    c1cc(ccc1C#N) 109 36112 http://www.aAlfa Aesar
    5024 4-cyanobenzoc1ccc(cc1)C(= 112 66553 http://www.aAlfa Aesar
    5025 4-cyanobenzoyc1cc(ccc1C#N) 69 72418 http://www.aAlfa Aesar
    5026 4-cyanobiphenc1ccc(cc1)c2c 86 17025 http://www. Alfa Aesar
    5027 4-cyanophenylCCCCc1ccc(cc 68 148739 http://www.aAlfa Aesar
    5028 4-cyanophenylCCCCCCc1ccc( 46 149419 http://www.aAlfa Aesar
    5029 4-cyanophenylCCCc1ccc(cc1 102 512959 http://www.aAlfa Aesar
    5030 4-cyanophenylc1cc(ccc1C#N 120 16660 http://www.aAlfa Aesar
    5031 4-cyanophenylc1cc(ccc1CC( 151 71894 http://www. Alfa Aesar
    5032 4-cyanopyridi c1cnccc1C#N 78 7225 http://www.aAlfa Aesar
    5033 4'-cyclohexyl CC(=O)c1ccc( 68 79134 http://www.aAlfa Aesar
    5034 4-cyclohexylanc1cc(ccc1C2C 54 72918 http://www.aAlfa Aesar
    5035 4-cyclohexylbB(c1ccc(cc1) 220 3781377 http://www.aAlfa Aesar
    5036 4-cyclohexylbc1cc(ccc1C2C 196 79693 http://www.aAlfa Aesar
    5037 4'-diethylam CCN(CC)c1ccc( 48 122147 http://www.aAlfa Aesar
    5038 4-diethylami CCN(CC)c1ccc 40 60462 http://www.aAlfa Aesar
    5039 4-diethylami CCN(CC)c1ccc 96 1415122 http://www.aAlfa Aesar
    5040 4-diethylaminCCN(CC)c1ccc 194 71793 http://www.aAlfa Aesar
    5041 4-diethylaminCCN(CC)c1ccc 67 68618 http://www.aAlfa Aesar
    5042 4-diethylaminCCN(CC)c1ccc 32 127948 http://www.aAlfa Aesar
    5043 4-diethylaminCCN(CC)c1ccc 62 78744 http://www.aAlfa Aesar
    5044 4-dimethylamCN(C)c1ccc(c 59 257043 http://www.aAlfa Aesar
    5045 4-dimethylamiCN(C)c1c(cc(c 249 454868 http://www.aAlfa Aesar
    5046 4-dimethylamCc1ccc(cc1)/N 166 17161 http://www.aAlfa Aesar
    5047 4-dimethylamiCN(C)c1ccc(c 170 74082 http://www.aAlfa Aesar
    5048 4-dimethylamCN(C)c1ccc(c 74 7199 http://www.aAlfa Aesar
    5049 4-dimethylamCN(C)c1ccc(c 175 79407 http://www.aAlfa Aesar
    5050 4-dimethylamiCN(C)c1ccc(c 74 64128 http://www.aAlfa Aesar
    5051 4-dimethylamCN(C)c1ccc(cc 89 10284 http://www.aAlfa Aesar
    5052 4-dimethylamiCN(C)c1ccc(cc 145 3601987 http://www.aAlfa Aesar
    5053 4-dimethylamCN(C)c1ccc(c 141 4447567 http://www.aAlfa Aesar
    5054 4-dimethylamiCN(C)c1ccc(c 67 67599 http://www.aAlfa Aesar
    5055 4-dodecanol CCCCCCCCC(C 11 59670 http://www.aAlfa Aesar
    5056 4-ethoxy-1,1,1CCOC=CC(=O)C -30 2060604 http://www. Alfa Aesar
    5057 4-ethoxy-2,3-dCCOc1ccc(c(c1 202 2049921 http://www. Alfa Aesar
    5058 4-ethoxy-3-m CCOc1ccc(cc1 61 60464 http://www.aAlfa Aesar
    5059 4'-ethoxyacetaCCOc1ccc(cc1 135 4590 http://www.aAlfa Aesar
    5060 4'-ethoxyace CCOc1ccc(cc1 37 65704 http://www.aAlfa Aesar
    5061 4-ethoxybenz CCOc1ccc(cc1 14 21105889 http://www.aAlfa Aesar
    5062 4-ethoxybenzeB(c1ccc(cc1)O 167 2016103 http://www.aAlfa Aesar
    5063 4-ethoxybenz CCOc1ccc(cc1 126 126650 http://www.aAlfa Aesar
    5064 4-ethoxybenzoCCOc1ccc(cc1 198 11596 http://www.aAlfa Aesar
    5065 4-ethoxybenzoCCOc1ccc(cc1 62 124526 http://www.aAlfa Aesar
    5066 4-ethoxybenzyCCOc1ccc(cc1 33 72578 http://www.aAlfa Aesar
    5067 4-ethoxymethy
    CCOC=C1C(=O) 95 25530 http://www.aAlfa Aesar
    5068 4-ethoxyphenCCOc1ccc(cc1 66 11651 http://www.aAlfa Aesar
    5069 4-ethoxyphenyCCOc1ccc(cc1 59 69452 http://www.aAlfa Aesar
    5070 4-ethoxyphenyCCOc1ccc(cc1 89 70988 http://www.aAlfa Aesar
    5071 4-ethyl-2-metCCc1ccc(c(c1 15 56245 http://www.aAlfa Aesar
    5072 4-ethylanilineCCc1ccc(cc1)N -5 21106525 http://www.aAlfa Aesar
    5073 4-ethylbenza CCc1ccc(cc1) 163 5383572 http://www.aAlfa Aesar
    5074 4-ethylbenzenB(c1ccc(cc1)C 152 2016104 http://www.aAlfa Aesar
    5075 4-ethylbenzenCCc1ccc(cc1)S 10 496427 http://www.aAlfa Aesar
    5076 4-ethylbenzoicCCc1ccc(cc1) 113 11589 http://www.aAlfa Aesar
    5077 4-ethylbiphenCCc1ccc(cc1)c 35 72080 http://www.aAlfa Aesar
    5078 4-ethylcatechCCc1ccc(c(c1) 39 63926 http://www.aAlfa Aesar
    5079 4-ethylmorphoCCN1CCOCC1 -63 7244 http://www.aAlfa Aesar
    5080 4-ethylphenolCCc1ccc(cc1) 43 28982 http://www.aAlfa Aesar
    5081 4-ethylphenoxCCc1ccc(cc1) 93 81708 http://www.aAlfa Aesar
    5082 4-ethylpyridinCCc1ccncc1 -91 21106560 http://www.aAlfa Aesar
    5083 4-ethylresorciCCc1ccc(cc1O 97 16931 http://www.aAlfa Aesar
    5084 4-ethyltoluen CCc1ccc(cc1)C -62 11660 http://www.aAlfa Aesar
    5085 4-fluoro-1-napc1ccc2c(c1)c( 225 61726 http://www.aAlfa Aesar
    5086 4-fluoro-2-(t c1cc(c(cc1F)C( 136 526494 http://www.aAlfa Aesar
    5087 4-fluoro-2-(t B(c1ccc(cc1C(F 185 10758447 http://www. Alfa Aesar
    5088 4-fluoro-2-(t c1cc(c(cc1F)C 167 21329543 http://www. Alfa Aesar
    5089 4-fluoro-2-(tr c1cc(c(cc1F)C( 50 2019180 http://www. Alfa Aesar
    5090 4-fluoro-2-(tr c1cc(c(cc1F)C 123 599734 http://www.aAlfa Aesar
    5091 4-fluoro-2-(tr c1cc(c(cc1F)C( 44 525984 http://www.aAlfa Aesar
    5092 4-fluoro-2-(tr c1cc(c(cc1F)C( 56 2019195 http://www.aAlfa Aesar
    5093 4-fluoro-2-(tr c1cc(c(cc1F)C 182 4643147 http://www.aAlfa Aesar
    5094 4-fluoro-2-(tr c1cc(c(cc1F)C( 52 452479 http://www. Alfa Aesar
    5095 4-fluoro-2,3-dCc1c(c(ccc1N) 44 15894583 http://www. Alfa Aesar
    5096 4'-fluoro-2'- CC(=O)c1ccc(c 32 2018968 http://www.aAlfa Aesar
    5097 4'-fluoro-2'- CC(=O)c1ccc( 52 126057 http://www.aAlfa Aesar
    5098 4-fluoro-2-m COc1cc(ccc1C 61 2054933 http://www. Alfa Aesar
    5099 4-fluoro-2-meCOc1cc(ccc1C 135 2054941 http://www. Alfa Aesar
    5100 4-fluoro-2-meCOc1cc(ccc1C 76 2063472 http://www. Alfa Aesar
    5101 4-fluoro-2-meB(c1ccc(cc1C) 200 2016409 http://www.aAlfa Aesar
    5102 4-fluoro-2-meCc1cc(ccc1S(= 181 746519 http://www. Alfa Aesar
    5103 4-fluoro-2-meCc1cc(ccc1C(= 170 3085599 http://www. Alfa Aesar
    5104 4-fluoro-2-meCc1cc(ccc1C# 72 3052247 http://www. Alfa Aesar
    5105 4-fluoro-2-meCc1cc(ccc1O)F 34 120069 http://www.aAlfa Aesar
    5106 4-fluoro-2-meCc1cc(ccc1CC 98 4196106 http://www. Alfa Aesar
    5107 4-fluoro-2-meCc1cc(ccc1CC 26 3090333 http://www. Alfa Aesar
    5108 4-fluoro-2-nit c1cc(c(cc1F)[ 92 61088 http://www.aAlfa Aesar
    5109 4-fluoro-2-nit c1cc(c(cc1F)[ 149 2019057 http://www.aAlfa Aesar
    5110 4-fluoro-2-nit c1cc(c(cc1F)[ 71 2055047 http://www. Alfa Aesar
    5111 4-fluoro-2-ni c1cc(c(cc1F)[ 75 120011 http://www.aAlfa Aesar
    5112 4-fluoro-2-nit Cc1ccc(cc1[N+ 26 61280 http://www.aAlfa Aesar
    5113 4-fluoro-3-(tr c1cc(c(cc1C(= 88 16499468 http://www. Alfa Aesar
    5114 4-fluoro-3-(t c1cc(c(cc1C(=O 85 127255 http://www.aAlfa Aesar
    5115 4-fluoro-3-(t c1cc(c(cc1S(= 162 21329539 http://www. Alfa Aesar
    5116 4-fluoro-3-(tr c1cc(c(cc1C(= 115 455580 http://www.aAlfa Aesar
    5117 4-fluoro-3-(tr c1cc(c(cc1C#N) 68 127256 http://www.aAlfa Aesar
    5118 4-fluoro-3-(t c1ccc(cc1)C(=O 46 2019188 http://www.aAlfa Aesar
    5119 4-fluoro-3-(tr c1cc(c(cc1/C= 143 4643148 http://www.aAlfa Aesar
    5120 4'-fluoro-3'-( CCC(=O)c1ccc( 32 2019249 http://www.aAlfa Aesar
    5121 4-fluoro-3,5-dCc1cc(cc(c1F) 166 13752196 http://www. Alfa Aesar
    5122 4-fluoro-3,5- Cc1cc(cc(c1F) 45 16499399 http://www. Alfa Aesar
    5123 4-fluoro-3-fo B(c1ccc(c(c1) 240 2058900 http://www.aAlfa Aesar
    5124 4-fluoro-3-hy c1cc(c(cc1C(= 216 516051 http://www.aAlfa Aesar
    5125 4'-fluoro-3'- CC(=O)c1ccc(c 52 2054928 http://www.aAlfa Aesar
    5126 4-fluoro-3-m COc1cc(ccc1F 62 2019000 http://www.aAlfa Aesar
    5127 4-fluoro-3-meCOc1cc(ccc1F 207 520204 http://www.aAlfa Aesar
    5128 4-fluoro-3-meCOc1cc(ccc1F 109 2019007 http://www.aAlfa Aesar
    5129 4-fluoro-3-meCOc1cc(ccc1F 49 516011 http://www. Alfa Aesar
    5130 4-fluoro-3-metCc1cc(ccc1F)N 34 61296 http://www.aAlfa Aesar
    5131 4-fluoro-3-meB(c1ccc(c(c1) 210 2054975 http://www.aAlfa Aesar
    5132 4-fluoro-3-meCc1cc(ccc1F)C 167 212274 http://www.aAlfa Aesar
    5133 4-fluoro-3-meCc1cc(ccc1F) 55 2059416 http://www. Alfa Aesar
    5134 4-fluoro-3-meCc1cc(ccc1F)O 30 2019036 http://www.aAlfa Aesar
    5135 4-fluoro-3-meCc1cc(ccc1F) 106 21379244 http://www. Alfa Aesar
    5136 4-fluoro-3-nit c1c(cc(c(c1C(F 122 21885716 http://www. Alfa Aesar
    5137 4'-fluoro-3'- CC(=O)c1ccc(c 48 2016357 http://www.aAlfa Aesar
    5138 4-fluoro-3-nit c1cc(c(cc1N)[ 96 61087 http://www.aAlfa Aesar
    5139 4-fluoro-3-ni c1cc(c(cc1C=O 46 519930 http://www. Alfa Aesar
    5140 4-fluoro-3-nit c1cc(c(cc1C(= 124 61302 http://www.aAlfa Aesar
    5141 4-fluoro-3-nit c1cc(c(cc1C#N 92 2055048 http://www. Alfa Aesar
    5142 4'-fluoroacetaCC(=O)Nc1ccc( 152 9225 http://www.aAlfa Aesar
    5143 4'-fluoroacet CC(=O)c1ccc(c 4 21112023 http://www.aAlfa Aesar
    5144 4-fluoro-alphac1cc(ccc1CS(= 60 2039861 http://www. Alfa Aesar
    5145 4-fluoroanilin c1cc(ccc1N)F -2 9349 http://www.aAlfa Aesar
    5146 4-fluoroanisolCOc1ccc(cc1)F -45 13875196 http://www.aAlfa Aesar
    5147 4-fluorobenzac1cc(ccc1C=O) -10 13854995 http://www.aAlfa Aesar
    5148 4-fluorobenz c1cc(ccc1C(=O 156 64644 http://www.aAlfa Aesar
    5149 4-fluorobenzeB(c1ccc(cc1)F 263 251786 http://www.aAlfa Aesar
    5150 4-fluorobenzec1cc(ccc1F)S( 37 9212 http://www.aAlfa Aesar
    5151 4-fluorobenzhc1cc(ccc1C(= 164 9578 http://www. Alfa Aesar
    5152 4-fluorobenzoic1cc(ccc1C(=O 185 9579 http://www.aAlfa Aesar
    5153 4-fluorobenzon
    c1cc(ccc1C#N) 36 13861 http://www.aAlfa Aesar
    5154 4-fluorobenz c1ccc(cc1)C(= 47 60982 http://www.aAlfa Aesar
    5155 4-fluorobenzotc1cc(ccc1C(F)( -42 61190 http://www.aAlfa Aesar
    5156 4-fluorobenzoy
    c1cc(ccc1C(=O 10 61196 http://www.aAlfa Aesar
    5157 4-fluorobenzylc1cc(ccc1CO)F 23 61337 http://www.aAlfa Aesar
    5158 4-fluorobenzylc1cc(ccc1CCl) -18 9226 http://www.aAlfa Aesar
    5159 4-fluorobiphec1ccc(cc1)c2c 74 9089 http://www.aAlfa Aesar
    5160 4'-fluorobuty CCCC(=O)c1ccc 37 61773 http://www. Alfa Aesar
    5161 4-fluorocinna c1cc(ccc1/C=C 209 1255136 http://www.aAlfa Aesar
    5162 4-fluoromandec1cc(ccc1C(C( 136 88541 http://www.aAlfa Aesar
    5163 4-fluoronaphtc1ccc2c(c1)c( 90 2018391 http://www.aAlfa Aesar
    5164 4-fluorophenoc1cc(ccc1O)F 46 9350 http://www.aAlfa Aesar
    5165 4-fluorophenoc1cc(ccc1OCC 105 61199 http://www.aAlfa Aesar
    5166 4-fluorophenoc1cc(ccc1OCC 125 642988 http://www.aAlfa Aesar
    5167 4-fluorophenylc1cc(sc1)C(=O 97 61754 http://www.aAlfa Aesar
    5168 4-fluorophenyc1cc(ccc1N=C 26 14507 http://www.aAlfa Aesar
    5169 4-fluorophenyCS(=O)(=O)c1c 79 61309 http://www.aAlfa Aesar
    5170 4-fluorophenylc1cc(ccc1CC(= 83 9454 http://www.aAlfa Aesar
    5171 4-fluorophenyC#Cc1ccc(cc1) 28 455890 http://www. Alfa Aesar
    5172 4-fluorophenylc1cc(ccc1F)S( 91 491780 http://www.aAlfa Aesar
    5173 4-fluorophthalc1cc(c(cc1F)C 156 14575 http://www. Alfa Aesar
    5174 4-fluorophthalc1cc(c(cc1F)C 101 93377 http://www.aAlfa Aesar
    5175 4-fluorosalicy c1cc(c(cc1F)O 71 2059503 http://www. Alfa Aesar
    5176 4-fluorosalicylc1cc(c(cc1F)O 188 60980 http://www.aAlfa Aesar
    5177 4-fluorostyre C=Cc1ccc(cc1) -36 61200 http://www.aAlfa Aesar
    5178 4-fluorotolue Cc1ccc(cc1)F -56 13875283 http://www.aAlfa Aesar
    5179 4'-fluorovale CCCCC(=O)c1c 27 62929 http://www.aAlfa Aesar
    5180 4-formyl-3-(t B(c1ccc(c(c1) 201 21431590 http://www. Alfa Aesar
    5181 4-formylbenzeB(c1ccc(cc1)C 263 513834 http://www.aAlfa Aesar
    5182 4-formylmorpC1COCCN1C= 22 19231 http://www.aAlfa Aesar
    5183 4-formylphenoc1cc(ccc1C=O 196 80473 http://www.aAlfa Aesar
    5184 4-heptadecanCCCCCCCCCCC 40 89116 http://www.aAlfa Aesar
    5185 4-heptanone CCCC(=O)CCC -33 28986 http://www.aAlfa Aesar
    5186 4-hydroxy-1h-c1cc2c(c(c1)O 222 10607767 http://www. Alfa Aesar
    5187 4-hydroxy-1-mCN1CCC(CC1) 28 59438 http://www.aAlfa Aesar
    5188 4-hydroxy-1-pc1ccc(cc1)n2c 306 10498318 http://www.aAlfa Aesar
    5189 4-hydroxy-2-(tc1cc(c(cc1O)C 160 2055483 http://www. Alfa Aesar
    5190 4-hydroxy-2-(tc1cc(c(cc1O)C 122 2063296 http://www. Alfa Aesar
    5191 4-hydroxy-2-( c1cnc(nc1O)C( 170 212958 http://www.aAlfa Aesar
    5192 4-hydroxy-2-(tc1ccc2c(c1)c(c 210 278289 http://www.aAlfa Aesar
    5193 4-hydroxy-2,2CC1(CC(CC(N1 131 68000 http://www.aAlfa Aesar
    5194 4-hydroxy-2,3,c1(c(c(c(c(c1F 149 89267 http://www.aAlfa Aesar
    5195 4-hydroxy-2- COc1cc(ccc1C 158 453181 http://www.aAlfa Aesar
    5196 4-hydroxy-2-mCc1cc(c2cccc 235 62307 http://www.aAlfa Aesar
    5197 4-hydroxy-2-mCSc1nc(cc(n1) 178 217181 http://www. Alfa Aesar
    5198 4-hydroxy-3-( c1cc(c(cc1C=O 78 5381040 http://www. Alfa Aesar
    5199 4'-hydroxy-3' CC(=O)c1ccc(c 176 2055481 http://www. Alfa Aesar
    5200 4-hydroxy-3-( c1cc(c(cc1C=O 161 5384498 http://www. Alfa Aesar
    5201 4-hydroxy-3-(tc1cc(c(cc1C(= 146 2055484 http://www. Alfa Aesar
    5202 4-hydroxy-3-(tc1cc(c(cc1C#N 173 2063302 http://www. Alfa Aesar
    5203 4-hydroxy-3,5COc1cc(cc(c1 131 10288 http://www.aAlfa Aesar
    5204 4-hydroxy-3,5Cc1cc(cc(c1O 114 67767 http://www.aAlfa Aesar
    5205 4-hydroxy-3,5Cc1cc(cc(c1O) 224 122010 http://www.aAlfa Aesar
    5206 4'-hydroxy-3 CC(=O)c1ccc(c 114 21106900 http://www.aAlfa Aesar
    5207 4-hydroxy-3-mCOc1cc(ccc1O 87 70511 http://www.aAlfa Aesar
    5208 4-hydroxy-3-mCOc1cc(ccc1O 114 56139 http://www.aAlfa Aesar
    5209 4'-hydroxy-3' Cc1cc(ccc1O) 108 63323 http://www.aAlfa Aesar
    5210 4'-hydroxy-3' CC(=O)c1ccc(c 132 122334 http://www.aAlfa Aesar
    5211 4-hydroxy-3-nc1cc(c(cc1C=O 142 17162 http://www.aAlfa Aesar
    5212 4-hydroxy-3-nc1cc(c(cc1C(= 183 11538 http://www.aAlfa Aesar
    5213 4-hydroxy-3-nc1ccc(cc1)c2c 67 12872 http://www.aAlfa Aesar
    5214 4-hydroxy-3-nic1cc(c(cc1CC( 147 394490 http://www.aAlfa Aesar
    5215 4-hydroxy-4'- c1cc(ccc1c2cc 118 1554684 http://www.aAlfa Aesar
    5216 4-hydroxy-4- CC(=O)CC(C)( -47 13838151 http://www.aAlfa Aesar
    5217 4-hydroxy-4'-nc1cc(ccc1/C=C 207 663932 http://www.aAlfa Aesar
    5218 4-hydroxy-6-(tc1c(nc(nc1O)S 251 1041321 http://www.aAlfa Aesar
    5219 4-hydroxy-6-(tc1cc2c(cc1C(F 267 2055506 http://www.aAlfa Aesar
    5220 4-hydroxy-6-mCc1ccc2c(c1)c( 253 2055461 http://www.aAlfa Aesar
    5221 4'-hydroxy-6- Cc1ccc2c(c1)c 241 1323659 http://www. Alfa Aesar
    5222 4-hydroxy-8-(tc1cc2c(ccnc2c 172 81486 http://www.aAlfa Aesar
    5223 4-hydroxy-8-mCc1cccc2c1nc( 128 2055462 http://www.aAlfa Aesar
    5224 4'-hydroxyac CC(=O)c1ccc(c 107 7189 http://www.aAlfa Aesar
    5225 4-hydroxybenc1cc(ccc1C=O 117 123 http://www.aAlfa Aesar
    5226 4-hydroxybenc1cc(ccc1C(= 161 58563 http://www.aAlfa Aesar
    5227 4-hydroxybenzc1cc(ccc1C(= 215 132 http://www.aAlfa Aesar
    5228 4-hydroxybenzc1cc(ccc1C#N 112 12478 http://www.aAlfa Aesar
    5229 4-hydroxybenc1ccc(cc1)C(= 134 13708 http://www.aAlfa Aesar
    5230 4-hydroxybenzc1cc(ccc1CO) 118 122 http://www.aAlfa Aesar
    5231 4-hydroxybenzc1cc(ccc1C=C 189 83923 http://www.aAlfa Aesar
    5232 4'-hydroxybiphc1cc(ccc1C#N) 198 124015 http://www.aAlfa Aesar
    5233 4'-hydroxybiphc1cc(ccc1c2cc 294 266505 http://www.aAlfa Aesar
    5234 4-hydroxybutyC=CC(=O)OCC -112 68112 http://www.aAlfa Aesar
    5235 4-hydroxybutyC(CC(=O)NN) 93 191387 http://www.aAlfa Aesar
    5236 4'-hydroxychac1ccc(cc1)/C= 176 4445525 http://www.aAlfa Aesar
    5237 4-hydroxycha c1ccc(cc1)C(= 184 4445524 http://www.aAlfa Aesar
    5238 4-hydroxydip c1ccc(cc1)Nc2 69 21111849 http://www.aAlfa Aesar
    5239 4'-hydroxyfla c1ccc2c(c1)C( 182 145054 http://www.aAlfa Aesar
    5240 4-hydroxyindoc1cc2c(cc[nH] 98 67953 http://www.aAlfa Aesar
    5241 4-hydroxymeth
    CC1(CN(NC1=O 125 83275 http://www.aAlfa Aesar
    5242 4-hydroxyphen
    c1cc(ccc1O)O 156 15094 http://www.aAlfa Aesar
    5243 4-hydroxyphen
    c1ccc(cc1)C(= 166 68074 http://www.aAlfa Aesar
    5244 4-hydroxyphec1cc(ccc1CC( 174 78467 http://www.aAlfa Aesar
    5245 4-hydroxyphen
    c1cc(ccc1CC( 149 124 http://www.aAlfa Aesar
    5246 4-hydroxyphen
    c1cc(ccc1CC# 69 24729 http://www.aAlfa Aesar
    5247 4-hydroxypipeC1CNCCC1O 88 71661 http://www.aAlfa Aesar
    5248 4'-hydroxypr CCC(=O)c1ccc 150 6035 http://www.aAlfa Aesar
    5249 4-hydroxypyric1cnccc1O 145 11787 http://www.aAlfa Aesar
    5250 4-hydroxyquinc1ccc2c(c1)c( 218 56797 http://www.aAlfa Aesar
    5251 4-hydroxyquinc1ccc2c(c1)c( 203 62357 http://www.aAlfa Aesar
    5252 4-iodo-2-methCc1cc(ccc1N)I 86 75086 http://www.aAlfa Aesar
    5253 4-iodo-2-nitroCOc1ccc(cc1[N 97 21242193 http://www.aAlfa Aesar
    5254 4-iodo-2-nitr Cc1ccc(cc1[N+ 60 149052 http://www.aAlfa Aesar
    5255 4-iodo-3-nitroCOc1ccc(c(c1) 62 258259 http://www.aAlfa Aesar
    5256 4-iodo-3-nitroc1cc(c(cc1C(= 210 9383660 http://www.aAlfa Aesar
    5257 4'-iodoaceto CC(=O)c1ccc(c 83 65701 http://www.aAlfa Aesar
    5258 4-iodoaniline c1cc(ccc1N)I 63 10431 http://www.aAlfa Aesar
    5259 4-iodoanisole COc1ccc(cc1)I 50 62877 http://www.aAlfa Aesar
    5260 4-iodobenzal c1cc(ccc1C=O) 77 87265 http://www.aAlfa Aesar
    5261 4-iodobenzenec1cc(ccc1S(=O) 82 7121 http://www.aAlfa Aesar
    5262 4-iodobenzonit
    c1cc(ccc1C#N) 126 68939 http://www.aAlfa Aesar
    5263 4-iodobenzotrc1cc(ccc1C(F)( -8 61308 http://www.aAlfa Aesar
    5264 4-iodobenzoylc1cc(ccc1C(=O) 63 66966 http://www.aAlfa Aesar
    5265 4-iodobenzyl c1cc(ccc1CO)I 73 26989 http://www.aAlfa Aesar
    5266 4-iodobenzyl c1cc(ccc1CBr)I 80 829436 http://www.aAlfa Aesar
    5267 4-iodobenzyl c1cc(ccc1CN)I 47 2019165 http://www.aAlfa Aesar
    5268 4-iodobiphenyc1ccc(cc1)c2cc 112 14585 http://www. Alfa Aesar
    5269 4-iodophenet CCOc1ccc(cc1) 28 191427 http://www.aAlfa Aesar
    5270 4-iodophenol c1cc(ccc1O)I 93 10432 http://www.aAlfa Aesar
    5271 4-iodophenoxyc1cc(ccc1OCC( 157 67233 http://www.aAlfa Aesar
    5272 4-iodophenyl c1cc(ccc1N=C 45 2644191 http://www.aAlfa Aesar
    5273 4-iodophenyl c1cc(ccc1N=C= 76 67499 http://www.aAlfa Aesar
    5274 4-iodophenylac1cc(ccc1CC(= 138 120914 http://www.aAlfa Aesar
    5275 4-iodophenylac1cc(ccc1CC#N 53 126037 http://www.aAlfa Aesar
    5276 4-iodophenylhc1cc(ccc1NN)I 101 614255 http://www.aAlfa Aesar
    5277 4-iodopyridin c1cnccc1I 98 529817 http://www.aAlfa Aesar
    5278 4-iodotolueneCc1ccc(cc1)I 34 11707 http://www.aAlfa Aesar
    5279 4-isobutyl-al CC(C)Cc1ccc(c 77 3544 http://www.aAlfa Aesar
    5280 4-isopropoxybCC(C)Oc1ccc(c 33 11346343 http://www.aAlfa Aesar
    5281 4-isopropoxybCC(C)Oc1ccc( 165 65786 http://www.aAlfa Aesar
    5282 4'-isopropylacCC(C)c1ccc(cc 104 226399 http://www.aAlfa Aesar
    5283 4-isopropylaniCC(C)c1ccc(cc -63 13853758 http://www.aAlfa Aesar
    5284 4-isopropylbeB(c1ccc(cc1)C 143 2053896 http://www.aAlfa Aesar
    5285 4-isopropylbeCC(C)c1ccc(cc 105 202472 http://www. Alfa Aesar
    5286 4-isopropylbenCC(C)c1ccc(cc 119 10363 http://www.aAlfa Aesar
    5287 4-isopropylbenCC(C)c1ccc(cc 27 21105932 http://www.aAlfa Aesar
    5288 4-isopropyl-beCC(C)c1ccc(cc 37 4643171 http://www.aAlfa Aesar
    5289 4-isopropylbi CC(C)c1ccc(cc 11 21974 http://www.aAlfa Aesar
    5290 4-isopropylphCC(C)c1ccc(cc 60 7185 http://www.aAlfa Aesar
    5291 4-isopropylphCC(C)c1ccc(c 86 120834 http://www.aAlfa Aesar
    5292 4-isopropylpheCC(C)c1ccc(cc 52 70605 http://www.aAlfa Aesar
    5293 4-mercaptophe
    c1cc(ccc1CC(= 107 2635348 http://www. Alfa Aesar
    5294 4-methoxy-1- COc1ccc(c2c1 34 76852 http://www.aAlfa Aesar
    5295 4-methoxy-1- COc1ccc(c2c1 129 59913 http://www.aAlfa Aesar
    5296 4-methoxy-1-nCOc1ccc(c2c1 102 72315 http://www.aAlfa Aesar
    5297 4-methoxy-2-(COc1ccc(c(c1) 32 16499403 http://www. Alfa Aesar
    5298 4-methoxy-2-(COc1ccc(c(c1) 40 2058544 http://www. Alfa Aesar
    5299 4-methoxy-2-(B(c1ccc(cc1C( 170 10758277 http://www. Alfa Aesar
    5300 4-methoxy-2-(COc1ccc(c(c1) 149 2055660 http://www. Alfa Aesar
    5301 4-methoxy-2,3Cc1cc(c(c(c1S 58 489229 http://www.aAlfa Aesar
    5302 4-methoxy-2-m
    Cc1cc(ccc1N) 14 21106028 http://www.aAlfa Aesar
    5303 4-methoxy-2- B(c1ccc(cc1C) 191 2053902 http://www.aAlfa Aesar
    5304 4-methoxy-2-m
    Cc1cc(ccc1C( 179 519163 http://www. Alfa Aesar
    5305 4'-methoxy-2'-CC(=O)Nc1ccc( 118 60425 http://www.aAlfa Aesar
    5306 4-methoxy-2-nCOc1ccc(c(c1) 127 60158 http://www.aAlfa Aesar
    5307 4-methoxy-2-nCOc1ccc(c(c1) 79 14550 http://www.aAlfa Aesar
    5308 4-methoxy-2-nCOc1ccc(c(c1) 92 124376 http://www.aAlfa Aesar
    5309 4-methoxy-2-qCOc1cc(nc2c1 197 516897 http://www.aAlfa Aesar
    5310 4-methoxy-3-(COc1ccc(cc1C( 59 522251 http://www.aAlfa Aesar
    5311 4-methoxy-3-(COc1ccc(cc1C( 39 2055657 http://www. Alfa Aesar
    5312 4-methoxy-3-(COc1ccc(cc1C( 170 2055661 http://www.aAlfa Aesar
    5313 4-methoxy-3-(COc1ccc(cc1C( 99 2055662 http://www.aAlfa Aesar
    5314 4-methoxy-3-(COc1ccc(cc1C( 77 2055668 http://www. Alfa Aesar
    5315 4-methoxy-3,5Cc1cc(cc(c1OC 64 3377714 http://www. Alfa Aesar
    5316 4-methoxy-3,5B(c1cc(c(c(c1 237 3044181 http://www.aAlfa Aesar
    5317 4-methoxy-3- B(c1ccc(c(c1) 215 2053903 http://www.aAlfa Aesar
    5318 4'-methoxy-3'CC(=O)c1ccc(c 98 72679 http://www.aAlfa Aesar
    5319 4-methoxy-3- COc1ccc(cc1[N 99 610566 http://www.aAlfa Aesar
    5320 4-methoxy-3- COc1ccc(cc1[N 175 74544 http://www.aAlfa Aesar
    5321 4-methoxy-3-nCOc1ccc(cc1[N 188 60007 http://www.aAlfa Aesar
    5322 4-methoxy-3-nCOc1ccc(cc1[N 48 87352 http://www.aAlfa Aesar
    5323 4-methoxy-3-pCOC1=CC(=O) 132 499755 http://www.aAlfa Aesar
    5324 4-methoxy-4' COc1ccc(cc1)C 126 308615 http://www.aAlfa Aesar
    5325 4'-methoxyaceCC(=O)Nc1ccc 127 5622 http://www.aAlfa Aesar
    5326 4'-methoxyac CC(=O)c1ccc( 38 13835344 http://www.aAlfa Aesar
    5327 4-methoxybenCOc1ccc(cc1) 1 21105937 http://www.aAlfa Aesar
    5328 4-methoxybenCOc1ccc(cc1) 166 10256859 http://www.aAlfa Aesar
    5329 4-methoxybenB(c1ccc(cc1)O 205 174258 http://www.aAlfa Aesar
    5330 4-methoxybenCOc1ccc(cc1) 112 63954 http://www.aAlfa Aesar
    5331 4-methoxybenz
    COc1ccc(cc1)S 40 7123 http://www.aAlfa Aesar
    5332 4-methoxybenCOc1ccc(cc1) 138 69248 http://www.aAlfa Aesar
    5333 4-methoxybenCOc1ccc(cc1)C 67 86072 http://www.aAlfa Aesar
    5334 4-methoxybenz
    COc1ccc(cc1) 184 10181338 http://www.aAlfa Aesar
    5335 4-methoxybenCOc1ccc(cc1) 97 63122 http://www.aAlfa Aesar
    5336 4-methoxybenz
    COc1ccc(cc1) 59 21112332 http://www.aAlfa Aesar
    5337 4-methoxybe COc1ccc(cc1)C 62 62361 http://www.aAlfa Aesar
    5338 4-methoxybenz
    COc1ccc(cc1)C 22 21106136 http://www.aAlfa Aesar
    5339 4-methoxybenz
    COc1ccc(cc1) 128 203494 http://www.aAlfa Aesar
    5340 4-methoxybenz
    COc1ccc(cc1) 24 21105859 http://www.aAlfa Aesar
    5341 4-methoxybenz
    COc1ccc(cc1) 76 79254 http://www.aAlfa Aesar
    5342 4-methoxybenCOc1ccc(cc1) -10 67982 http://www.aAlfa Aesar
    5343 4-methoxybipCOc1ccc(cc1)c 88 11449 http://www.aAlfa Aesar
    5344 4'-methoxybipCOc1ccc(cc1)c 103 2073641 http://www. Alfa Aesar
    5345 4'-methoxychCOc1ccc(cc1) 102 557050 http://www.aAlfa Aesar
    5346 4-methoxychaCOc1ccc(cc1) 75 557051 http://www.aAlfa Aesar
    5347 4-methoxycouCOc1cc(=O)oc 124 461399 http://www.aAlfa Aesar
    5348 4-methoxyindCOc1cccc2c1c 70 121988 http://www.aAlfa Aesar
    5349 4-methoxyman
    COc1ccc(cc1) 107 100467 http://www.aAlfa Aesar
    5350 4-methoxypheCOc1ccc(cc1) 57 8665 http://www.aAlfa Aesar
    5351 4-methoxyphen
    COc1ccc(cc1) 111 67224 http://www.aAlfa Aesar
    5352 4-methoxyphen
    COc1ccc(cc1) 19 67835 http://www.aAlfa Aesar
    5353 4-methoxypheCOc1ccc(cc1) 186 211415 http://www.aAlfa Aesar
    5354 4-methoxyphen
    COc1ccc(cc1) 87 7406 http://www.aAlfa Aesar
    5355 4-methoxyphen
    COc1ccc(cc1) 8 59422 http://www.aAlfa Aesar
    5356 4-methoxypheCOc1ccc(cc1) 28 219872 http://www. Alfa Aesar
    5357 4'-methoxypr CCC(=O)c1ccc 28 60489 http://www.aAlfa Aesar
    5358 4-methoxypyrCOc1ccncc1 4 62489 http://www.aAlfa Aesar
    5359 4-methoxypyriCOc1cc[n+](cc 102 63908 http://www.aAlfa Aesar
    5360 4-methoxystilCOc1ccc(cc1)/ 137 1046312 http://www.aAlfa Aesar
    5361 4-methoxytrityCOc1ccc(cc1)C 123 76191 http://www.aAlfa Aesar
    5362 4-methyl-1,10Cc1ccnc2c1cc 145 84094 http://www.aAlfa Aesar
    5363 4-methyl-1,2,3Cc1c(snn1)C( 185 1155566 http://www.aAlfa Aesar
    5364 4-methyl-1h-pCc1c[nH]nc1 13 3289 http://www.aAlfa Aesar
    5365 4-methyl-1-p CC(C)CC=C -153 12201 http://www.aAlfa Aesar
    5366 4-methyl-1-peB(C=CCC(C)C) 101 3569775 http://www. Alfa Aesar
    5367 4-methyl-2-(2-Cc1c(sc(n1)c2 226 186284 http://www. Alfa Aesar
    5368 4-methyl-2-(3-Cc1c(sc(n1)c2 246 2044175 http://www. Alfa Aesar
    5369 4-methyl-2-(4-Cc1c(sc(n1)c2 305 1224783 http://www. Alfa Aesar
    5370 4-methyl-2-(trCc1ccc(c(c1)C 25 2055930 http://www. Alfa Aesar
    5371 4-methyl-2,3, Cc1c(c(c(c(c1F 42 2058624 http://www.aAlfa Aesar
    5372 4-methyl-2h-1CN1c2ccccc2 59 80337 http://www. Alfa Aesar
    5373 4-methyl-2-nitCc1ccc(c(c1)[ 117 6712 http://www.aAlfa Aesar
    5374 4-methyl-2-nitCc1ccc(c(c1)[ 97 86875 http://www.aAlfa Aesar
    5375 4-methyl-2-niCc1ccc(c(c1)[ 34 8086 http://www.aAlfa Aesar
    5376 4-methyl-2-niCc1ccc(c(c1)[ 65 123691 http://www.aAlfa Aesar
    5377 4-methyl-2-p CC(C)CC(=O)C -84 7621 http://www.aAlfa Aesar
    5378 4-methyl-2-phe
    Cc1c(nn(n1)c2 203 453522 http://www.aAlfa Aesar
    5379 4-methyl-2-phCc1c[nH]c(n1) 175 63204 http://www.aAlfa Aesar
    5380 4-methyl-3-(trCc1ccc(cc1C(F 177 2055925 http://www.aAlfa Aesar
    5381 4-methyl-3-(trCc1ccc(cc1C(F 61 2055931 http://www.aAlfa Aesar
    5382 4'-methyl-3'- Cc1ccc(cc1[N+ 60 71571 http://www.aAlfa Aesar
    5383 4-methyl-3-nitCc1ccc(cc1[N+ 77 8085 http://www.aAlfa Aesar
    5384 4-methyl-3-niCc1ccc(cc1[N+ 46 1408587 http://www.aAlfa Aesar
    5385 4-methyl-3-niCc1ccc(cc1[N+ 166 79299 http://www.aAlfa Aesar
    5386 4-methyl-3-niB(c1ccc(c(c1) 250 2053931 http://www.aAlfa Aesar
    5387 4-methyl-3-niCc1ccc(cc1[N+ 143 73433 http://www. Alfa Aesar
    5388 4-methyl-3-niCc1ccc(cc1[N+ 35 487382 http://www.aAlfa Aesar
    5389 4-methyl-3-niCc1ccc(cc1[N+ 189 7043 http://www.aAlfa Aesar
    5390 4-methyl-3-nitCc1ccc(cc1[N+ 106 512297 http://www.aAlfa Aesar
    5391 4-methyl-3-niCc1ccc(cc1[N+ 79 15439 http://www.aAlfa Aesar
    5392 4-methyl-3-niCc1ccc(cc1[N 51 65913 http://www.aAlfa Aesar
    5393 4-methyl-3-niCc1ccncc1[N+] 20 455192 http://www.aAlfa Aesar
    5394 4-methyl-3-thCNC(=S)NN 137 2006040 http://www.aAlfa Aesar
    5395 4-methyl-5-vinCc1c(scn1)C= -15 14889 http://www.aAlfa Aesar
    5396 4'-methylacetCc1ccc(cc1)N 149 10243171 http://www.aAlfa Aesar
    5397 4'-methylace Cc1ccc(cc1)C( -19 8186 http://www.aAlfa Aesar
    5398 4-methylanisoCc1ccc(cc1)O -50 13865438 http://www.aAlfa Aesar
    5399 4-methylbenzeB(c1ccc(cc1)C 250 72092 http://www.aAlfa Aesar
    5400 4-methylbenzCc1ccc(cc1)C( 52 86074 http://www.aAlfa Aesar
    5401 4-methylbenzCc1ccc(cc1)C( 55 8330 http://www.aAlfa Aesar
    5402 4-methylbenzyCc1ccc(cc1)C 59 11021 http://www.aAlfa Aesar
    5403 4-methylbenzCc1ccc(cc1)CB 35 7435 http://www.aAlfa Aesar
    5404 4-methylbenzyCc1ccc(cc1)CC 5 21111850 http://www.aAlfa Aesar
    5405 4-methylbenzCc1ccc(cc1)CN 12 59426 http://www.aAlfa Aesar
    5406 4-methylbipheCc1ccc(cc1)c2 46 12047 http://www.aAlfa Aesar
    5407 4-methylcatecCc1ccc(c(c1)O 68 9564 http://www.aAlfa Aesar
    5408 4-methylcycl CC1CCC(=O)C -41 11041 http://www.aAlfa Aesar
    5409 4-methylimidaCc1c[nH]cn1 51 12640 http://www.aAlfa Aesar
    5410 4-methylmorpCN1CCOCC1 -65 7684 http://www.aAlfa Aesar
    5411 4-methylpheno
    Cc1ccc(cc1)O 140 63512 http://www.aAlfa Aesar
    5412 4-methylpheno
    Cc1ccc(cc1)O 43 454152 http://www.aAlfa Aesar
    5413 4-methylpiperCC1CCNCC1 5 62589 http://www.aAlfa Aesar
    5414 4'-methylpro CCC(=O)c1ccc( 7 20140 http://www.aAlfa Aesar
    5415 4-methylsalicyCc1ccc(c(c1)O 178 5584 http://www.aAlfa Aesar
    5416 4-methylstyreCc1ccc(cc1)C= -34 11661 http://www.aAlfa Aesar
    5417 4-methylsulfoCc1ccc(cc1[N+ 121 598731 http://www.aAlfa Aesar
    5418 4-methylthio-3CSc1ccc(cc1C( 57 10655386 http://www. Alfa Aesar
    5419 4-methylthiomCN1CCS(=O)(= 86 82544 http://www.aAlfa Aesar
    5420 4-methylumbel
    Cc1cc(=O)oc2c 189 4444190 http://www.aAlfa Aesar
    5421 4-methylumbel
    Cc1cc(=O)oc2 150 359 http://www.aAlfa Aesar
    5422 4-methylvaleriCC(C)CCC(=O) -35 12067 http://www.aAlfa Aesar
    5423 4-morpholinepC1COCCN1CC 21 70670 http://www.aAlfa Aesar
    5424 4-n-butyl-4'- CCCCc1ccc(cc1 50 94148 http://www.aAlfa Aesar
    5425 4-n-butylanili CCCCc1ccc(cc -14 21106519 http://www.aAlfa Aesar
    5426 4-n-butylbenzCCCCc1ccc(cc -43 64149 http://www.aAlfa Aesar
    5427 4-n-butylben CCCCc1ccc(cc 128 2080170 http://www.aAlfa Aesar
    5428 4-n-butylbenzB(c1ccc(cc1)C 105 3314840 http://www.aAlfa Aesar
    5429 4-n-butylben CCCCc1ccc(cc 94 1548811 http://www.aAlfa Aesar
    5430 4-n-butylbenzCCCCc1ccc(cc1 14 2018994 http://www.aAlfa Aesar
    5431 4-n-butylbenzo
    CCCCc1ccc(cc 107 79969 http://www.aAlfa Aesar
    5432 4-n-butylbiph CCCCc1ccc(cc1 7 2055605 http://www.aAlfa Aesar
    5433 4-n-butylphenCCCCc1ccc(cc 22 14678 http://www.aAlfa Aesar
    5434 4-n-decylanili CCCCCCCCCCc1 24 83338 http://www.aAlfa Aesar
    5435 4-n-decylbiphCCCCCCCCCCc1 53 2080316 http://www.aAlfa Aesar
    5436 4-n-decyloxybCCCCCCCCCCOc 97 122145 http://www.aAlfa Aesar
    5437 4-n-dodecylo CCCCCCCCCCC 28 124433 http://www.aAlfa Aesar
    5438 4-n-dodecyloxCCCCCCCCCCCC 135 67867 http://www.aAlfa Aesar
    5439 4-n-heptylbenCCCCCCCc1ccc 102 148691 http://www.aAlfa Aesar
    5440 4-n-heptylbip CCCCCCCc1ccc 27 97836 http://www.aAlfa Aesar
    5441 4-n-heptyloxyCCCCCCCOc1cc 45 125610 http://www.aAlfa Aesar
    5442 4-n-heptyloxyCCCCCCCOc1cc 93 76800 http://www.aAlfa Aesar
    5443 4-n-heptylpheCCCCCCCc1ccc 27 15327 http://www.aAlfa Aesar
    5444 4-n-hexadecylCCCCCCCCCCC 60 122630 http://www.aAlfa Aesar
    5445 4-n-hexylbiphCCCCCCc1ccc( 30 97835 http://www.aAlfa Aesar
    5446 4'-n-hexylbiphCCCCCCc1ccc( 223 11619957 http://www.aAlfa Aesar
    5447 4-n-hexyloxybCCCCCCOc1ccc 104 63998 http://www.aAlfa Aesar
    5448 4-n-hexyloxypCCCCCCOc1ccc 46 27298 http://www.aAlfa Aesar
    5449 4-n-hexylresorCCCCCCc1ccc( 66 21106121 http://www.aAlfa Aesar
    5450 4-nitro-1h-pyrc1c(cn[nH]1)[ 161 15531 http://www. Alfa Aesar
    5451 4-nitro-1-nap c1ccc2c(c1)c( 166 304821 http://www.aAlfa Aesar
    5452 4'-nitro-2'-(t CC(=O)Nc1ccc( 148 470605 http://www. Alfa Aesar
    5453 4-nitro-2-(tri c1cc(c(cc1[N+] 92 60475 http://www.aAlfa Aesar
    5454 4-nitro-2-(tri c1cc(c(cc1[N+ 52 2056113 http://www.aAlfa Aesar
    5455 4-nitro-2-picoCc1cc(cc[n+]1 156 85988 http://www.aAlfa Aesar
    5456 4-nitro-3-(tri c1cc(c(cc1N)C( 127 85677 http://www.aAlfa Aesar
    5457 4-nitro-3-(tri c1cc(c(cc1S(=O 64 2058844 http://www.aAlfa Aesar
    5458 4-nitro-3-(tri c1cc(c(cc1O)C( 76 6665 http://www.aAlfa Aesar
    5459 4-nitro-3-picoCc1c[n+](ccc1 136 63801 http://www.aAlfa Aesar
    5460 4'-nitroacetanCC(=O)Nc1ccc( 216 7407 http://www.aAlfa Aesar
    5461 4'-nitroaceto CC(=O)c1ccc(c 79 21106581 http://www.aAlfa Aesar
    5462 4-nitro-alpha-c1cc(ccc1CS(= 92 2073534 http://www. Alfa Aesar
    5463 4-nitroaniline c1cc(ccc1N)[N 148 13846959 http://www.aAlfa Aesar
    5464 4-nitroanisoleCOc1ccc(cc1)[ 52 21106148 http://www.aAlfa Aesar
    5465 4-nitrobenzal c1cc(ccc1C=O) 105 526 http://www.aAlfa Aesar
    5466 4-nitrobenzal c1cc(ccc1C=NO 128 86963 http://www.aAlfa Aesar
    5467 4-nitrobenza c1cc(ccc1C(=O 200 11594 http://www.aAlfa Aesar
    5468 4-nitrobenzenc1cc(ccc1[N+] 180 21360 http://www.aAlfa Aesar
    5469 4-nitrobenzenc1cc(ccc1[N+] 78 7126 http://www.aAlfa Aesar
    5470 4-nitrobenzo-c1cc2c(cc1[N 94 126824 http://www.aAlfa Aesar
    5471 4-nitrobenzoicc1cc(ccc1C(=O 240 5882 http://www.aAlfa Aesar
    5472 4-nitrobenzonic1cc(ccc1C#N) 145 11593 http://www.aAlfa Aesar
    5473 4-nitrobenzo c1ccc(cc1)C(= 137 64003 http://www.aAlfa Aesar
    5474 4-nitrobenzotrc1cc(ccc1C(F)( 40 9438 http://www.aAlfa Aesar
    5475 4-nitrobenzoylc1cc(ccc1C(=O 73 8188 http://www.aAlfa Aesar
    5476 4-nitrobenzyl c1cc(ccc1CO)[ 94 62486 http://www.aAlfa Aesar
    5477 4-nitrobenzyl c1cc(ccc1CBr) 99 59402 http://www.aAlfa Aesar
    5478 4-nitrobenzyl c1cc(ccc1COC( 50 5378372 http://www.aAlfa Aesar
    5479 4-nitrobenzyl c1cc(ccc1CCl) 72 7202 http://www.aAlfa Aesar
    5480 4-nitrocatechoc1cc(c(cc1[N+ 176 2745027 http://www.aAlfa Aesar
    5481 4-nitrochalco c1ccc(cc1)C(= 164 4526395 http://www.aAlfa Aesar
    5482 4-nitrocinnamc1cc(ccc1/C=C 127 4575657 http://www.aAlfa Aesar
    5483 4-nitrohippuric1cc(ccc1C(=O 130 16594 http://www.aAlfa Aesar
    5484 4-nitroindole c1cc2c(cc[nH] 205 128590 http://www.aAlfa Aesar
    5485 4-nitro-m-xyl Cc1ccc(c(c1)C 6 6725 http://www.aAlfa Aesar
    5486 4-nitro-o-phe c1cc(c(cc1[N+ 201 4286892 http://www.aAlfa Aesar
    5487 4-nitro-o-xyle Cc1ccc(cc1C)[ 29 7162 http://www.aAlfa Aesar
    5488 4-nitrophenolc1cc(ccc1[N+] 113 955 http://www.aAlfa Aesar
    5489 4-nitrophenoxc1cc(ccc1[N+ 189 137859 http://www.aAlfa Aesar
    5490 4-nitrophenoxc1cc(ccc1[N+] 75 125140 http://www.aAlfa Aesar
    5491 4-nitrophenyl CC(=O)Oc1ccc( 78 12687 http://www.aAlfa Aesar
    5492 4-nitrophenyl c1ccc(cc1)C(= 143 63575 http://www.aAlfa Aesar
    5493 4-nitrophenyl c1cc(ccc1[N+] 86 90953 http://www.aAlfa Aesar
    5494 4-nitrophenyl c1cc(ccc1[N+] 94 85641 http://www.aAlfa Aesar
    5495 4-nitrophenyl c1cc(ccc1[N+] 79 74123 http://www.aAlfa Aesar
    5496 4-nitrophenyl c1cc(ccc1[N+] 72 67203 http://www.aAlfa Aesar
    5497 4-nitrophenyl c1cc(ccc1N=C= 58 59403 http://www.aAlfa Aesar
    5498 4-nitrophenyl c1cc(ccc1N=C= 108 67597 http://www.aAlfa Aesar
    5499 4-nitrophenyl CCCCCCCCCCCC 66 66524 http://www.aAlfa Aesar
    5500 4-nitrophenyl c1ccc(cc1)Oc2 55 11613 http://www.aAlfa Aesar
    5501 4-nitrophenyl c1ccc(cc1)Sc2 56 13125 http://www.aAlfa Aesar
    5502 4-nitrophenyl c1cc(ccc1[N+] 52 478390 http://www.aAlfa Aesar
    5503 4-nitrophenylac1cc(ccc1CC(= 154 4500 http://www.aAlfa Aesar
    5504 4-nitrophenylac1cc(ccc1CC#N 116 61672 http://www.aAlfa Aesar
    5505 4-nitrophenylgc1cc(ccc1C(=O 110 133919 http://www.aAlfa Aesar
    5506 4-nitrophthalic1cc(c(cc1[N+ 163 62338 http://www.aAlfa Aesar
    5507 4-nitrophthal c1cc2c(cc1[N 202 6703 http://www.aAlfa Aesar
    5508 4-nitropyridinc1c[n+](ccc1[ 161 13662 http://www.aAlfa Aesar
    5509 4-nitroquinolic1ccc2c(c1)c(c 155 5740 http://www.aAlfa Aesar
    5510 4-nitrostyreneC=Cc1ccc(cc1) 27 7201 http://www. Alfa Aesar
    5511 4-nitrothioaniCOc1ccc(cc1)S 69 19973970 http://www.aAlfa Aesar
    5512 4-nitrotoluen Cc1ccc(cc1)[N 52 13863774 http://www.aAlfa Aesar
    5513 4-nitroveratroCOc1ccc(cc1OC 97 62928 http://www.aAlfa Aesar
    5514 4-n-nonylbenzB(c1ccc(cc1) 84 3781380 http://www.aAlfa Aesar
    5515 4-n-nonyloxyaCCCCCCCCCOc1 39 125889 http://www.aAlfa Aesar
    5516 4-n-nonylphenCCCCCCCCCc1c 45 1688 http://www.aAlfa Aesar
    5517 4-n-octylbenzoCCCCCCCCc1cc 98 18066 http://www.aAlfa Aesar
    5518 4'-n-octylbiphCCCCCCCCc1cc 21 94149 http://www. Alfa Aesar
    5519 4-n-octyloxybCCCCCCCCOc1c 103 16310 http://www.aAlfa Aesar
    5520 4-n-octyloxybeCCCCCCCCOc1c 25 128064 http://www.aAlfa Aesar
    5521 4-n-octylphenCCCCCCCCc1cc 45 14958 http://www. Alfa Aesar
    5522 4-n-pentylbenB(c1ccc(cc1)C 83 3781379 http://www.aAlfa Aesar
    5523 4-n-pentylbenCCCCCc1ccc(cc 42 127592 http://www.aAlfa Aesar
    5524 4-n-pentylbip CCCCCc1ccc(cc 10 73579 http://www.aAlfa Aesar
    5525 4-n-pentyloxyCCCCCOc1ccc( 123 76799 http://www.aAlfa Aesar
    5526 4-n-pentylpheCCCCCc1ccc(c 24 25119 http://www.aAlfa Aesar
    5527 4-n-propylbenCCCc1ccc(cc1) 21 2018866 http://www.aAlfa Aesar
    5528 4-n-propylbenCCCc1ccc(cc1 142 121262 http://www.aAlfa Aesar
    5529 4'-n-propylbipCCCc1ccc(cc1) 226 456119 http://www.aAlfa Aesar
    5530 4-n-propylpheCCCc1ccc(cc1 21 12060 http://www.aAlfa Aesar
    5531 4-oxo-4-(2-thic1cc(sc1)C(= 119 70754 http://www.aAlfa Aesar
    5532 4-pentenoic aC=CCCC(=O)O -22 55085 http://www.aAlfa Aesar
    5533 4-pentynoic aC#CCCC(=O)O 56 21069 http://www.aAlfa Aesar
    5534 4'-phenoxyac CC(=O)c1ccc(c 50 206700 http://www.aAlfa Aesar
    5535 4-phenoxyanilc1ccc(cc1)Oc2 84 8434 http://www.aAlfa Aesar
    5536 4-phenoxybenc1ccc(cc1)Oc2 25 59526 http://www.aAlfa Aesar
    5537 4-phenoxybenc1ccc(cc1)Oc2 131 732624 http://www. Alfa Aesar
    5538 4-phenoxybenz
    c1ccc(cc1)Oc2 44 2073647 http://www.aAlfa Aesar
    5539 4-phenoxybenz
    c1ccc(cc1)Oc2 162 67728 http://www.aAlfa Aesar
    5540 4-phenoxybenz
    c1ccc(cc1)Oc2 44 121471 http://www.aAlfa Aesar
    5541 4-phenoxybe c1ccc(cc1)C(= 64 208441 http://www.aAlfa Aesar
    5542 4-phenoxybutyc1ccc(cc1)OC 63 21319 http://www.aAlfa Aesar
    5543 4-phenoxyphec1ccc(cc1)Oc2 84 12696 http://www.aAlfa Aesar
    5544 4-phenoxyphen
    c1ccc(cc1)Oc2 76 208862 http://www. Alfa Aesar
    5545 4-phenyl-1(2hc1ccc(cc1)c2c 240 189960 http://www. Alfa Aesar
    5546 4-phenyl-1,2,3c1ccc(cc1)c2c 78 237442 http://www.aAlfa Aesar
    5547 4-phenyl-2-(2-c1ccc(cc1)c2c 57 11421132 http://www. Alfa Aesar
    5548 4-phenyl-2-(3-c1ccc(cc1)c2c 54 610948 http://www. Alfa Aesar
    5549 4-phenyl-2-(4-c1ccc(cc1)c2c 93 645462 http://www. Alfa Aesar
    5550 4-phenyl-2-(m-Cc1cccc(c1)c2 48 15292633 http://www. Alfa Aesar
    5551 4-phenyl-2-(p-Cc1ccc(cc1)c2 58 19233317 http://www. Alfa Aesar
    5552 4-phenyl-3-thc1ccc(cc1)NC 138 638258 http://www.aAlfa Aesar
    5553 4-phenylazod c1ccc(cc1)Nc2 83 20483879 http://www.aAlfa Aesar
    5554 4-phenylazoma
    c1ccc(cc1)/N 164 76955 http://www.aAlfa Aesar
    5555 4-phenylazop c1ccc(cc1)/N= 154 10296254 http://www.aAlfa Aesar
    5556 4-phenylazophc1ccc(cc1)N= 97 21242821 http://www.aAlfa Aesar
    5557 4-phenylbutyric1ccc(cc1)CC 51 4611 http://www.aAlfa Aesar
    5558 4-phenylcinnac1ccc(cc1)c2c 226 4719720 http://www.aAlfa Aesar
    5559 4-phenylcycl c1ccc(cc1)C2 80 70962 http://www.aAlfa Aesar
    5560 4-phenylimidac1ccc(cc1)c2c 144 62794 http://www.aAlfa Aesar
    5561 4-phenylphenc1ccc(cc1)c2c 166 13846658 http://www.aAlfa Aesar
    5562 4-phenylquinuc1ccc(cc1)C2 124 125991 http://www.aAlfa Aesar
    5563 4-phenylsemicc1ccc(cc1)NC 124 10380 http://www.aAlfa Aesar
    5564 4-phenylurazoc1ccc(cc1)n2c 208 76862 http://www.aAlfa Aesar
    5565 4-picoline Cc1ccncc1 3 13874733 http://www.aAlfa Aesar
    5566 4-picoline n-oCc1cc[n+](cc1 184 13257 http://www.aAlfa Aesar
    5567 4-piperidinemC1CNCCC1CO 59 372471 http://www.aAlfa Aesar
    5568 4-pyridineacec1cnccc1CC(= 146 197574 http://www.aAlfa Aesar
    5569 4-pyridinemetc1cnccc1CO 54 10988 http://www.aAlfa Aesar
    5570 4-pyrimidine c1cncnc1CO 77 10199014 http://www. Alfa Aesar
    5571 4'-tert-butyl CC(C)(C)c1ccc 36 199962 http://www.aAlfa Aesar
    5572 4-tert-butyl-3 CC(C)(C)NC(= 140 644336 http://www.aAlfa Aesar
    5573 4'-tert-butyl CC(C)(C)c1ccc 48 2005894 http://www.aAlfa Aesar
    5574 4'-tert-butyl CC(=O)c1ccc(c 18 13080 http://www.aAlfa Aesar
    5575 4-tert-butylanCC(C)(C)c1ccc 16 63057 http://www.aAlfa Aesar
    5576 4-tert-butylanCC(C)(C)c1ccc 18 85489 http://www.aAlfa Aesar
    5577 4-tert-butylb CC(C)(C)c1ccc 173 83079 http://www.aAlfa Aesar
    5578 4-tert-butylb B(c1ccc(cc1)C 194 2016072 http://www.aAlfa Aesar
    5579 4-tert-butylbeCC(C)(C)c1ccc 82 123363 http://www.aAlfa Aesar
    5580 4-tert-butylb CC(C)(C)c1ccc 129 110108 http://www.aAlfa Aesar
    5581 4-tert-butylbeCC(C)(C)c1ccc 166 7125 http://www.aAlfa Aesar
    5582 4-tert-butylb CC(C)(C)c1ccc 40 81044 http://www.aAlfa Aesar
    5583 4-tert-butylb CC(C)(C)c1ccc 10 79244 http://www. Alfa Aesar
    5584 4-tert-butylcaCC(C)(C)c1ccc 342 11483985 http://www.aAlfa Aesar
    5585 4-tert-butylcaCC(C)(C)c1ccc 379 11483984 http://www.aAlfa Aesar
    5586 4-tert-butylcaCC(C)(C)c1ccc 55 7103 http://www.aAlfa Aesar
    5587 4-tert-butylc CC(C)(C)C1CC 49 7114 http://www.aAlfa Aesar
    5588 4-tert-butylp CC(C)(C)c1ccc 99 13846663 http://www.aAlfa Aesar
    5589 4-tert-butylst CC(C)(C)c1ccc -38 14866 http://www.aAlfa Aesar
    5590 4-tert-butyltoCc1ccc(cc1)C( -63 7112 http://www.aAlfa Aesar
    5591 4-tert-pentylbCCC(C)(C)c1cc 47 11310245 http://www.aAlfa Aesar
    5592 4-tert-pentyl CCC(C)(C)c1cc 89 21106091 http://www.aAlfa Aesar
    5593 4-tridecanoneCCCCCCCCCC( 19 89114 http://www.aAlfa Aesar
    5594 4-trifluorometc1cc(ccc1CS(= 104 516660 http://www. Alfa Aesar
    5595 4-tritylaniline c1ccc(cc1)C(c 258 81162 http://www.aAlfa Aesar
    5596 4-tritylphenolc1ccc(cc1)C(c 281 63601 http://www.aAlfa Aesar
    5597 4-vinylbenzenB(c1ccc(cc1)C 190 2016145 http://www.aAlfa Aesar
    5598 4-vinylbenzoicC=Cc1ccc(cc1 142 13476 http://www.aAlfa Aesar
    5599 4-vinylbiphenyC=Cc1ccc(cc1) 116 15998 http://www.aAlfa Aesar
    5600 5-(2,3-dichlor c1cc(c(c(c1)Cl 181 3878314 http://www.aAlfa Aesar
    5601 5-(2,4-dichlor c1cc(c(cc1Cl) 163 2845663 http://www.aAlfa Aesar
    5602 5-(2,5-dichlor c1cc(c(cc1Cl) 157 5373883 http://www.aAlfa Aesar
    5603 5-(2,6-dichlor c1cc(c(c(c1)Cl 203 2087096 http://www.aAlfa Aesar
    5604 5-(2-bromophe
    c1ccc(c(c1)c2 182 487421 http://www.aAlfa Aesar
    5605 5-(2-chlorophec1ccc(c(c1)c2 180 487463 http://www.aAlfa Aesar
    5606 5-(2-fluorophec1ccc(c(c1)c2 158 518334 http://www.aAlfa Aesar
    5607 5-(2-furyl)-1h c1cc(oc1)c2cc 220 568530 http://www.aAlfa Aesar
    5608 5-(2-methoxypCOc1ccccc1c2 155 750604 http://www.aAlfa Aesar
    5609 5-(2-methylphCc1ccccc1c2[ 153 506799 http://www.aAlfa Aesar
    5610 5-(2-thienyl)pc1cc(sc1)CCC 41 134262 http://www.aAlfa Aesar
    5611 5-(3,4-dichlor c1cc(c(cc1c2[ 161 2087095 http://www.aAlfa Aesar
    5612 5-(3,5-dichlor c1c(cc(cc1Cl) 207 5373885 http://www.aAlfa Aesar
    5613 5-(3,5-difluor c1cnoc1c2cc(c 77 21469233 http://www. Alfa Aesar
    5614 5-(3-benzylox c1ccc(cc1)COc 209 5373895 http://www.aAlfa Aesar
    5615 5-(3-bromophe
    c1cc(cc(c1)Br 151 3288096 http://www.aAlfa Aesar
    5616 5-(3-chlorophec1cc(cc(c1)Cl 140 515081 http://www.aAlfa Aesar
    5617 5-(3-fluorophec1cc(cc(c1)F) 143 295921 http://www.aAlfa Aesar
    5618 5-(3-methoxypCOc1cccc(c1) 157 2738644 http://www.aAlfa Aesar
    5619 5-(3-methylphCc1cccc(c1)c2 145 506998 http://www.aAlfa Aesar
    5620 5-(3-phenoxypc1ccc(cc1)Oc2 153 5373893 http://www.aAlfa Aesar
    5621 5-(3-trifluor c1cc(cc(c1)OC 158 2057634 http://www.aAlfa Aesar
    5622 5-(4-chlorophec1cc(ccc1c2[n 263 226141 http://www.aAlfa Aesar
    5623 5-(4-diethyla CCN(CC)c1ccc 163 2298983 http://www.aAlfa Aesar
    5624 5-(4-dimethyl CN(C)c1ccc(cc 278 1068756 http://www.aAlfa Aesar
    5625 5-(4-fluorophec1cc(ccc1c2[n 210 669961 http://www.aAlfa Aesar
    5626 5-(4-fluorophec1cc(ccc1c2cc 55 2055109 http://www. Alfa Aesar
    5627 5-(4-fluorophec1cc(ccc1CCC 74 2016414 http://www.aAlfa Aesar
    5628 5-(4-hydroxypc1cc(ccc1CCC 118 5379435 http://www.aAlfa Aesar
    5629 5-(4-methoxypCOc1ccc(cc1) 237 272171 http://www.aAlfa Aesar
    5630 5-(4-methylphCc1ccc(cc1)c2 251 251339 http://www.aAlfa Aesar
    5631 5-(4-morpholic1cc(c(cc1N2 144 2078137 http://www.aAlfa Aesar
    5632 5-(5-bromo-3-p
    c1c(cncc1Br)c 227 3385091 http://www.aAlfa Aesar
    5633 5-(ethylthio)- CCSc1[nH]nnn 76 2039683 http://www. Alfa Aesar
    5634 5-(phenylsulfoc1ccc(cc1)S(= 104 504922 http://www.aAlfa Aesar
    5635 5-(trifluoromec1cc2c(cc1OC( 171 2014565 http://www.aAlfa Aesar
    5636 5-(trifluoromec1cc(c(cc1OC( 132 2055475 http://www. Alfa Aesar
    5637 5-(trifluoromec1cc2c(cc[nH] 69 2043773 http://www. Alfa Aesar
    5638 5-(trifluorom c1cc(ncc1C(F) 32 11518807 http://www. Alfa Aesar
    5639 5-(trifluoromec1c(c(=O)[nH] 253 5688 http://www.aAlfa Aesar
    5640 5,5,5-trifluoroCC(C[C@@H](C 274 144284 http://www.aAlfa Aesar
    5641 5,5'-dimethyl-Cc1ccc(nc1)c2 116 14899 http://www. Alfa Aesar
    5642 5,5-dimethylhCC1(C(=O)NC( 176 6246 http://www.aAlfa Aesar
    5643 5,5-dimethyloCC1(C(=O)NC( 79 2972 http://www.aAlfa Aesar
    5644 5,5-diphenylhc1ccc(cc1)C2( 296 1710 http://www.aAlfa Aesar
    5645 5,6,7,8,9,10- c1ccc2c(c1)c3 145 220761 http://www.aAlfa Aesar
    5646 5,6,7,8-tetra c1cc2c(c(c1)O 70 61556 http://www.aAlfa Aesar
    5647 5,6,7,8-tetra c1cc2c(cc1O) 62 13667 http://www.aAlfa Aesar
    5648 5,6,7-trihydroc1ccc(cc1)c2c 269 4444924 http://www.aAlfa Aesar
    5649 5,6,7-trimeth COc1cc2c(c(=O 166 390980 http://www.aAlfa Aesar
    5650 5,6'-dibromo-3c1cc(ncc1c2cc 203 21242433 http://www. Alfa Aesar
    5651 5,6-diethyl-3-(CCc1c(nnc(n1 70 5895592 http://www.aAlfa Aesar
    5652 5,6-difluorosac1cc(c(c(c1O) 55 13830032 http://www. Alfa Aesar
    5653 5,6-difluorosalc1cc(c(c(c1O) 183 21112835 http://www. Alfa Aesar
    5654 5,6-dihydro-5 CC1CNC(=O)N 264 84456 http://www.aAlfa Aesar
    5655 5,6-dihydro-6 CC1CC(=O)NC 219 88293 http://www.aAlfa Aesar
    5656 5,6-dihydrouraC1CNC(=O)NC 279 629 http://www.aAlfa Aesar
    5657 5,6-dimethox COc1cc2c(cc1 119 67571 http://www.aAlfa Aesar
    5658 5,6-dimethox COc1cc2c(cc1 186 522664 http://www. Alfa Aesar
    5659 5,6-dimethoxyCOc1cc2cc[nH 157 76162 http://www.aAlfa Aesar
    5660 5,6-dimethyl- Cc1c(c2cccnc 268 68834 http://www.aAlfa Aesar
    5661 5,6-dimethyl- Cc1cc2c(cc1C) 84 601419 http://www.aAlfa Aesar
    5662 5,6-dimethyl-3Cc1c(nnc(n1)c 85 10562962 http://www.aAlfa Aesar
    5663 5,6-dimethylbCc1cc2c(cc1C) 204 655 http://www.aAlfa Aesar
    5664 5,7-dibromo-8c1cc2c(cc(c(c 201 2359 http://www.aAlfa Aesar
    5665 5,7-dichloro- c1cc2c(cc(c(c2 181 2621 http://www.aAlfa Aesar
    5666 5,7-dihydroxyCOc1ccc(cc1) 212 4444068 http://www.aAlfa Aesar
    5667 5,7-dihydroxyCc1cc(=O)oc2c 299 4510504 http://www.aAlfa Aesar
    5668 5,7-dihydroxyc1ccc(cc1)c2c 287 4444926 http://www.aAlfa Aesar
    5669 5,7-dimethox COc1cc2c(ccc( 148 2673 http://www.aAlfa Aesar
    5670 5,7-dimethylisCc1cc(c2c(c1) 246 35100 http://www.aAlfa Aesar
    5671 5,7-dodecadiyC(CCO)CC#CC 50 487568 http://www.aAlfa Aesar
    5672 5-[3-(trifluor c1cc(cc(c1)C( 157 616391 http://www.aAlfa Aesar
    5673 5-[4-(methylthCSc1ccc(cc1)c 215 3959632 http://www.aAlfa Aesar
    5674 5-acetyl-2,3- CC(=O)c1ccc2 58 128102 http://www.aAlfa Aesar
    5675 5-acetyl-2-amCc1c(cnc(n1)N 227 404697 http://www.aAlfa Aesar
    5676 5-acetylsalicy CC(=O)c1ccc(c 221 171555 http://www.aAlfa Aesar
    5677 5-acetylsalicylCC(=O)c1ccc(c 215 75019 http://www.aAlfa Aesar
    5678 5-acetylthiop B(c1ccc(s1)C( 145 3355822 http://www.aAlfa Aesar
    5679 5-acetylthiophCC(=O)c1ccc( 78 2029013 http://www.aAlfa Aesar
    5680 5-acetylthiophCC(=O)c1ccc( 210 2972612 http://www.aAlfa Aesar
    5681 5-acetylvaleri CC(=O)CCCCC 35 89244 http://www.aAlfa Aesar
    5682 5alpha-cholesC[C@H](CCCC 142 6413 http://www.aAlfa Aesar
    5683 5alpha-cholesC[C@H](CCCC 130 83174 http://www.aAlfa Aesar
    5684 5-amino-1-(2-c1ccc(c(c1)n2 138 11368263 http://www. Alfa Aesar
    5685 5-amino-1-(3-c1cc(cc(c1)Cl 185 641750 http://www. Alfa Aesar
    5686 5-amino-1-(4-c1cc(ccc1n2c( 171 554550 http://www. Alfa Aesar
    5687 5-amino-1,3-dCc1cc(n(n1)C) 75 454203 http://www.aAlfa Aesar
    5688 5-amino-1,3-dc1ccc(cc1)c2c 131 173078 http://www.aAlfa Aesar
    5689 5-amino-1h-bec1cc2c(cc1N) 160 69297 http://www.aAlfa Aesar
    5690 5-amino-1h-inc1cc2c(cc1N)c 175 79400 http://www.aAlfa Aesar
    5691 5-amino-1-metCn1c(cc(n1)c2 127 451759 http://www.aAlfa Aesar
    5692 5-amino-1-pe C(CCN)CCO 36 68156 http://www.aAlfa Aesar
    5693 5-amino-2-(4-c1cc(ncc1N) 129 93945 http://www. Alfa Aesar
    5694 5-amino-2-(tr c1cc2c(cc1N)n 188 18253 http://www.aAlfa Aesar
    5695 5-amino-2,4,6-c1(c(c(c(c(c1I 268 2283852 http://www.aAlfa Aesar
    5696 5-amino-2-br c1cc(ncc1N)Br 77 557998 http://www.aAlfa Aesar
    5697 5-amino-2-chlc1cc(ncc1N)Cl 83 71627 http://www.aAlfa Aesar
    5698 5-amino-2-cyac1cc(ncc1N)C 150 3096176 http://www. Alfa Aesar
    5699 5-amino-2-fluc1cc(c(cc1N)C 191 2017592 http://www. Alfa Aesar
    5700 5-amino-2-fluc1cc(c(cc1N)C 94 2019305 http://www. Alfa Aesar
    5701 5-amino-2-fluc1cc(ncc1N)F 91 715949 http://www. Alfa Aesar
    5702 5-amino-2-iodc1cc(ncc1N)I 65 1734073 http://www. Alfa Aesar
    5703 5-amino-2-mec1cc2c(cc1N)n 242 2015760 http://www. Alfa Aesar
    5704 5-amino-2-meCOc1ccc(cc1O 131 66912 http://www.aAlfa Aesar
    5705 5-amino-2-meCOc1ccc(cn1) 30 73188 http://www. Alfa Aesar
    5706 5-amino-2-metCc1ccc(cn1)N 97 212713 http://www. Alfa Aesar
    5707 5-amino-3-(2-c1cc(sc1)c2cc 101 456381 http://www.aAlfa Aesar
    5708 5-amino-3,4-dCc1c(noc1N)C 119 79675 http://www.aAlfa Aesar
    5709 5-amino-3-metCc1cc(on1)N 83 76311 http://www.aAlfa Aesar
    5710 5-amino-3-phec1ccc(cc1)c2c 109 229297 http://www. Alfa Aesar
    5711 5-amino-3-terCC(C)(C)c1cc( 157 2016981 http://www.aAlfa Aesar
    5712 5-amino-4,6-dc1nc(c(c(n1)Cl 145 71751 http://www.aAlfa Aesar
    5713 5-amino-4-br Cn1c(c(cn1)Br 99 521937 http://www.aAlfa Aesar
    5714 5-amino-4-cyac1ccc(cc1)n2c 164 73615 http://www.aAlfa Aesar
    5715 5-aminoindanc1cc2c(cc1N) 35 81705 http://www.aAlfa Aesar
    5716 5-aminoindol c1cc2c(cc[nH] 132 71202 http://www.aAlfa Aesar
    5717 5-aminoisoquic1cc2cnccc2c( 129 63931 http://www.aAlfa Aesar
    5718 5-aminomethyl
    c1cc(ncc1CN)C 30 5383869 http://www.aAlfa Aesar
    5719 5-aminopyridic1cc(ncc1N)C 218 3390814 http://www. Alfa Aesar
    5720 5-aminoquinolc1cc(c2cccnc2 108 11417 http://www.aAlfa Aesar
    5721 5-aminovalericC(CCN)CC(=O) 157 135 http://www.aAlfa Aesar
    5722 5-azabenzimidc1cncc2c1[nH 172 8872 http://www.aAlfa Aesar
    5723 5-benzoylpentc1ccc(cc1)C( 77 194221 http://www.aAlfa Aesar
    5724 5-benzyloxy-2Cc1cc(ccc1[N+ 70 226108 http://www.aAlfa Aesar
    5725 5-benzyloxyinc1ccc(cc1)COc 99 13959 http://www.aAlfa Aesar
    5726 5-benzyloxyindc1ccc(cc1)COc 197 73212 http://www.aAlfa Aesar
    5727 5-benzyloxyinc1ccc(cc1)COc 241 73446 http://www.aAlfa Aesar
    5728 5-bromo-1,2, COc1cc(cc(c1 79 68390 http://www.aAlfa Aesar
    5729 5-bromo-1,2,4Cc1cc(c(cc1C) 72 13875161 http://www.aAlfa Aesar
    5730 5-bromo-1,3-dCc1cc(cn(c1=O 106 25027439 http://www. Alfa Aesar
    5731 5-bromo-1-in c1cc2c(cc1Br 127 454180 http://www.aAlfa Aesar
    5732 5-bromo-2-(teCC(C)(C)Oc1nc 62 21242473 http://www. Alfa Aesar
    5733 5-bromo-2-(trc1cc(ncc1Br)C( 40 2041927 http://www.aAlfa Aesar
    5734 5-bromo-2,3'-c1cc(cnc1)c2c 77 9565579 http://www. Alfa Aesar
    5735 5-bromo-2,3-dc1c(cnc(c1N)N 157 602170 http://www.aAlfa Aesar
    5736 5-bromo-2,3-dCOc1cc(cc(c1F 35 2053709 http://www.aAlfa Aesar
    5737 5-bromo-2,4-dCC(C)(C)Oc1c( 60 715402 http://www. Alfa Aesar
    5738 5-bromo-2,4-dc1c(c(nc(n1)Cl 30 255845 http://www.aAlfa Aesar
    5739 5-bromo-2'-chlc1cc(c(nc1)Cl) 132 21242472 http://www. Alfa Aesar
    5740 5-bromo-2-chlc1cc(c(cc1Br) 160 30620 http://www.aAlfa Aesar
    5741 5-bromo-2-chlc1cc(c(cc1Br)C -21 61274 http://www.aAlfa Aesar
    5742 5-bromo-2-chc1cc(c(cc1Br)O 57 716779 http://www.aAlfa Aesar
    5743 5-bromo-2-chlc1cc(ncc1Br)C 70 2016166 http://www.aAlfa Aesar
    5744 5-bromo-2-chlc1c(cnc(n1)Cl) 79 527333 http://www.aAlfa Aesar
    5745 5-bromo-2-cy c1cc(ncc1Br) 126 713853 http://www.aAlfa Aesar
    5746 5-bromo-2-et CCOc1ccc(cc1 69 127841 http://www.aAlfa Aesar
    5747 5-bromo-2-ethCCOc1ccc(cn1 34 713927 http://www. Alfa Aesar
    5748 5-bromo-2-fluCc1cc(cnc1F)B 62 13285048 http://www. Alfa Aesar
    5749 5-bromo-2-fluc1cc(c(cc1Br) 79 2007015 http://www.aAlfa Aesar
    5750 5-bromo-2-fluc1cc(c(cc1Br) 195 599790 http://www.aAlfa Aesar
    5751 5-bromo-2-fluc1c(cnc(n1)F) 92 522238 http://www. Alfa Aesar
    5752 5-bromo-2-fu c1cc(oc1C=O) 84 521915 http://www.aAlfa Aesar
    5753 5-bromo-2-furc1cc(oc1C(=O 190 61786 http://www.aAlfa Aesar
    5754 5'-bromo-2'-hCC(=O)c1cc(cc 131 600451 http://www. Alfa Aesar
    5755 5-bromo-2-hyd
    c1c(cnc(c1[N+ 247 76793 http://www.aAlfa Aesar
    5756 5-bromo-2-hyc1ccc(cc1)C(= 110 199363 http://www.aAlfa Aesar
    5757 5-bromo-2-hyd
    c1cc(c(cc1Br) 109 67879 http://www.aAlfa Aesar
    5758 5-bromo-2-hyd
    c1cc(ncc1Br)O 180 521200 http://www.aAlfa Aesar
    5759 5-bromo-2-iodc1cc(c(cc1Br) 121 5383816 http://www.aAlfa Aesar
    5760 5-bromo-2-iodc1cc(ncc1Br)I 115 516098 http://www.aAlfa Aesar
    5761 5-bromo-2-iodc1c(cnc(n1)I)B 101 5370903 http://www.aAlfa Aesar
    5762 5-bromo-2-meCOc1ccc(cc1N 95 2821777 http://www.aAlfa Aesar
    5763 5-bromo-2-meCOc1ccc(cc1C 116 81876 http://www.aAlfa Aesar
    5764 5-bromo-2-met
    COc1ccc(cc1S( 114 453594 http://www.aAlfa Aesar
    5765 5-bromo-2-met
    COc1ccc(cc1C 91 3619021 http://www. Alfa Aesar
    5766 5-bromo-2-met
    COc1ccc(cc1/C 121 4513854 http://www.aAlfa Aesar
    5767 5-bromo-2-meCOc1ccc(cc1/ 225 588905 http://www.aAlfa Aesar
    5768 5-bromo-2-meCc1ccc(cc1O)B 79 13964299 http://www. Alfa Aesar
    5769 5-bromo-2-meCc1ccc(cn1)Br 34 1012926 http://www. Alfa Aesar
    5770 5-bromo-2-nitc1cc(c(cc1Br)C 34 119947 http://www.aAlfa Aesar
    5771 5-bromo-2-nitc1cc(ncc1Br)[ 149 714293 http://www.aAlfa Aesar
    5772 5-bromo-2-phe
    c1ccc(cc1)c2c 74 2043560 http://www. Alfa Aesar
    5773 5-bromo-3-(trc1c(cc(c(c1C= 46 2059514 http://www. Alfa Aesar
    5774 5-bromo-3-cy c1c(cncc1Br) 105 643894 http://www.aAlfa Aesar
    5775 5-bromo-3-met
    COc1cc(cc(c1 129 230275 http://www.aAlfa Aesar
    5776 5-bromo-3-met
    Cc1cc(cnc1NC( 127 21242386 http://www. Alfa Aesar
    5777 5-bromo-3-nitc1c(cc(c(c1C= 126 537704 http://www. Alfa Aesar
    5778 5-bromo-3-pyrc1c(cncc1Br) 184 2081215 http://www.aAlfa Aesar
    5779 5-bromo-4,6-dc1nc(c(c(n1)Cl 79 100117 http://www. Alfa Aesar
    5780 5-bromo-4-chlCC(=O)n1cc(c2 166 68889 http://www.aAlfa Aesar
    5781 5-bromo-6-chlc1c(cnc(c1Br) 172 251591 http://www. Alfa Aesar
    5782 5-bromo-7-azac1c[nH]c2c1cc 179 8483398 http://www. Alfa Aesar
    5783 5-bromo-7-nitc1c[nH]c2c1cc 213 713442 http://www.aAlfa Aesar
    5784 5-bromo-7-nitc1c(cc(c2c1CC 131 2286325 http://www.aAlfa Aesar
    5785 5-bromoacetyc1cc(c(cc1C(= 203 171857 http://www.aAlfa Aesar
    5786 5-bromobenzoc1cc2c(ccs2)c 46 2056891 http://www.aAlfa Aesar
    5787 5-bromoindolc1cc2c(cc[nH] 91 23286 http://www.aAlfa Aesar
    5788 5-bromoindolc1cc2c(cc1Br) 205 63325 http://www.aAlfa Aesar
    5789 5-bromoindolc1cc2c(cc1Br 38 2655545 http://www.aAlfa Aesar
    5790 5-bromoisophtc1c(cc(cc1C(= 283 81313 http://www. Alfa Aesar
    5791 5-bromoisoquic1cc2cnccc2c( 82 643610 http://www.aAlfa Aesar
    5792 5-bromonicotc1c(cncc1Br)C 227 1742 http://www.aAlfa Aesar
    5793 5-bromonicotic1c(cncc1Br)C 184 80042 http://www.aAlfa Aesar
    5794 5-bromonicotic1c(cncc1Br)C 73 2061407 http://www.aAlfa Aesar
    5795 5-bromopyridc1cc(ncc1Br) 95 8053239 http://www. Alfa Aesar
    5796 5-bromopyridic1cc(ncc1Br)C 174 528977 http://www.aAlfa Aesar
    5797 5-bromopyrimc1c(cncn1)Br 72 70714 http://www.aAlfa Aesar
    5798 5-bromoquinoc1cc2c(cccn2) 46 714008 http://www.aAlfa Aesar
    5799 5-bromosalicyc1cc(c(cc1Br) 105 65695 http://www.aAlfa Aesar
    5800 5-bromosalicylc1cc(c(cc1Br) 168 6706 http://www.aAlfa Aesar
    5801 5-bromothiopc1cc(sc1C=NO 133 173553 http://www.aAlfa Aesar
    5802 5-bromothioph
    c1cc(sc1C(=O) 140 309912 http://www.aAlfa Aesar
    5803 5-bromothioph
    c1cc(sc1S(=O) 41 2015687 http://www.aAlfa Aesar
    5804 5-bromouridi c1c(c(=O)[nH 192 82616 http://www.aAlfa Aesar
    5805 5-bromovaleriC(CCBr)CC(=O 40 15526 http://www.aAlfa Aesar
    5806 5-bromovanillCOc1cc(cc(c1 164 17096 http://www.aAlfa Aesar
    5807 5-chloro-1,10 c1cc2cc(c3ccc 123 70257 http://www.aAlfa Aesar
    5808 5-chloro-1,2- c1c(cc(c(c1F)B 38 2007022 http://www.aAlfa Aesar
    5809 5-chloro-1-in c1cc2c(cc1Cl 94 125793 http://www.aAlfa Aesar
    5810 5-chloro-1-phc1ccc(cc1)n2c 123 76019 http://www.aAlfa Aesar
    5811 5-chloro-2-(2 c1cc(c(cc1Cl) 57 5363 http://www.aAlfa Aesar
    5812 5-chloro-2(3hc1cc2c(cc1Cl) 191 2632 http://www.aAlfa Aesar
    5813 5-chloro-2-(tr c1cc(c(cc1Cl)C 86 2054268 http://www.aAlfa Aesar
    5814 5-chloro-2-(tr c1cc(c(cc1Cl) 118 2058382 http://www. Alfa Aesar
    5815 5-chloro-2-(tr c1cc(c(cc1Cl)C 62 2058386 http://www.aAlfa Aesar
    5816 5-chloro-2,3- c1c(cnc(c1N)N 172 1064913 http://www.aAlfa Aesar
    5817 5-chloro-2,4- B(c1cc(c(cc1F) 220 2997879 http://www. Alfa Aesar
    5818 5-chloro-2,4- COc1cc(c(cc1 93 3591411 http://www.aAlfa Aesar
    5819 5-chloro-2,4-dc1c(c(cc(c1Cl 181 2958418 http://www.aAlfa Aesar
    5820 5-chloro-2,4-dCc1cc(c(cc1[N 90 222451 http://www.aAlfa Aesar
    5821 5-chloro-2'-fl c1cc(c(nc1)F)c 100 21242389 http://www. Alfa Aesar
    5822 5-chloro-2-fl c1cc(c(cc1Cl) 136 2054005 http://www.aAlfa Aesar
    5823 5-chloro-2-fl c1cc(c(cc1Cl) 135 1064940 http://www. Alfa Aesar
    5824 5-chloro-2-fl c1cc(c(cc1Cl)S 43 2058531 http://www.aAlfa Aesar
    5825 5-chloro-2-fluc1cc(c(cc1Cl) 149 2018200 http://www.aAlfa Aesar
    5826 5-chloro-2-fluc1cc(c(cc1Cl) 68 84537 http://www.aAlfa Aesar
    5827 5-chloro-2-fu c1cc(oc1C=O)C 35 2050132 http://www.aAlfa Aesar
    5828 5-chloro-2-hy c1c(cnc(c1I)N 137 21242347 http://www. Alfa Aesar
    5829 5-chloro-2-hy Cc1cc(cc(c1O) 59 2054759 http://www.aAlfa Aesar
    5830 5'-chloro-2'- CC(=O)c1cc(cc 134 599716 http://www. Alfa Aesar
    5831 5'-chloro-2'- CC(=O)c1cc(cc 53 66679 http://www.aAlfa Aesar
    5832 5-chloro-2-h c1cc(c(cc1Cl) 225 308931 http://www.aAlfa Aesar
    5833 5-chloro-2-hy c1cc(c(cc1Cl) 86 71563 http://www. Alfa Aesar
    5834 5-chloro-2-hydc1c(cnc(c1C(= 259 142510 http://www.aAlfa Aesar
    5835 5-chloro-2-hy c1cc(ncc1Cl)O 164 70281 http://www.aAlfa Aesar
    5836 5-chloro-2-iodc1cc(c(cc1Cl)N 41 555103 http://www.aAlfa Aesar
    5837 5-chloro-2-mec1cc2c(cc1Cl) 300 1550010 http://www.aAlfa Aesar
    5838 5-chloro-2-mec1cc2c(cc1Cl)n 199 2006030 http://www.aAlfa Aesar
    5839 5-chloro-2-m Cc1cc(c(cc1Cl 170 13473613 http://www. Alfa Aesar
    5840 5-chloro-2-meCc1cc(c(cc1Cl 127 21242251 http://www. Alfa Aesar
    5841 5-chloro-2-meCOc1ccc(cc1N) 82 60129 http://www.aAlfa Aesar
    5842 5-chloro-2-m COc1ccc(cc1C 77 2949378 http://www. Alfa Aesar
    5843 5-chloro-2-meB(c1cc(ccc1OC 138 2017437 http://www. Alfa Aesar
    5844 5-chloro-2-meCOc1ccc(cc1S( 102 2016027 http://www.aAlfa Aesar
    5845 5-chloro-2-meCOc1ccc(cc1C 99 69419 http://www.aAlfa Aesar
    5846 5-chloro-2-meCOc1ccc(cc1C 100 2079692 http://www.aAlfa Aesar
    5847 5-chloro-2-meCOc1ccc(cc1N 60 127036 http://www.aAlfa Aesar
    5848 5-chloro-2-meCOc1ccc(cc1N 58 644229 http://www.aAlfa Aesar
    5849 5-chloro-2-m CNc1ccc(cc1C( 96 13323 http://www.aAlfa Aesar
    5850 5-chloro-2-meCc1ccc(cc1N)C 23 6990 http://www.aAlfa Aesar
    5851 5-chloro-2-meCc1cc2cc(ccc2 112 63804 http://www.aAlfa Aesar
    5852 5-chloro-2-meCc1ccc(cc1O)C 73 71519 http://www.aAlfa Aesar
    5853 5-chloro-2-nitc1cc(c(cc1Cl) 126 66825 http://www.aAlfa Aesar
    5854 5-chloro-2-ni c1cc(c(cc1Cl) 157 2005873 http://www.aAlfa Aesar
    5855 5-chloro-2-nitc1cc(c(cc1Cl) 138 16358 http://www.aAlfa Aesar
    5856 5-chloro-2-nitc1cc(c(cc1Cl)C 22 60403 http://www.aAlfa Aesar
    5857 5-chloro-2-nitc1cc(ncc1Cl)[ 122 228044 http://www. Alfa Aesar
    5858 5-chloro-3-hy c1c(cncc1Cl)O 161 506127 http://www.aAlfa Aesar
    5859 5-chloro-3-meCc1csc2c1cc(c 35 280836 http://www.aAlfa Aesar
    5860 5-chloro-3-phc1ccc(cc1)c2c 116 308146 http://www.aAlfa Aesar
    5861 5'-chloro-4'-f CC(=O)Nc1cc(c 111 2054222 http://www.aAlfa Aesar
    5862 5-chloro-4-fluc1c(c(cc(c1Cl) 143 451809 http://www.aAlfa Aesar
    5863 5-chloro-4-met
    Cc1cc(c(cc1Cl 161 220502 http://www.aAlfa Aesar
    5864 5-chloro-4-nitc1c(c(sc1S(=O) 53 2017469 http://www.aAlfa Aesar
    5865 5-chloro-8-hy c1cc2c(ccc(c2 123 2715 http://www.aAlfa Aesar
    5866 5-chlorobenzoc1cc2c(cc1Cl) 154 177643 http://www.aAlfa Aesar
    5867 5-chlorobenzoc1cc2c(cc1Cl) 134 2060083 http://www.aAlfa Aesar
    5868 5-chlorobenzoc1cc2c(cc1Cl) 47 123661 http://www.aAlfa Aesar
    5869 5-chlorobenzoc1cc2c(cc1Cl) 44 26419 http://www. Alfa Aesar
    5870 5-chloroindol c1cc2c(cc[nH] 71 78577 http://www.aAlfa Aesar
    5871 5-chloroindol c1cc2c(cc1Cl) 211 2074253 http://www.aAlfa Aesar
    5872 5-chloronicotic1c(cncc1Cl)C 170 217108 http://www. Alfa Aesar
    5873 5-chloropyrazic1c(ncc(n1)Cl 155 409222 http://www. Alfa Aesar
    5874 5-chloropyridic1cc(ncc1Cl)C 169 2043570 http://www. Alfa Aesar
    5875 5-chlorosalicyc1cc(c(cc1Cl) 101 11971 http://www.aAlfa Aesar
    5876 5-chlorosalicylc1cc(c(cc1Cl) 174 9075 http://www.aAlfa Aesar
    5877 5-chlorothiop B(c1ccc(s1)Cl 138 2016076 http://www.aAlfa Aesar
    5878 5-chlorothiop c1cc(sc1C(=O) 151 85763 http://www.aAlfa Aesar
    5879 5-chlorothiop c1cc(sc1S(=O) 117 1042281 http://www.aAlfa Aesar
    5880 5-chlorothiophc1cc(sc1S(=O) 27 2015688 http://www.aAlfa Aesar
    5881 5-chlorovanilliCOc1cc(cc(c1O 245 40234 http://www.aAlfa Aesar
    5882 5-chlorovanill COc1cc(cc(c1 164 27533 http://www.aAlfa Aesar
    5883 5-cyano-2-(tric1cc(ncc1C#N) 39 2057832 http://www.aAlfa Aesar
    5884 5-cyano-2-metCc1ccc(cn1)C 85 248316 http://www.aAlfa Aesar
    5885 5-cyanothiophB(c1ccc(s1)C# 127 3409021 http://www.aAlfa Aesar
    5886 5-cyclobutyl- c1ccc(cc1)C2 235 243942 http://www.aAlfa Aesar
    5887 5-ethoxy-2-m CCOc1ccc2c(c1 249 691550 http://www.aAlfa Aesar
    5888 5-ethyl-2-(2-hCCc1ccc(nc1) 42 71229 http://www.aAlfa Aesar
    5889 5-ethyl-2-metCCc1ccc(nc1)C -71 21105900 http://www.aAlfa Aesar
    5890 5-ethylpyridinCCc1cc(c(nc1 153 101798 http://www.aAlfa Aesar
    5891 5-ethyluracil CCc1c[nH]c(= 309 66013 http://www.aAlfa Aesar
    5892 5-fluoro-1,3- Cc1cc(cc(c1[N 54 21242357 http://www. Alfa Aesar
    5893 5-fluoro-1h-inc1cc2c(cc1F)c 123 10554276 http://www. Alfa Aesar
    5894 5-fluoro-1-in c1cc2c(cc1F) 39 120305 http://www.aAlfa Aesar
    5895 5-fluoro-2-(tr c1cc(c(cc1F)N) 31 14497571 http://www. Alfa Aesar
    5896 5-fluoro-2-(tr c1cc(c(cc1F)C 82 599768 http://www.aAlfa Aesar
    5897 5-fluoro-2-(tr c1cc(c(cc1F)CO 50 2019196 http://www.aAlfa Aesar
    5898 5-fluoro-2-(tr c1cc(c(cc1F)O) 50 2055183 http://www. Alfa Aesar
    5899 5-fluoro-2,4-dc1c(c(nc(n1)Cl 38 219582 http://www. Alfa Aesar
    5900 5-fluoro-2'-dec1c(c(=O)[nH 150 5586 http://www.aAlfa Aesar
    5901 5'-fluoro-2'- CC(=O)c1cc(cc 57 86660 http://www.aAlfa Aesar
    5902 5-fluoro-2-iodc1cc(c(cc1F)N) 41 2054909 http://www.aAlfa Aesar
    5903 5-fluoro-2-meCOc1ccc(cc1C 117 2062891 http://www.aAlfa Aesar
    5904 5-fluoro-2-meCOc1ccc(cc1C 60 16787577 http://www. Alfa Aesar
    5905 5-fluoro-2-metCc1ccc(cc1N)F 39 61093 http://www.aAlfa Aesar
    5906 5-fluoro-2-meB(c1cc(ccc1C) 149 2063333 http://www.aAlfa Aesar
    5907 5-fluoro-2-meCc1ccc(cc1C(= 131 158395 http://www.aAlfa Aesar
    5908 5-fluoro-2-meCc1ccc(cc1C# 43 455927 http://www.aAlfa Aesar
    5909 5-fluoro-2-meCc1ccc(cc1CO 38 2054990 http://www. Alfa Aesar
    5910 5-fluoro-2-ni c1cc(c(cc1F)C 95 510311 http://www.aAlfa Aesar
    5911 5-fluoro-2-nit c1cc(c(cc1F)C 135 2019060 http://www.aAlfa Aesar
    5912 5-fluoro-2-nit c1cc(c(cc1F)C 103 2985688 http://www. Alfa Aesar
    5913 5-fluoro-2-nit c1cc(c(cc1F)C( 23 193727 http://www.aAlfa Aesar
    5914 5-fluoro-2-ni c1cc(c(cc1F)O 33 9549 http://www.aAlfa Aesar
    5915 5-fluoro-2-nit c1cc(c(cc1F)C 155 8573292 http://www. Alfa Aesar
    5916 5-fluoro-2-nit c1cc(c(cc1F)C 71 17888 http://www. Alfa Aesar
    5917 5-fluoro-2-nit Cc1cc(ccc1[N+ 20 85678 http://www.aAlfa Aesar
    5918 5-fluoroindolec1cc2c(cc[nH] 45 61178 http://www.aAlfa Aesar
    5919 5-fluoroindol c1cc2c(cc1F)c 164 227398 http://www.aAlfa Aesar
    5920 5-fluoroisatin c1cc2c(cc1F) 226 206493 http://www.aAlfa Aesar
    5921 5-fluoropyridic1cc(ncc1F)C( 165 2043574 http://www. Alfa Aesar
    5922 5-fluorosalicy c1cc(c(cc1F)C 84 2018970 http://www.aAlfa Aesar
    5923 5-fluorosalicylc1cc(c(cc1F)C 180 60977 http://www.aAlfa Aesar
    5924 5-formyl-2-meB(c1cc(ccc1O 160 2016119 http://www.aAlfa Aesar
    5925 5-formyl-4-meB(c1cc(c(s1)C 119 21242217 http://www. Alfa Aesar
    5926 5-hexadecanoCCCCCCCCCCC 37 89121 http://www.aAlfa Aesar
    5927 5-hydroxy-1, c1cc2c(c(c1) 162 3674 http://www. Alfa Aesar
    5928 5-hydroxy-2-(tc1cc(ncc1O)C( 175 2063530 http://www. Alfa Aesar
    5929 5-hydroxy-2-mCc1ccc(cn1)O 169 13637 http://www.aAlfa Aesar
    5930 5-hydroxy-2-nc1cc(c(cc1O)C 167 35874 http://www.aAlfa Aesar
    5931 5-hydroxy-2-nc1cc(c(cc1O)C 170 11389 http://www. Alfa Aesar
    5932 5-hydroxy-3,4COc1cc(cc(c1 196 67282 http://www.aAlfa Aesar
    5933 5-hydroxyflav c1ccc(cc1)c2c 158 61420 http://www.aAlfa Aesar
    5934 5-hydroxyindoc1cc2c(cc[nH] 109 15244 http://www.aAlfa Aesar
    5935 5-hydroxymeth
    c1cc(oc1CO)C 34 207215 http://www.aAlfa Aesar
    5936 5-indanol c1cc2c(cc1O) 53 14390 http://www.aAlfa Aesar
    5937 5-iodo-1,2,3- COc1cc(cc(c1 86 263274 http://www.aAlfa Aesar
    5938 5-iodo-2,4-di COc1c(cnc(n1) 73 231407 http://www.aAlfa Aesar
    5939 5-iodo-2-fura c1cc(oc1C=O)I 127 604080 http://www.aAlfa Aesar
    5940 5-iodo-2-methCOc1ccc(cc1N) 86 14994356 http://www.aAlfa Aesar
    5941 5-iodo-2-methCc1ccc(cc1N)I 48 456040 http://www.aAlfa Aesar
    5942 5-iodo-3-methCc1cc(cnc1NC( 143 846946 http://www. Alfa Aesar
    5943 5-iodo-3-methCc1cc(cnc1NC) 72 21242452 http://www. Alfa Aesar
    5944 5-iodoindole c1cc2c(cc[nH] 99 2062472 http://www.aAlfa Aesar
    5945 5-iodosalicylicc1cc(c(cc1I)C 197 8083 http://www.aAlfa Aesar
    5946 5-iodouracil c1c(c(=O)[nH] 275 62873 http://www.aAlfa Aesar
    5947 5-iodovanillin COc1cc(cc(c1O 183 71809 http://www.aAlfa Aesar
    5948 5-isopropyl-1 CC(C)C1CC(=O 80 492106 http://www. Alfa Aesar
    5949 5-isopropyl-1hCC(C)c1cc(n[n 155 678694 http://www.aAlfa Aesar
    5950 5-isopropyl-2 B(c1cc(ccc1OC 86 3781378 http://www.aAlfa Aesar
    5951 5-isopropylbarCC(C)C1C(=O 215 73882 http://www.aAlfa Aesar
    5952 5-mercapto-1-Cn1c(nnn1)S 127 2005963 http://www.aAlfa Aesar
    5953 5-methoxy-1- COc1ccc2c(c1 109 71124 http://www.aAlfa Aesar
    5954 5-methoxy-1-m
    Cn1cc(c2c1cc 135 807739 http://www.aAlfa Aesar
    5955 5-methoxy-2- Cc1nc2cc(ccc 36 68731 http://www.aAlfa Aesar
    5956 5-methoxy-2- Cc1cc2cc(ccc 87 63808 http://www.aAlfa Aesar
    5957 5-methoxy-2-nCOc1ccc(c(c1) 133 300677 http://www.aAlfa Aesar
    5958 5-methoxybenCOc1ccc2c(c1 122 70955 http://www.aAlfa Aesar
    5959 5-methoxybenCOc1ccc2c(c1) 117 284177 http://www.aAlfa Aesar
    5960 5-methoxyfla COc1cccc2c1c( 130 85301 http://www.aAlfa Aesar
    5961 5-methoxyindCOc1ccc2c(c1) 54 13272 http://www.aAlfa Aesar
    5962 5-methoxyindCOc1ccc2c(c1) 181 74683 http://www.aAlfa Aesar
    5963 5-methoxyisatCOc1ccc2c(c1 201 35133 http://www.aAlfa Aesar
    5964 5-methoxypipCOC1(CC2=C( 129 10781190 http://www.aAlfa Aesar
    5965 5-methyl-1,10Cc1cc2cccnc2 113 65627 http://www.aAlfa Aesar
    5966 5-methyl-1h-bCc1ccc2c(c1)n 81 8381 http://www.aAlfa Aesar
    5967 5-methyl-1h-iCc1ccc2c(c1)c 111 10384562 http://www. Alfa Aesar
    5968 5-methyl-1-phCc1c(cnn1c2c 167 128103 http://www.aAlfa Aesar
    5969 5-methyl-2(3hCc1ccc2c(c1)[ 224 619381 http://www.aAlfa Aesar
    5970 5-methyl-2-furCc1ccc(o1)C(= 29 2040600 http://www. Alfa Aesar
    5971 5-methyl-2-h CC(C)CCC(=O) -74 7743 http://www.aAlfa Aesar
    5972 5-methyl-2-nitCc1ccc(c(c1)N 108 10878 http://www.aAlfa Aesar
    5973 5-methyl-2-niCc1ccc(c(c1)C 135 17349 http://www.aAlfa Aesar
    5974 5-methyl-2-niCc1ccc(c(c1)O 55 12263 http://www.aAlfa Aesar
    5975 5-methyl-2-thiCc1c[nH]c(=S 285 628889 http://www.aAlfa Aesar
    5976 5-methyl-3-phCc1nc(no1)c2c 35 89240 http://www.aAlfa Aesar
    5977 5-methyl-4-phe
    Cc1c(nc(s1)c2 86 25027434 http://www. Alfa Aesar
    5978 5-methyl-4-phe
    Cc1c(nc(s1)c2 80 25027431 http://www. Alfa Aesar
    5979 5-methyl-4-phe
    Cc1c(nc(s1)c2 84 25027432 http://www. Alfa Aesar
    5980 5-methylbenzCc1ccc2c(c1)n 115 11484 http://www.aAlfa Aesar
    5981 5-methylbenzCc1ccc2c(c1)c 34 76088 http://www.aAlfa Aesar
    5982 5-methylbenzCc1ccc2c(c1)n 97 123905 http://www.aAlfa Aesar
    5983 5-methylbenzCc1ccc2c(c1)n 43 2007084 http://www.aAlfa Aesar
    5984 5-methylcycloCC1CC(=O)CC( 128 403129 http://www.aAlfa Aesar
    5985 5-methylhydaCC1C(=O)NC( 151 62429 http://www.aAlfa Aesar
    5986 5-methylimidaCc1c(nc[nH]1 168 2074763 http://www.aAlfa Aesar
    5987 5-methylindolCc1ccc2c(c1)c 60 11483 http://www.aAlfa Aesar
    5988 5-methylisopht
    Cc1cc(cc(c1)C 299 61445 http://www.aAlfa Aesar
    5989 5-methylisopht
    Cc1cc(cc(c1) 164 2017778 http://www.aAlfa Aesar
    5990 5-methylisoxazCc1cc(no1)C( 172 69397 http://www.aAlfa Aesar
    5991 5-methylisoxazCc1c(cno1)C( 147 1180751 http://www.aAlfa Aesar
    5992 5-methylnicotCc1cc(cnc1)C 167 59003 http://www.aAlfa Aesar
    5993 5-methylnicotiCc1cc(cnc1)C 213 224685 http://www.aAlfa Aesar
    5994 5-methylpyrimCc1cncnc1 30 67424 http://www.aAlfa Aesar
    5995 5-methylquinoCc1cccc2c1nc 21 55574 http://www.aAlfa Aesar
    5996 5-methylsalicyCc1ccc(c(c1)C 153 6707 http://www.aAlfa Aesar
    5997 5-methylthio-1CSc1nnc(s1)S 137 1042223 http://www.aAlfa Aesar
    5998 5-methylthiopCc1ccc(s1)C(= 137 67286 http://www.aAlfa Aesar
    5999 5-n-hexylthio-CCCCCCSc1nnc 75 2018180 http://www.aAlfa Aesar
    6000 5-nitro-1,10- c1cc2cc(c3ccc 203 65626 http://www.aAlfa Aesar
    6001 5-nitro-1h-indc1cc2c(cc1[N+ 210 20208 http://www.aAlfa Aesar
    6002 5-nitro-2-(n- CCCNc1ccc(cn1 95 105159 http://www. Alfa Aesar
    6003 5-nitro-2-fur c1cc(oc1C=O)[ 36 12249 http://www.aAlfa Aesar
    6004 5-nitro-2-furaCC(=O)OC(c1cc 90 6830 http://www.aAlfa Aesar
    6005 5-nitro-2-furoc1cc(oc1C(=O) 187 12057 http://www.aAlfa Aesar
    6006 5-nitro-2-furonc1cc(oc1C#N)[ 63 85608 http://www.aAlfa Aesar
    6007 5-nitro-2-furoc1cc(oc1C(=O) 40 81899 http://www.aAlfa Aesar
    6008 5-nitrobenzimc1cc2c(cc1[N+ 209 6927 http://www.aAlfa Aesar
    6009 5-nitroindole c1cc2c(cc[nH] 141 21124 http://www.aAlfa Aesar
    6010 5-nitroindolinc1cc2c(cc1[N+ 93 33305 http://www.aAlfa Aesar
    6011 5-nitroisophthc1c(cc(cc1C(= 262 11572 http://www.aAlfa Aesar
    6012 5-nitroisopht COC(=O)c1cc(c 183 67347 http://www.aAlfa Aesar
    6013 5-nitroisoquinc1cc2cnccc2c( 108 62303 http://www.aAlfa Aesar
    6014 5-nitro-m-xyl Cc1cc(cc(c1)[ 71 7148 http://www.aAlfa Aesar
    6015 5-nitrosalicyli c1cc(c(cc1[N+ 232 7042 http://www.aAlfa Aesar
    6016 5-nitrothiophec1cc(sc1C#N)[ 44 452961 http://www.aAlfa Aesar
    6017 5-nitrothioph c1cc(sc1C=O)[ 74 70653 http://www.aAlfa Aesar
    6018 5-nitrouracil c1c(c(=O)[nH] 300 62351 http://www.aAlfa Aesar
    6019 5-nitrovanillinCOc1cc(cc(c1O 176 73200 http://www.aAlfa Aesar
    6020 5-nonanol CCCCC(CCCC) 5 11702 http://www.aAlfa Aesar
    6021 5-nonanone CCCCC(=O)CC -50 9976 http://www.aAlfa Aesar
    6022 5-norborneneC1[C@@H]2C= 84 10308731 http://www. Alfa Aesar
    6023 5-oxo-5-(2-thic1cc(sc1)C(= 96 223696 http://www.aAlfa Aesar
    6024 5-phenyl-1,3,4c1ccc(cc1)c2n 220 642445 http://www.aAlfa Aesar
    6025 5-phenyl-2,4- c1ccc(cc1)C= 165 66415 http://www.aAlfa Aesar
    6026 5-phenylvaleric1ccc(cc1)CC 59 15886 http://www.aAlfa Aesar
    6027 5-tert-butyl-1 Cc1cc(cc(c1C) 32 60175 http://www.aAlfa Aesar
    6028 5-tert-butyl- Cc1cc(cc(c1I)C 56 2021590 http://www.aAlfa Aesar
    6029 5-tert-butyl- B(c1cc(ccc1OC 105 21241262 http://www.aAlfa Aesar
    6030 5-tert-butyl- CC(C)(C)c1ccc 75 5373888 http://www.aAlfa Aesar
    6031 5-tert-butyl-2 Cc1c(cc(o1)C( 92 2023711 http://www.aAlfa Aesar
    6032 5-tert-butyl- Cc1cc(cc(c1)C( -22 7100 http://www.aAlfa Aesar
    6033 5-tert-butylpyCC(C)(C)c1cc( 135 519492 http://www.aAlfa Aesar
    6034 5-undecanol CCCCCCC(CCC -4 89117 http://www.aAlfa Aesar
    6035 5-undecanoneCCCCCCC(=O) 2 89118 http://www.aAlfa Aesar
    6036 6-(1-piperidinc1cc(ncc1C=O 43 2044659 http://www. Alfa Aesar
    6037 6-(4-bromophe
    c1cc(ccc1C2= 169 600486 http://www. Alfa Aesar
    6038 6(5h)-phenantc1ccc2c(c1)c3 291 1785 http://www.aAlfa Aesar
    6039 6-(methylthioCSc1c2c([nH] 222 5574 http://www.aAlfa Aesar
    6040 6-(trifluoromec1cc(cc2c1cc[ 103 2057801 http://www.aAlfa Aesar
    6041 6-(trifluoromec1cc(ncc1C(=O 192 2057829 http://www.aAlfa Aesar
    6042 6,2'-dichloro- c1cc(ncc1c2cc 222 21242393 http://www. Alfa Aesar
    6043 6,6'-dibromo-2c1cc(nc(c1)Br 168 21242321 http://www. Alfa Aesar
    6044 6,6-dimethyl- CC1(OC(=O)C2 65 72019 http://www.aAlfa Aesar
    6045 6,7,8,9,10,11 c1ccc2c(c1)c3 74 239912 http://www.aAlfa Aesar
    6046 6,8-dibromococ1c2cc(c(=O)o 223 633479 http://www.aAlfa Aesar
    6047 6,9-dichloro- COc1ccc2c(c1) 164 59946 http://www.aAlfa Aesar
    6048 6-[(2-methoxyCn1c(c(c(=O) 137 25027442 http://www. Alfa Aesar
    6049 6-acetamidoheCC(=O)NCCCC 104 1928 http://www.aAlfa Aesar
    6050 6-acetoxy-2-nCC(=O)Oc1ccc 221 78512 http://www.aAlfa Aesar
    6051 6-acetyl-1,2, CC(=O)c1ccc2 -21 63080 http://www.aAlfa Aesar
    6052 6-acetyl-1,4- CC(=O)c1ccc2 83 68627 http://www.aAlfa Aesar
    6053 6-acetyl-2(3h CC(=O)c1ccc2c 192 600433 http://www. Alfa Aesar
    6054 6-acetyl-2(3h CC(=O)c1ccc2c 236 600434 http://www. Alfa Aesar
    6055 6-acetyl-2h-1 CC(=O)c1ccc2 196 2876051 http://www. Alfa Aesar
    6056 6-amino-1-he C(CCCO)CCN 57 18801 http://www.aAlfa Aesar
    6057 6-amino-2-metCc1ccc2cc(cc 190 93167 http://www.aAlfa Aesar
    6058 6-amino-3-br Cc1c(ccc(n1)N 81 149219 http://www.aAlfa Aesar
    6059 6-amino-3-cyaCc1c(ccc(n1) 165 2073554 http://www. Alfa Aesar
    6060 6-aminobenzoc1cc2c(cc1N)s 88 61585 http://www.aAlfa Aesar
    6061 6-aminohexano
    C(CCC(=O)O)C 211 548 http://www.aAlfa Aesar
    6062 6-aminoindol c1cc(cc2c1cc[ 73 224584 http://www.aAlfa Aesar
    6063 6-aminonicot c1cc(ncc1C(= 247 9128 http://www.aAlfa Aesar
    6064 6-aminophthac1cc2c(cc1N) 184 84519 http://www.aAlfa Aesar
    6065 6-aminoquinolc1cc2cc(ccc2n 117 10895 http://www.aAlfa Aesar
    6066 6-aminouracilc1c([nH]c(=O 360 63308 http://www.aAlfa Aesar
    6067 6-aza-2-thiot Cc1c(=O)[nH]c 220 1061203 http://www.aAlfa Aesar
    6068 6-azathymine Cc1c(=O)[nH] 213 63453 http://www.aAlfa Aesar
    6069 6-azauracil c1c(=O)[nH]c( 276 61352 http://www.aAlfa Aesar
    6070 6-benzoylhexac1ccc(cc1)C( 85 305793 http://www.aAlfa Aesar
    6071 6-benzyladenic1ccc(cc1)CN 231 56177 http://www.aAlfa Aesar
    6072 6-benzyloxyinc1ccc(cc1)COc 115 228921 http://www.aAlfa Aesar
    6073 6-benzyloxypyB(c1ccc(nc1)O 109 16498192 http://www. Alfa Aesar
    6074 6-bromo-1,1,4CC1(CCC(c2c1c 36 197150 http://www. Alfa Aesar
    6075 6-bromo-2,3-dc1cc(c(c(c1F) 41 8053528 http://www. Alfa Aesar
    6076 6-bromo-2'-chlc1cc(nc(c1)Br 141 21242352 http://www. Alfa Aesar
    6077 6-bromo-2'-chlc1cc(c(nc1)Cl) 161 21242381 http://www. Alfa Aesar
    6078 6-bromo-2h-1,c1cc2c(cc1Br 223 10619713 http://www. Alfa Aesar
    6079 6-bromo-2-meCc1ccc2cc(ccc 103 456115 http://www. Alfa Aesar
    6080 6-bromo-2-nap
    c1cc(cc2c1cc( 294 3743716 http://www.aAlfa Aesar
    6081 6-bromo-2-nac1cc(cc2c1cc( 128 25264 http://www.aAlfa Aesar
    6082 6-bromo-3-buCCCC(=O)c1cc 164 2078401 http://www.aAlfa Aesar
    6083 6-bromo-4-met
    B(c1cnc(cc1C) 164 21242339 http://www. Alfa Aesar
    6084 6-bromo-6'-chlc1cc(ncc1c2cc 244 21242388 http://www. Alfa Aesar
    6085 6-bromobenzoc1cc2c(cc1Br) 53 2074053 http://www. Alfa Aesar
    6086 6-bromocoumar
    c1cc2c(cc1Br) 195 605012 http://www.aAlfa Aesar
    6087 6-bromohexanC(CCC(=O)O)C 34 19037 http://www.aAlfa Aesar
    6088 6-bromoindolc1cc(cc2c1cc[ 92 589197 http://www.aAlfa Aesar
    6089 6-bromonicotic1cc(ncc1C(=O 184 208731 http://www. Alfa Aesar
    6090 6-bromopiperc1c(c(cc2c1O 129 85777 http://www.aAlfa Aesar
    6091 6-bromopyridc1cc(nc(c1)Br 81 2037769 http://www.aAlfa Aesar
    6092 6-bromoveratCOc1cc(c(cc1 150 71671 http://www.aAlfa Aesar
    6093 6-chloro-1,3-dCn1c(=O)cc(n( 110 73485 http://www.aAlfa Aesar
    6094 6-chloro-2,3- c1cc2c(cc1Cl 148 2038152 http://www. Alfa Aesar
    6095 6-chloro-2,3- c1cc2c(cc1Cl 131 2575196 http://www. Alfa Aesar
    6096 6-chloro-2,4- COc1cc(nc(n1) 72 72791 http://www.aAlfa Aesar
    6097 6-chloro-2-fl Cc1ccc(c(c1F) 151 2054076 http://www.aAlfa Aesar
    6098 6-chloro-2-fl Cc1ccc(c(c1F) 136 2054081 http://www.aAlfa Aesar
    6099 6-chloro-2-fluCc1ccc(c(c1F) 57 16499435 http://www. Alfa Aesar
    6100 6-chloro-2-fl Cc1ccc(c(c1F) 57 2054086 http://www.aAlfa Aesar
    6101 6-chloro-2-fl Cc1ccc(c(c1F) 48 2054096 http://www.aAlfa Aesar
    6102 6-chloro-2-fl c1[nH]c2c(n1) 152 4450184 http://www. Alfa Aesar
    6103 6-chloro-2h-c c1cc2c(cc1Cl 243 518903 http://www.aAlfa Aesar
    6104 6-chloro-2-meCc1c(ccc(n1)C 56 221836 http://www. Alfa Aesar
    6105 6-chloro-3-io Cc1c(ccc(n1)Cl 32 21242438 http://www. Alfa Aesar
    6106 6-chloro-3-pyrc1cc(ncc1CC(= 174 11217756 http://www. Alfa Aesar
    6107 6-chloro-4-hydc1cc2c(cc1Cl)c 279 2018267 http://www.aAlfa Aesar
    6108 6-chloro-4-hy Cc1c(ncnc1Cl) 202 21328676 http://www. Alfa Aesar
    6109 6-chloro-5-fl c1c2c(cc(c1Cl 149 2018193 http://www.aAlfa Aesar
    6110 6-chloro-5-meB(c1cc(c(nc1) 182 16498236 http://www. Alfa Aesar
    6111 6-chloro-7-m Cc1cc2c(cc1Cl 171 600119 http://www. Alfa Aesar
    6112 6-chlorochro c1cc2c(cc1Cl 102 85971 http://www.aAlfa Aesar
    6113 6-chloroindol c1cc(cc2c1cc[ 89 78578 http://www.aAlfa Aesar
    6114 6-chloronicot c1cc(ncc1C(=O 215 72667 http://www.aAlfa Aesar
    6115 6-chloronicotic1cc(ncc1C(=O 50 2062334 http://www.aAlfa Aesar
    6116 6-chloropiper c1c(c(cc2c1O 116 123476 http://www.aAlfa Aesar
    6117 6-chloropiperoc1c(c(cc2c1O 70 5378370 http://www.aAlfa Aesar
    6118 6-chloropiperoc1c(c(cc2c1OC 64 81349 http://www.aAlfa Aesar
    6119 6-chloropyridic1cc(nc(c1)Cl 194 19588 http://www.aAlfa Aesar
    6120 6-chloropyridiB(c1ccc(nc1)C 156 3070444 http://www.aAlfa Aesar
    6121 6-chloropyrid c1cc(ncc1CO)C 48 154274 http://www.aAlfa Aesar
    6122 6-chloroquinoc1cc2cc(ccc2n 35 62378 http://www.aAlfa Aesar
    6123 6-cyanonicotinc1cc(ncc1C(= 192 2041839 http://www.aAlfa Aesar
    6124 6-dimethylamiCn1c(c(c(=O) 139 25027443 http://www. Alfa Aesar
    6125 6-ethoxy-2-meCCOc1ccc2c(c1 199 627838 http://www.aAlfa Aesar
    6126 6-ethoxypyridB(c1ccc(nc1) 103 10689691 http://www.aAlfa Aesar
    6127 6-fluoro-1-in c1cc2c(cc1F)C 58 1249443 http://www.aAlfa Aesar
    6128 6-fluoro-2,3- COc1ccc(c(c1 46 8901481 http://www. Alfa Aesar
    6129 6-fluoro-2-meCc1ccc2cc(ccc 54 63949 http://www.aAlfa Aesar
    6130 6-fluorochro c1cc2c(cc1F) 115 2015065 http://www.aAlfa Aesar
    6131 6-fluoroindolec1cc(cc2c1cc[ 76 311904 http://www.aAlfa Aesar
    6132 6-fluoropyrid c1cc(nc(c1)F) 136 2049916 http://www. Alfa Aesar
    6133 6-fluoropyridic1cc(nc(c1)F) 141 196531 http://www. Alfa Aesar
    6134 6-fluorosalicy c1cc(c(c(c1)F 38 2018969 http://www.aAlfa Aesar
    6135 6-fluorosalicylc1cc(c(c(c1)F 160 510041 http://www.aAlfa Aesar
    6136 6-fluoroverat COc1cc(c(cc1 99 524706 http://www.aAlfa Aesar
    6137 6-heptenoic aC=CCCCCC(=O -6 63871 http://www.aAlfa Aesar
    6138 6-hexadecanoCCCCCCCCCCC 37 84621 http://www.aAlfa Aesar
    6139 6-hydroxy-2,4Cc1cc(nc(n1)C 199 73165 http://www.aAlfa Aesar
    6140 6-hydroxy-2h-c1cc2c(cc1O) 241 205674 http://www.aAlfa Aesar
    6141 6-hydroxy-2h c1cc2c(cc1O) 165 3957602 http://www.aAlfa Aesar
    6142 6-hydroxy-2-nc1cc(cc2c1cc( 249 77161 http://www.aAlfa Aesar
    6143 6-hydroxy-4- Cc1cc(=O)oc2c 248 67942 http://www.aAlfa Aesar
    6144 6-hydroxyflav c1ccc(cc1)c2c 235 65233 http://www.aAlfa Aesar
    6145 6-hydroxynicotc1cc(ncc1C(= 315 65756 http://www.aAlfa Aesar
    6146 6-methoxy-1- COc1ccc2c(c1 103 295996 http://www.aAlfa Aesar
    6147 6-methoxy-1-tCOc1ccc2c(c1 79 13490 http://www.aAlfa Aesar
    6148 6-methoxy-2( COc1ccc2c(c1 154 10317 http://www.aAlfa Aesar
    6149 6-methoxy-2-m
    Cc1ccc2cc(cc 64 63814 http://www.aAlfa Aesar
    6150 6-methoxy-2- COc1ccc2cc(c 81 69437 http://www.aAlfa Aesar
    6151 6-methoxy-2-nCOc1ccc2cc(c 193 309966 http://www.aAlfa Aesar
    6152 6-methoxy-2-tCOc1ccc2c(c1 35 68107 http://www.aAlfa Aesar
    6153 6-methoxyfla COc1ccc2c(c1 142 88333 http://www.aAlfa Aesar
    6154 6-methoxyfla COc1ccc2c(c1) 164 129764 http://www.aAlfa Aesar
    6155 6-methoxyindCOc1ccc2cc[n 92 69121 http://www.aAlfa Aesar
    6156 6-methoxypyriB(c1ccc(nc1)O 133 2016120 http://www.aAlfa Aesar
    6157 6-methoxypyriCOc1ccc(cn1) 51 2610366 http://www. Alfa Aesar
    6158 6-methoxyquiCOc1ccc2c(c1 19 14170 http://www.aAlfa Aesar
    6159 6-methyl-1,2, Cc1ccc2c(c1) 35 60044 http://www.aAlfa Aesar
    6160 6-methyl-1-i Cc1ccc2c(c1) 58 2073976 http://www.aAlfa Aesar
    6161 6-methyl-2-pyCc1cccc(n1)C 33 63901 http://www. Alfa Aesar
    6162 6-methyl-3(2hCc1ccc(=O)[n 144 75205 http://www.aAlfa Aesar
    6163 6-methyl-4-tr Cc1cc(cc(=O)[ 130 2063136 http://www.aAlfa Aesar
    6164 6-methyl-5-heCC(=CCCC(=O) -67 9478 http://www.aAlfa Aesar
    6165 6-methyl-5-niCc1ccc2c(c1[N 117 81255 http://www.aAlfa Aesar
    6166 6-methylchrom
    Cc1ccc2c(c1)c 152 600117 http://www. Alfa Aesar
    6167 6-methylcoumCc1ccc2c(c1)c 76 6825 http://www.aAlfa Aesar
    6168 6-methylindolCc1ccc2cc[nH 31 121576 http://www.aAlfa Aesar
    6169 6-methylindolCc1ccc2c(c1) 187 3964546 http://www.aAlfa Aesar
    6170 6-methylnicotCc1ccc(cn1)C 197 86975 http://www.aAlfa Aesar
    6171 6-methylnicotiCc1ccc(cn1)C 213 121509 http://www.aAlfa Aesar
    6172 6-methylpyridCc1cccc(n1)C 31 63902 http://www. Alfa Aesar
    6173 6-methylpyridiCc1cccc(n1)C 129 63466 http://www. Alfa Aesar
    6174 6-methylquinoCc1ccc2c(c1)c -22 6792 http://www.aAlfa Aesar
    6175 6-methyluraciCc1cc(=O)[nH] 319 11780 http://www.aAlfa Aesar
    6176 6-nitro-1h-indc1cc2cn[nH]c2 181 22661 http://www.aAlfa Aesar
    6177 6-nitro-2(3h) c1cc2c(cc1[N+ 246 70788 http://www. Alfa Aesar
    6178 6-nitrobenzotc1cc2c(cc1[N+ 175 68735 http://www.aAlfa Aesar
    6179 6-nitrocoumarc1cc(=O)oc2c1 188 68447 http://www.aAlfa Aesar
    6180 6-nitroindole c1cc(cc2c1cc[ 143 70866 http://www.aAlfa Aesar
    6181 6-nitroindolinc1cc2c(cc1[N+ 68 27653 http://www.aAlfa Aesar
    6182 6-nitrophthalic1cc2c(cc1[N+ 143 194210 http://www.aAlfa Aesar
    6183 6-nitropiperonc1c(c(cc2c1O 95 12310 http://www.aAlfa Aesar
    6184 6-nitropiperonc1c(c(cc2c1OC 123 452806 http://www.aAlfa Aesar
    6185 6-nitroveratr COc1cc(c(cc1O 133 79856 http://www.aAlfa Aesar
    6186 6-phenylhexanc1ccc(cc1)CC 18 71995 http://www.aAlfa Aesar
    6187 7-(3-methoxypr
    Cn1c2c(cc(n2 166 25027444 http://www. Alfa Aesar
    6188 7-(trifluoromec1cc2c(cc1C(F 32 2061327 http://www.aAlfa Aesar
    6189 7-(trifluoromec1cc2ccc(cc2n 66 404515 http://www. Alfa Aesar
    6190 7,8-dihydroxyCc1cc(=O)oc2 243 4511725 http://www.aAlfa Aesar
    6191 7-amino-4-(mCOCc1cc(=O)o 184 453088 http://www.aAlfa Aesar
    6192 7-amino-4-(tr c1cc2c(cc(=O) 223 90930 http://www.aAlfa Aesar
    6193 7-amino-4-meCc1cc(=O)oc2c 227 83285 http://www.aAlfa Aesar
    6194 7-amino-5-br c1c[nH]c2c1cc 105 5373886 http://www.aAlfa Aesar
    6195 7-aminoheptan
    C(CCCN)CCC( 195 12991 http://www. Alfa Aesar
    6196 7-aminoindol c1cc2cc[nH]c2 91 100140 http://www.aAlfa Aesar
    6197 7-azaindole c1cc2cc[nH]c 105 8867 http://www.aAlfa Aesar
    6198 7-azaindole-5-c1c[nH]c2c1c 228 9963029 http://www. Alfa Aesar
    6199 7-benzoylheptc1ccc(cc1)C( 81 263987 http://www.aAlfa Aesar
    6200 7-benzyloxyinc1ccc(cc1)COc 72 228915 http://www. Alfa Aesar
    6201 7-benzyloxyinc1ccc(cc1)CO 154 228916 http://www. Alfa Aesar
    6202 7-bromo-1,2,3c1cc2c(cc1Br 34 8904588 http://www.aAlfa Aesar
    6203 7-bromo-1-chlc1cc(cc2c1ccn 124 5002454 http://www.aAlfa Aesar
    6204 7-bromo-1h-i c1cc2cn[nH]c2 128 15394453 http://www. Alfa Aesar
    6205 7-bromo-1-hyd
    c1cc(cc2c1ccn 249 9451133 http://www.aAlfa Aesar
    6206 7-bromo-2h-1,c1cc2c(cc1Br 212 600445 http://www. Alfa Aesar
    6207 7-bromoacetylc1cc2c(cc1C( 76 2056707 http://www. Alfa Aesar
    6208 7-bromoindolc1cc2cc[nH]c2 43 2037780 http://www.aAlfa Aesar
    6209 7-bromoisatinc1cc2c(c(c1) 197 1721357 http://www. Alfa Aesar
    6210 7-bromoisoquic1cc(cc2c1cc[n 180 19190255 http://www. Alfa Aesar
    6211 7-chloro-2h-1c1cc2c(cc1Cl) 214 190176 http://www. Alfa Aesar
    6212 7-chloro-4-hy c1cc2c(ccnc2c 280 59961 http://www.aAlfa Aesar
    6213 7-chloroindol c1cc2cc[nH]c2 58 94470 http://www.aAlfa Aesar
    6214 7-diethylaminCCN(CC)c1ccc2 74 6783 http://www.aAlfa Aesar
    6215 7-ethoxy-4-m CCOc1ccc2c(c 115 59963 http://www.aAlfa Aesar
    6216 7-ethoxybenzoCCOc1cccc2c1 198 643334 http://www.aAlfa Aesar
    6217 7-ethoxycoumCCOc1ccc2ccc 90 32841 http://www.aAlfa Aesar
    6218 7-fluoro-1,2,3c1cc2c(cc1F) 224 14126740 http://www. Alfa Aesar
    6219 7-fluorobenzoc1cc(c2c(c1F) 144 108876 http://www.aAlfa Aesar
    6220 7-fluoroindolec1cc2cc[nH]c2 62 2054901 http://www.aAlfa Aesar
    6221 7-fluoroisatin c1cc2c(c(c1) 194 509738 http://www. Alfa Aesar
    6222 7h-benz[de]anc1ccc2c(c1)-c 173 6442 http://www.aAlfa Aesar
    6223 7-hexadecanoCCCCCCCCCC( 37 89120 http://www.aAlfa Aesar
    6224 7-hydroxy-3,4c1cc2c(cc1O) 232 2065611 http://www. Alfa Aesar
    6225 7-hydroxy-4- COCc1cc(=O)o 127 4537972 http://www.aAlfa Aesar
    6226 7-hydroxy-4-( c1cc2c(cc(=O) 179 4525103 http://www.aAlfa Aesar
    6227 7-hydroxy-5-me
    Cc1cc(n2c(n1 283 10466603 http://www.aAlfa Aesar
    6228 7-hydroxycouc1cc(cc2c1ccc 230 4444774 http://www.aAlfa Aesar
    6229 7-hydroxyflav c1ccc(cc1)C2 188 1819 http://www.aAlfa Aesar
    6230 7-hydroxyflav c1ccc(cc1)c2c 246 4445181 http://www.aAlfa Aesar
    6231 7-hydroxyisoqc1cc(cc2c1ccn 227 404656 http://www.aAlfa Aesar
    6232 7-methoxy-1,4COc1ccc2c(c1 185 357554 http://www. Alfa Aesar
    6233 7-methoxy-4-m
    Cc1cc(=O)[nH] 206 665802 http://www. Alfa Aesar
    6234 7-methoxy-4- Cc1cc(=O)oc2 161 346415 http://www.aAlfa Aesar
    6235 7-methoxybenz
    COc1cccc2c1o 219 526808 http://www.aAlfa Aesar
    6236 7-methoxycouCOc1ccc2ccc( 119 10295 http://www.aAlfa Aesar
    6237 7-methoxyfla COc1ccc2c(c1 88 2103199 http://www.aAlfa Aesar
    6238 7-methoxyfla COc1ccc2c(=O) 110 409827 http://www.aAlfa Aesar
    6239 7-methyl-4-inCc1ccc(c2c1C 81 77020 http://www.aAlfa Aesar
    6240 7-methyl-8-niCc1ccc2cccnc2 186 73986 http://www.aAlfa Aesar
    6241 7-methylindolCc1cccc2c1[n 84 63459 http://www.aAlfa Aesar
    6242 7-methylindolCc1cccc2c1[n 210 228553 http://www.aAlfa Aesar
    6243 7-nitro-1h-indc1cc2cn[nH]c2 187 1821 http://www.aAlfa Aesar
    6244 7-nitroindole c1cc2cc[nH]c2 95 21878 http://www.aAlfa Aesar
    6245 7-nitroindole-c1cc2cc([nH]c 265 73457 http://www.aAlfa Aesar
    6246 7-pentadecanCCCCCCCCC(= 31 258226 http://www.aAlfa Aesar
    6247 7-phenylheptac1ccc(cc1)CC 20 454436 http://www.aAlfa Aesar
    6248 8-acetoxyquinCC(=O)Oc1ccc 55 68288 http://www.aAlfa Aesar
    6249 8-acetyl-7-hy CC(=O)c1c(cc 169 4549513 http://www. Alfa Aesar
    6250 8-amino-2-na c1cc2ccc(cc2c 208 8055 http://www.aAlfa Aesar
    6251 8-aminooctano
    C(CCCC(=O)O 195 59474 http://www.aAlfa Aesar
    6252 8-aminoquinolc1cc2cccnc2c( 65 10881 http://www.aAlfa Aesar
    6253 8-bromooctano
    C(CCCC(=O)O) 39 477171 http://www.aAlfa Aesar
    6254 8-carboxynap c1cc2cccc(c2c 268 2057462 http://www.aAlfa Aesar
    6255 8-chloro-2-meCc1ccc2cccc(c 67 191819 http://www.aAlfa Aesar
    6256 8-chloro-4-hydc1cc2c(cc(nc2c 139 2018269 http://www.aAlfa Aesar
    6257 8-fluoro-4-hydc1cc2c(cc(nc2c 113 2018981 http://www.aAlfa Aesar
    6258 8-hydroxy-2-mCc1ccc2cccc( 72 12669 http://www.aAlfa Aesar
    6259 8-hydroxy-5-nc1cc2c(ccc(c2 180 18756 http://www.aAlfa Aesar
    6260 8-hydroxy-7- COc1ccc2ccc( 176 129207 http://www.aAlfa Aesar
    6261 8-hydroxyjulolc1cc(c2c3c1C 134 149045 http://www.aAlfa Aesar
    6262 8-hydroxyquinc1cc2cccnc2c( 74 1847 http://www.aAlfa Aesar
    6263 8-hydroxyquino
    c1cc2ccc(nc2c 219 66696 http://www. Alfa Aesar
    6264 8-methoxy-1,2COc1cccc2c1C 142 2859527 http://www.aAlfa Aesar
    6265 8-methoxypsoCOc1c2c(ccc( 148 3971 http://www.aAlfa Aesar
    6266 8-methylquinoCc1cccc2c1nc -80 11416 http://www.aAlfa Aesar
    6267 8-nitroquinolic1cc2cccnc2c( 88 11337 http://www.aAlfa Aesar
    6268 8-phenyloctanc1ccc(cc1)CC 28 453820 http://www.aAlfa Aesar
    6269 9(10h)-acrido c1ccc2c(c1)c( 361 10188539 http://www.aAlfa Aesar
    6270 9-(chloromethc1ccc2c(c1)cc 140 30010 http://www.aAlfa Aesar
    6271 9-(trimethylsi C[Si](C)(C)C1 97 481432 http://www.aAlfa Aesar
    6272 9,10-anthraquc1ccc2c(c1)C 285 13835294 http://www.aAlfa Aesar
    6273 9,10-bis(phenc1ccc(cc1)C#C 255 74309 http://www.aAlfa Aesar
    6274 9,10-dichloro c1ccc2c(c1)c( 213 11307 http://www.aAlfa Aesar
    6275 9,10-diethoxyCCOc1c2ccccc 150 100132 http://www.aAlfa Aesar
    6276 9,10-dihydrobc1cc2ccc3cc4 174 86406 http://www.aAlfa Aesar
    6277 9,10-dimethylCc1c2ccccc2c( 183 12532 http://www.aAlfa Aesar
    6278 9,10-diphenylc1ccc(cc1)c2c 251 14430 http://www.aAlfa Aesar
    6279 9,10-phenant c1ccc2c(c1)-c 210 6505 http://www.aAlfa Aesar
    6280 9,9-dimethylxCC1(c2ccccc2 42 527625 http://www. Alfa Aesar
    6281 9-acetylanthr CC(=O)c1c2cc 74 63106 http://www.aAlfa Aesar
    6282 9-anthracene c1ccc2c(c1)cc 163 66482 http://www.aAlfa Aesar
    6283 9-bromo-9-phc1ccc(cc1)C2( 97 201825 http://www.aAlfa Aesar
    6284 9-bromoanthrc1ccc2c(c1)cc 100 66680 http://www.aAlfa Aesar
    6285 9-bromofluor c1ccc2c(c1)-c 103 15216 http://www.aAlfa Aesar
    6286 9-bromophenac1ccc2c(c1)cc 64 10834 http://www.aAlfa Aesar
    6287 9-chloroanthrc1ccc2c(c1)cc 104 62944 http://www.aAlfa Aesar
    6288 9-decen-1-ol C=CCCCCCCCC -13 23877 http://www.aAlfa Aesar
    6289 9-ethylcarbaz CCn1c2ccccc2 69 6575 http://www.aAlfa Aesar
    6290 9-ethynyl-9-fl C#CC1(c2cccc 110 452564 http://www.aAlfa Aesar
    6291 9-fluorenol c1ccc2c(c1)-c 156 66916 http://www.aAlfa Aesar
    6292 9-fluorenone c1ccc2c(c1)-c 84 9824 http://www.aAlfa Aesar
    6293 9-fluorenone c1ccc2c(c1)- 152 75451 http://www.aAlfa Aesar
    6294 9-fluorenone c1ccc2c(c1)- 194 15683 http://www.aAlfa Aesar
    6295 9-fluorenylidec1ccc2c(c1)- 232 87392 http://www.aAlfa Aesar
    6296 9-fluorenylmec1ccc2c(c1)-c 104 81679 http://www.aAlfa Aesar
    6297 9-fluorenylmec1ccc2c(c1)-c 62 31647 http://www.aAlfa Aesar
    6298 9-fluorenylmec1ccc2c(c1)-c 85 2015007 http://www.aAlfa Aesar
    6299 9-heptadecanCCCCCCCCC(= 52 10425 http://www.aAlfa Aesar
    6300 9-isopropylca CC(C)n1c2ccc 120 66507 http://www. Alfa Aesar
    6301 9-methylanth Cc1c2ccccc2c 80 12524 http://www.aAlfa Aesar
    6302 9-nitroanthra c1ccc2c(c1)cc 141 11274 http://www.aAlfa Aesar
    6303 9-octadecynoiCCCCCCCCC#C 45 61475 http://www.aAlfa Aesar
    6304 9-vinylanthra C=Cc1c2ccccc 64 16209 http://www.aAlfa Aesar
    6305 abietic acid CC(C)C1=CC2 161 10127 http://www.aAlfa Aesar
    6306 acenaphthenec1cc2cccc3c2c 94 6478 http://www.aAlfa Aesar
    6307 acenaphthenec1cc2cccc3c2 258 6468 http://www.aAlfa Aesar
    6308 acetaldehyde CC=O -128 172 http://www.aAlfa Aesar
    6309 acetaldehyde CdCOC(C)OCC -100 13835836 http://www.aAlfa Aesar
    6310 acetaldehyde CC(OC)OC -113 13854808 http://www.aAlfa Aesar
    6311 acetamide CC(=O)N 79 173 http://www.aAlfa Aesar
    6312 acetanilide CC(=O)Nc1ccc 115 880 http://www.aAlfa Aesar
    6313 acetic acid CC(=O)O 17 171 http://www.aAlfa Aesar
    6314 acetic anhydr CC(=O)OC(=O) -73 7630 http://www.aAlfa Aesar
    6315 acetic hydraziCC(=O)NN 64 13420 http://www.aAlfa Aesar
    6316 acetoacetanil CC(=O)CC(=O) 85 7311 http://www.aAlfa Aesar
    6317 acetobromo-aCC(=O)OC[C@ 87 91958 http://www.aAlfa Aesar
    6318 acetohydroxam
    CC(=O)NO 88 1913 http://www.aAlfa Aesar
    6319 acetone CC(=O)C -94 175 http://www.aAlfa Aesar
    6320 acetone oxim CC(=NO)C 62 60524 http://www.aAlfa Aesar
    6321 acetone semi CC(=NNC(=O) 182 60324 http://www.aAlfa Aesar
    6322 acetonitrile CC#N -47 6102 http://www.aAlfa Aesar
    6323 acetophenoneCC(=O)c1cccc 20 7132 http://www.aAlfa Aesar
    6324 acetyl bromidCC(=O)Br -96 10050 http://www.aAlfa Aesar
    6325 acetyl chlorid CC(=O)Cl -112 6127 http://www.aAlfa Aesar
    6326 acetylacetald CC(=O)CC(OC -83 198921 http://www.aAlfa Aesar
    6327 acridine c1ccc2c(c1)cc 109 8860 http://www.aAlfa Aesar
    6328 acrolein C=CC=O -87 7559 http://www.aAlfa Aesar
    6329 acrylamide C=CC(=O)N 84 6331 http://www.aAlfa Aesar
    6330 acrylic acid C=CC(=O)O 13 6333 http://www.aAlfa Aesar
    6331 acrylonitrile C=CC#N -84 7567 http://www.aAlfa Aesar
    6332 adamantane C1C2CC3CC1C 267 8883 http://www.aAlfa Aesar
    6333 adamantane-1-
    C1C2CC3CC1CC 195 82060 http://www.aAlfa Aesar
    6334 adamantane-1-
    C1C2CC3CC1CC 51 89342 http://www.aAlfa Aesar
    6335 adamantane-1C1C2CC3CC1CC 187 20382 http://www.aAlfa Aesar
    6336 adamantane-1-
    C1C2CC3CC1CC 175 12680 http://www.aAlfa Aesar
    6337 adenosine c1nc(c2c(n1 235 54923 http://www.aAlfa Aesar
    6338 adipamide C(CCC(=O)N)C 226 11858 http://www.aAlfa Aesar
    6339 adipic acid C(CCC(=O)O)C 153 191 http://www.aAlfa Aesar
    6340 adipic acid moCCOC(=O)CCC 29 10807625 http://www.aAlfa Aesar
    6341 adipic dihydraC(CCC(=O)NN 181 59505 http://www.aAlfa Aesar
    6342 adiponitrile C(CCC#N)CC# 2 13876621 http://www.aAlfa Aesar
    6343 adonitol C([C@H]([C@ 103 10254628 http://www.aAlfa Aesar
    6344 albendazole CCCSc1ccc2c( 209 1998 http://www. Alfa Aesar
    6345 alizarin c1ccc2c(c1)C( 288 6056 http://www.aAlfa Aesar
    6346 allyl acetate CC(=O)OCC=C 6 13862665 http://www.aAlfa Aesar
    6347 allyl acetoace CC(=O)CC(=O -85 63867 http://www.aAlfa Aesar
    6348 allyl alcohol C=CCO -129 13872989 http://www.aAlfa Aesar
    6349 allyl bromide C=CCBr -119 7553 http://www.aAlfa Aesar
    6350 allyl chloride C=CCCl -135 13836674 http://www.aAlfa Aesar
    6351 allyl glycidyl C=CCOCC1CO -100 13836520 http://www.aAlfa Aesar
    6352 allyl iodide C=CCI -99 21171407 http://www.aAlfa Aesar
    6353 allyl isothioc C=CCN=C=S -80 21105854 http://www.aAlfa Aesar
    6354 allyl methacryCC(=C)C(=O)O -65 7003 http://www.aAlfa Aesar
    6355 allylamine C=CCN -88 13835977 http://www.aAlfa Aesar
    6356 allylbenzene C=CCc1ccccc1 -50 8950 http://www.aAlfa Aesar
    6357 allylcyclopentC=CCC1CCCC1 -111 69505 http://www.aAlfa Aesar
    6358 allylmalonic a C=CCC(C(=O)O 104 68265 http://www.aAlfa Aesar
    6359 alpha-(4-morpc1ccc(cc1)C( 69 77401 http://www.aAlfa Aesar
    6360 alpha-(phenyltc1ccc(cc1)C(C 100 209324 http://www.aAlfa Aesar
    6361 alpha,alpha,a c1ccc(c(c1)C(B 116 75099 http://www.aAlfa Aesar
    6362 alpha,alpha-dic1ccc(cc1)C(C 75 634077 http://www. Alfa Aesar
    6363 alpha,alpha-dCC(C)(c1ccccc 81 12667 http://www.aAlfa Aesar
    6364 alpha-angelic CC1=CCC(=O) 18 11071 http://www.aAlfa Aesar
    6365 alpha-benzylsuc1ccc(cc1)CC 162 3724 http://www.aAlfa Aesar
    6366 alpha-bromo-2c1ccc(c(c1)C( 107 2054440 http://www.aAlfa Aesar
    6367 alpha-bromocc1ccc(cc1)/C= 70 4520474 http://www.aAlfa Aesar
    6368 alpha-chloral C([C@H]([C@ 183 5414376 http://www.aAlfa Aesar
    6369 alpha-cyanocic1ccc(cc1)/C 175 558329 http://www.aAlfa Aesar
    6370 alpha-cyclohexc1ccc(cc1)C( 54 85999 http://www.aAlfa Aesar
    6371 alpha-D-glucoCC(=O)OC[C@ 111 2005838 http://www.aAlfa Aesar
    6372 alpha-D-talos C([C@H]([C@ 134 89855 http://www.aAlfa Aesar
    6373 alpha-ethyl-3-CC/C(=Cc1cccc 140 4794147 http://www.aAlfa Aesar
    6374 alpha-fluorophc1ccc(cc1)C(C 80 92719 http://www.aAlfa Aesar
    6375 alpha-hydroxyCC(c1ccccc1)( 65 305659 http://www.aAlfa Aesar
    6376 alpha-isopropyCC(C)C(c1cccc 60 17960 http://www.aAlfa Aesar
    6377 alpha-methylcC/C(=Cc1cccc 80 553403 http://www.aAlfa Aesar
    6378 alpha-methylsCC(=C)c1ccccc -23 7129 http://www.aAlfa Aesar
    6379 alpha-naphthoc1ccc(cc1)c2c 158 11297 http://www.aAlfa Aesar
    6380 alpha-naphthoc1ccc2c(c1)c( 239 62215 http://www.aAlfa Aesar
    6381 alpha-phenylcc1ccc(cc1)/C= 173 610577 http://www.aAlfa Aesar
    6382 alpha-pinene CC1=CC[C@@H -62 74205 http://www.aAlfa Aesar
    6383 alpha-p-xyleneCc1ccc(cc1)CS 77 2073540 http://www. Alfa Aesar
    6384 alpha-terpine CC1=CCC(CC1) 32 13850142 http://www.aAlfa Aesar
    6385 alpha-toluenec1ccc(cc1)CS( 103 70690 http://www.aAlfa Aesar
    6386 alpha-toluenesc1ccc(cc1)CS( 92 67312 http://www.aAlfa Aesar
    6387 alpha-toluenesc1ccc(cc1)CS( 93 4620 http://www.aAlfa Aesar
    6388 anabasine c1cc(cnc1)C2 9 21106257 http://www.aAlfa Aesar
    6389 aniline c1ccc(cc1)N -6 5889 http://www.aAlfa Aesar
    6390 anisoin COc1ccc(cc1)C 112 86111 http://www.aAlfa Aesar
    6391 anisole COc1ccccc1 -37 7238 http://www.aAlfa Aesar
    6392 anthracene c1ccc2cc3cccc 216 8111 http://www.aAlfa Aesar
    6393 anthracene-9-c1ccc2c(c1)cc 177 13924 http://www.aAlfa Aesar
    6394 anthranilic ac c1ccc(c(c1)C( 147 222 http://www.aAlfa Aesar
    6395 anthranilic ac c1ccc(cc1)C= 65 6617 http://www.aAlfa Aesar
    6396 anthrone c1ccc2c(c1)C 157 6751 http://www.aAlfa Aesar
    6397 antipyrine Cc1cc(=O)n(n1 113 2121 http://www.aAlfa Aesar
    6398 arachidic acid CCCCCCCCCCC 75 10035 http://www.aAlfa Aesar
    6399 arbutin c1cc(ccc1O) 198 389765 http://www.aAlfa Aesar
    6400 azelaic acid C(CCCC(=O)O) 102 2179 http://www.aAlfa Aesar
    6401 azobenzene c1ccc(cc1)/N= 67 2185 http://www.aAlfa Aesar
    6402 azoxybenzenec1ccc(cc1)/N= 35 9894 http://www.aAlfa Aesar
    6403 azulene c1ccc-2cccc2c 100 8876 http://www.aAlfa Aesar
    6404 bathocuproin Cc1cc(c2ccc3c 282 58658 http://www.aAlfa Aesar
    6405 bathophenantc1ccc(cc1)c2c 220 65648 http://www.aAlfa Aesar
    6406 behenic acid CCCCCCCCCCC 76 7923 http://www.aAlfa Aesar
    6407 benz[a]anthrac1ccc2c(c1)c 170 16332 http://www.aAlfa Aesar
    6408 benzal chloridc1ccc(cc1)C(Cl -16 13882337 http://www.aAlfa Aesar
    6409 benzaldehydec1ccc(cc1)C=O -26 235 http://www.aAlfa Aesar x repeating value clearly out of range cc
    6410 benzaldehydec1ccc(cc1)/C 93 4482129 http://www.aAlfa Aesar
    6411 benzamide c1ccc(cc1)C(= 127 2241 http://www.aAlfa Aesar
    6412 benzanilide c1ccc(cc1)C(= 164 6900 http://www.aAlfa Aesar
    6413 benzene c1ccccc1 5 236 http://www.aAlfa Aesar
    6414 benzeneboroniB(c1ccccc1)(O 217 60191 http://www.aAlfa Aesar
    6415 benzeneselenic1ccc(cc1)[Se 164 78710 http://www.aAlfa Aesar x metal - AL
    6416 benzenesulfo c1ccc(cc1)S(= 153 7092 http://www.aAlfa Aesar
    6417 benzenesulfonc1ccc(cc1)S(= 48 7093 http://www.aAlfa Aesar
    6418 benzenesulfonc1ccc(cc1)S(= 15 7091 http://www.aAlfa Aesar
    6419 benzenesulfonc1ccc(cc1)S(= 103 59146 http://www.aAlfa Aesar
    6420 benzhydrazid c1ccc(cc1)C( 115 11461 http://www.aAlfa Aesar
    6421 benzhydrol c1ccc(cc1)C(c 66 6770 http://www.aAlfa Aesar
    6422 benzhydryl b c1ccc(cc1)C(c 39 206530 http://www.aAlfa Aesar
    6423 benzhydryl chc1ccc(cc1)C(c 19 6768 http://www.aAlfa Aesar
    6424 benzhydryl is c1ccc(cc1)C(c 59 454221 http://www.aAlfa Aesar
    6425 benzhydrylamc1ccc(cc1)C(c 12 6769 http://www.aAlfa Aesar
    6426 benzil c1ccc(cc1)C(= 95 8329 http://www.aAlfa Aesar
    6427 benzilic acid c1ccc(cc1)C(c 150 6220 http://www.aAlfa Aesar
    6428 benzimidazolec1ccc2c(c1)[n 172 5593 http://www.aAlfa Aesar
    6429 benzo[a]pyre c1ccc2c(c1)cc 179 2246 http://www.aAlfa Aesar
    6430 benzo[b]furan-c1ccc2c(c1)cc 194 10778469 http://www.aAlfa Aesar
    6431 benzo[b]furan-c1ccc2c(c1)c( 39 2049922 http://www.aAlfa Aesar
    6432 benzo[b]thio c1ccc2c(c1)cc 30 6951 http://www.aAlfa Aesar
    6433 benzo[b]thiopc1ccc2c(c1)C 138 63189 http://www.aAlfa Aesar
    6434 benzo[b]thiopB(c1cc2ccccc2 255 2269 http://www.aAlfa Aesar
    6435 benzo[b]thiopc1ccc2c(c1)cc 87 125604 http://www.aAlfa Aesar
    6436 benzo[b]thio c1ccc2c(c1)cc 31 643621 http://www.aAlfa Aesar
    6437 benzo[b]thio c1ccc2c(c1)cc 177 206969 http://www.aAlfa Aesar
    6438 benzo[b]thiopc1ccc2c(c1)cc 239 86542 http://www.aAlfa Aesar
    6439 benzo[b]thiopc1ccc2c(c1)cc 186 453083 http://www.aAlfa Aesar
    6440 benzo[b]thio c1ccc2c(c1)cc 100 2056653 http://www. Alfa Aesar
    6441 benzo[b]thiopc1ccc2c(c1)c( 110 63964 http://www.aAlfa Aesar
    6442 benzo[b]thiopc1ccc2c(c1)c( 64 69142 http://www.aAlfa Aesar
    6443 benzo[b]thiopc1ccc2c(c1)c( 175 522713 http://www. Alfa Aesar
    6444 benzo[c]cinnoc1ccc2c(c1)c3 158 8835 http://www.aAlfa Aesar
    6445 benzo[h]quinoc1ccc2c(c1)cc 50 8836 http://www.aAlfa Aesar
    6446 benzo-15-cro c1ccc2c(c1) 80 75956 http://www.aAlfa Aesar
    6447 benzo-18-cro c1ccc2c(c1) 44 509179 http://www.aAlfa Aesar
    6448 benzofurazan c1ccc2c(c1)no 54 60825 http://www.aAlfa Aesar
    6449 benzofuroxanc1ccc2c(c1)no 69 61388 http://www.aAlfa Aesar
    6450 benzofuroxan-c1cc2c(cc1C(= 128 297120 http://www.aAlfa Aesar
    6451 benzoguanamc1ccc(cc1)c2n 227 6797 http://www.aAlfa Aesar
    6452 benzoic acid c1ccc(cc1)C(= 123 238 http://www.aAlfa Aesar
    6453 benzoic anhydc1ccc(cc1)C(= 42 6899 http://www.aAlfa Aesar
    6454 benzoin c1ccc(cc1)C(C 134 8093 http://www.aAlfa Aesar
    6455 benzonitrile c1ccc(cc1)C#N -13 7224 http://www.aAlfa Aesar
    6456 benzophenonc1ccc(cc1)C(= 49 2991 http://www.aAlfa Aesar
    6457 benzopinacol c1ccc(cc1)C(c 177 85502 http://www.aAlfa Aesar
    6458 benzopinacol c1ccc(cc1)C(= 182 61364 http://www.aAlfa Aesar
    6459 benzothiazolec1ccc2c(c1)nc 2 6952 http://www.aAlfa Aesar
    6460 benzothiazolec1ccc2c(c1)nc 114 2056575 http://www.aAlfa Aesar
    6461 benzothiazolec1ccc2c(c1)nc 74 211171 http://www. Alfa Aesar
    6462 benzothiazole-c1cc2c(cc1C# 138 8782511 http://www. Alfa Aesar
    6463 benzothiazole-c1cc2c(cc1C(= 248 523045 http://www. Alfa Aesar
    6464 benzotrichlor c1ccc(cc1)C(Cl -4 13882366 http://www.aAlfa Aesar
    6465 benzotrifluori c1ccc(cc1)C(F) -29 7090 http://www.aAlfa Aesar
    6466 benzoxazole c1ccc2c(c1)nc 30 8873 http://www.aAlfa Aesar
    6467 benzoyl chlor c1ccc(cc1)C(= -1 7134 http://www.aAlfa Aesar
    6468 benzoyl fluori c1ccc(cc1)C(= -28 61314 http://www.aAlfa Aesar
    6469 benzoyl(2-hy c1ccc(cc1)C(= 120 66483 http://www. Alfa Aesar
    6470 benzoylacetoni
    c1ccc(cc1)C( 81 58331 http://www.aAlfa Aesar
    6471 benzyl 2-naphc1ccc(cc1)COc 97 109701 http://www.aAlfa Aesar
    6472 benzyl 3-hydr c1ccc(cc1)COC 80 5379428 http://www.aAlfa Aesar
    6473 benzyl 4-bro c1ccc(cc1)CC( 111 453353 http://www.aAlfa Aesar
    6474 benzyl 4-chlo c1ccc(cc1)CC( 105 203911 http://www.aAlfa Aesar
    6475 benzyl 4-hydr c1ccc(cc1)COC 112 6912 http://www.aAlfa Aesar
    6476 benzyl 5-aminc1ccc(cc1)CO 122 3563677 http://www.aAlfa Aesar
    6477 benzyl 6-hydr c1ccc(cc1)COC 180 5385885 http://www.aAlfa Aesar
    6478 benzyl acetat CC(=O)OCc1cc -51 13850405 http://www.aAlfa Aesar
    6479 benzyl alcoholc1ccc(cc1)CO -15 13860335 http://www.aAlfa Aesar
    6480 benzyl alpha- c1ccc(cc1)COC 71 9036709 http://www. Alfa Aesar
    6481 benzyl benzoac1ccc(cc1)COC 19 13856959 http://www.aAlfa Aesar
    6482 benzyl bromidc1ccc(cc1)CBr -4 13851576 http://www.aAlfa Aesar
    6483 benzyl carbamc1ccc(cc1)CO 87 11638 http://www.aAlfa Aesar
    6484 benzyl carbaz c1ccc(cc1)CO 68 71567 http://www.aAlfa Aesar
    6485 benzyl chloridc1ccc(cc1)CCl -43 13840690 http://www.aAlfa Aesar
    6486 benzyl chloro c1ccc(cc1)COC -20 9958 http://www.aAlfa Aesar
    6487 benzyl cinnamc1ccc(cc1)CO 35 4437893 http://www.aAlfa Aesar
    6488 benzyl cyanoac1ccc(cc1)CO 28 487528 http://www.aAlfa Aesar
    6489 benzyl merca c1ccc(cc1)CS -30 13851383 http://www.aAlfa Aesar
    6490 benzyl methylCOCc1ccccc1 -53 21170543 http://www.aAlfa Aesar
    6491 benzyl methylCS(=O)(=O)Cc 126 69028 http://www.aAlfa Aesar
    6492 benzyl nicotinc1ccc(cc1)CO 22 6923 http://www.aAlfa Aesar
    6493 benzyl phenylc1ccc(cc1)COc 39 63533 http://www.aAlfa Aesar
    6494 benzyl phenyl c1ccc(cc1)CSc 41 12697 http://www.aAlfa Aesar
    6495 benzyl phenylc1ccc(cc1)CS( 149 69027 http://www.aAlfa Aesar
    6496 benzyl propio CCC(=O)OCc1c 222 28960 http://www.aAlfa Aesar
    6497 benzyl salicyl c1ccc(cc1)CO 19 8060 http://www.aAlfa Aesar
    6498 benzyl thiocy c1ccc(cc1)CS 42 17163 http://www.aAlfa Aesar
    6499 benzylamine c1ccc(cc1)CN -43 7223 http://www.aAlfa Aesar
    6500 benzyldiphen c1ccc(cc1)CP( 75 524994 http://www.aAlfa Aesar
    6501 benzylidenea CC(=O)/C=C/c 40 21106584 http://www.aAlfa Aesar
    6502 benzylidenema
    c1ccc(cc1)C= 84 16648 http://www.aAlfa Aesar
    6503 benzyloxycarbCOC(=O)C(NC( 78 2016462 http://www.aAlfa Aesar
    6504 benzylphospho
    c1ccc(cc1)CP( 169 73363 http://www.aAlfa Aesar
    6505 benzylurea c1ccc(cc1)CN 149 10396 http://www.aAlfa Aesar
    6506 beta,2-dinitroc1ccc(c(c1)/C 106 4519923 http://www.aAlfa Aesar
    6507 beta,3-dinitroc1cc(cc(c1)[N 126 4511076 http://www.aAlfa Aesar
    6508 beta,4-dinitroc1cc(ccc1/C=C 204 4511075 http://www.aAlfa Aesar
    6509 beta-bromostyc1ccc(cc1)C=C -8 7384 http://www.aAlfa Aesar
    6510 beta-D-allose C([C@@H]1[C 145 395203 http://www.aAlfa Aesar
    6511 beta-D-galact CC(=O)OC[C@ 144 85491 http://www.aAlfa Aesar
    6512 beta-D-glucosCC(=O)N[C@@ 187 89857 http://www.aAlfa Aesar
    6513 beta-D-ribofurCC(=O)OC[C@ 82 793856 http://www.aAlfa Aesar
    6514 beta-estradiolC[C@]12CC[C 177 5554 http://www.aAlfa Aesar
    6515 beta-ionone CC1=C(C(CCC1 -49 553581 http://www.aAlfa Aesar
    6516 beta-naphthofc1ccc(cc1)c2c 164 2271 http://www.aAlfa Aesar
    6517 beta-propiola C1COC1=O -34 2275 http://www.aAlfa Aesar
    6518 bicyclo[2.2.2] C1CC2CCC1C(= 159 24590520 http://www.aAlfa Aesar
    6519 bicyclo[2.2.2] C1=CC2C3C(C 360 92746 http://www.aAlfa Aesar
    6520 bicyclohexyl C1CCC(CC1)C 4 6827 http://www.aAlfa Aesar
    6521 biphenyl c1ccc(cc1)c2c 71 6828 http://www.aAlfa Aesar
    6522 biphenyl-2-boB(c1ccccc1c2c 179 3781375 http://www.aAlfa Aesar
    6523 biphenyl-2-carc1ccc(cc1)c2c 112 63538 http://www.aAlfa Aesar
    6524 biphenyl-3-boB(c1cccc(c1)c 209 2016067 http://www.aAlfa Aesar
    6525 biphenyl-4,4'-c1cc(ccc1C#N) 234 14584 http://www.aAlfa Aesar
    6526 biphenyl-4-boB(c1ccc(cc1)c 243 133308 http://www.aAlfa Aesar
    6527 biphenyl-4-carc1ccc(cc1)c2c 113 75919 http://www.aAlfa Aesar
    6528 biphenyl-4-ca c1ccc(cc1)c2c 59 69150 http://www.aAlfa Aesar
    6529 biphenyl-4-ca c1ccc(cc1)c2c 228 523754 http://www.aAlfa Aesar
    6530 biphenyl-4-carc1ccc(cc1)c2c 225 60090 http://www.aAlfa Aesar
    6531 biphenyl-4-sulc1ccc(cc1)c2c 115 66801 http://www.aAlfa Aesar
    6532 bis(2-benzamic1ccc(cc1)C(= 142 60603 http://www.aAlfa Aesar
    6533 bis(2-chloroetC(CCl)OCCCl -50 21106016 http://www.aAlfa Aesar
    6534 bis(2-cyanoet c1ccc(cc1)P( 73 303267 http://www.aAlfa Aesar
    6535 bis(2-ethylhexCCCCC(CC)CO -67 7358 http://www.aAlfa Aesar
    6536 bis(2-ethylhe CCCCC(CC)COP -50 8918 http://www.aAlfa Aesar
    6537 bis(2-ethylhexCCCCC(CC)COC -55 21106505 http://www.aAlfa Aesar
    6538 bis(2-hydroxyeC(CSSCCO)O 25 15117 http://www.aAlfa Aesar
    6539 bis(2-methoxyCOc1ccccc1OC 87 10633 http://www.aAlfa Aesar
    6540 bis(2-nitrophec1ccc(c(c1)[N 194 64024 http://www.aAlfa Aesar
    6541 bis(3,5,6-tric CCCCCOC(=O)c1 78 2286073 http://www. Alfa Aesar
    6542 bis(4-aminophc1cc(ccc1N)Oc 191 7298 http://www.aAlfa Aesar
    6543 bis(4-bromophc1cc(ccc1Oc2c 58 15471 http://www.aAlfa Aesar
    6544 bis(4-chlorophc1cc(ccc1SSc2c 73 13721 http://www.aAlfa Aesar
    6545 bis(4-chlorophc1cc(ccc1S(=O 149 6373 http://www.aAlfa Aesar
    6546 bis(4-chlorop c1cc(ccc1SCSc 47 121240 http://www.aAlfa Aesar
    6547 bis(4-fluoro-3 c1cc(c(cc1S(= 194 9028 http://www.aAlfa Aesar
    6548 bis(4-fluorophc1cc(ccc1F)S( 99 61159 http://www.aAlfa Aesar
    6549 bis(4-fluorop c1cc(ccc1Cc2c 29 86740 http://www.aAlfa Aesar
    6550 bis(4-hydroxy c1cc(ccc1O)S( 248 6374 http://www.aAlfa Aesar
    6551 bis(4-methoxyCOc1ccc(cc1) 129 91457 http://www.aAlfa Aesar
    6552 bis(4-methoxyCOc1ccc(cc1) 87 3021458 http://www.aAlfa Aesar
    6553 bis(4-methox COc1ccc(cc1)P 89 452658 http://www.aAlfa Aesar
    6554 bis(4-nitrophec1cc(ccc1[N+] 138 71095 http://www.aAlfa Aesar
    6555 bis(4-nitrophec1cc(ccc1[N+] 254 64034 http://www.aAlfa Aesar
    6556 bis(cyclohexa C1CCC(=NNC( 210 9341 http://www.aAlfa Aesar
    6557 bis(dicyclohe C1CCC(CC1)P 99 537493 http://www.aAlfa Aesar
    6558 bis(dimethyla CN(C)[Si](C)(C -98 69798 http://www.aAlfa Aesar
    6559 bis(diphenylp c1ccc(cc1)P(C 86 71126 http://www.aAlfa Aesar
    6560 bis(diphenyl c1ccc(cc1)P(C 119 67509 http://www.aAlfa Aesar
    6561 bis(hydroxymec1ccc(cc1)P(C 57 174055 http://www. Alfa Aesar
    6562 bis(neopentylB1(OCC(CO1)( 183 2016068 http://www.aAlfa Aesar
    6563 bis(pentabromc1(c(c(c(c(c1B 306 13764 http://www.aAlfa Aesar
    6564 bis(pentafluo c1ccc(cc1)P(c2 62 71096 http://www.aAlfa Aesar
    6565 bis(phenylacetc1ccc(cc1)CC( 59 2623876 http://www.aAlfa Aesar
    6566 bis(phenylthi c1ccc(cc1)SCS 37 69543 http://www.aAlfa Aesar
    6567 bis(trimethylsiC[Si](C)(C)OS( 46 79003 http://www.aAlfa Aesar
    6568 bis(trimethylsC[Si](C)(C)C#C 22 76286 http://www.aAlfa Aesar
    6569 bis(trimethylsC[Si](C)(C)N=C -23 63651 http://www.aAlfa Aesar
    6570 bis(trimethylsC[Si](C)(C)C[Si -71 67582 http://www.aAlfa Aesar
    6571 bis[2-hydroxy Cc1cc(c(c(c1) 135 6241 http://www.aAlfa Aesar
    6572 bisphenol a CC(C)(c1ccc(c 156 6371 http://www.aAlfa Aesar
    6573 boc-on CC(C)(C)OC(= 88 4517159 http://www.aAlfa Aesar
    6574 borneol C[C@]12CC[C 207 1013314 http://www.aAlfa Aesar
    6575 bromoacetic aC(C(=O)O)Br 47 10301338 http://www.aAlfa Aesar
    6576 bromobenzenc1ccc(cc1)Br -31 7673 http://www.aAlfa Aesar
    6577 bromochloroac
    C(C(=O)O)(Cl) 27 11307583 http://www.aAlfa Aesar
    6578 bromocycloheC1CCC(CC1)Br -57 7672 http://www.aAlfa Aesar
    6579 bromodichlor C(Cl)(Cl)Br -57 6119 http://www.aAlfa Aesar
    6580 bromodimethyB(C)(C)Br -129 109839 http://www.aAlfa Aesar
    6581 bromoethaneCCBr -119 6092 http://www.aAlfa Aesar
    6582 bromoform C(Br)(Br)Br 9 13838404 http://www.aAlfa Aesar
    6583 bromopentaflc1(c(c(c(c(c1F -31 21168727 http://www.aAlfa Aesar
    6584 bromopentamCc1c(c(c(c(c1C 162 71166 http://www.aAlfa Aesar
    6585 bromopyruvicC(C(=O)C(=O) 78 63850 http://www.aAlfa Aesar
    6586 bromothymol Cc1c(cc(c(c1B 201 6208 http://www.aAlfa Aesar
    6587 bromotrichlo C(Cl)(Cl)(Cl)Br -6 6143 http://www.aAlfa Aesar
    6588 bromotrimethy
    C[Si](C)(C)Br -44 68599 http://www.aAlfa Aesar
    6589 bromotriphenc1ccc(cc1)C(= 114 14615 http://www.aAlfa Aesar
    6590 bromotriphenc1ccc(cc1)C(c 154 11200 http://www.aAlfa Aesar
    6591 burgess reageCC[N+](CC)(CC 77 2007108 http://www.aAlfa Aesar
    6592 butadiene dieC1[C@@H](O -19 203785 http://www.aAlfa Aesar
    6593 butadiene moC=CC1CO1 -135 12997 http://www.aAlfa Aesar
    6594 butyraldehyd CCCC=O -99 256 http://www.aAlfa Aesar
    6595 butyraldoxim CCCC=NO -29 7778 http://www.aAlfa Aesar
    6596 butyramide CCCC(=O)N 115 10464 http://www.aAlfa Aesar
    6597 butyric acid CCCC(=O)O -8 259 http://www.aAlfa Aesar
    6598 butyric acid h CCCC(=O)NN 44 69525 http://www.aAlfa Aesar
    6599 butyric anhydCCCC(=O)OC( -75 7510 http://www.aAlfa Aesar
    6600 butyronitrile CCCC#N -112 7717 http://www.aAlfa Aesar
    6601 butyrophenonCCCC(=O)c1cc 12 9893 http://www.aAlfa Aesar
    6602 butyryl chlori CCCC(=O)Cl -89 8523 http://www.aAlfa Aesar
    6603 caffeine Cn1cnc2c1c(= 235 2424 http://www.aAlfa Aesar
    6604 calix[4]arene c1cc2c(c(c1)C 317 488909 http://www.aAlfa Aesar
    6605 calix[6]arene c1cc2c(c(c1)C 418 2007000 http://www.aAlfa Aesar
    6606 camphene CC1([C@H]2C 35 389793 http://www.aAlfa Aesar
    6607 camphor CC1(C2CCC1(C 174 2441 http://www.aAlfa Aesar
    6608 camphorquin CC1(C2CCC1(C 200 23544 http://www.aAlfa Aesar
    6609 caps C1CCC(CC1)NC 324 63979 http://www.aAlfa Aesar
    6610 capso C1CCC(CC1)NC 272 2015277 http://www.aAlfa Aesar
    6611 carbazole c1ccc2c(c1)c3 243 6593 http://www.aAlfa Aesar
    6612 carbohydrazidC(=O)(NN)NN 156 66578 http://www.aAlfa Aesar
    6613 carbon disulfi C(=S)=S -112 6108 http://www.aAlfa Aesar
    6614 catechol c1ccc(c(c1)O) 106 13837760 http://www.aAlfa Aesar
    6615 catecholboranB1Oc2ccccc2 12 10617125 http://www.aAlfa Aesar
    6616 chloramphenic1cc(ccc1[C@ 151 5744 http://www.aAlfa Aesar
    6617 chlorendic an C12C(C(=O)OC1 237 7967 http://www.aAlfa Aesar
    6618 chloroacetic aC(C(=O)O)Cl 62 10772140 http://www.aAlfa Aesar
    6619 chloroacetic C(C(=O)OC(=O) 58 21112535 http://www.aAlfa Aesar
    6620 chloroacetoneCC(=O)CCl -45 6323 http://www.aAlfa Aesar
    6621 chloroacetyl cC(C(=O)Cl)Cl -22 13856283 http://www.aAlfa Aesar
    6622 chlorobenzen c1ccc(cc1)Cl -45 7676 http://www.aAlfa Aesar
    6623 chlorobis(2-mCOc1ccccc1P( 113 15927019 http://www. Alfa Aesar
    6624 chlorobis(4-c c1cc(ccc1P(c2c 53 13721424 http://www. Alfa Aesar
    6625 chlorobis(4-mCOc1ccc(cc1)P 63 3581957 http://www. Alfa Aesar
    6626 chlorocycloheC1CCC(CC1)Cl -44 10487 http://www.aAlfa Aesar
    6627 chlorocyclopeC1CCC(C1)Cl -94 63437 http://www.aAlfa Aesar
    6628 chlorodi(1-na c1ccc2c(c1)cc 156 13721399 http://www. Alfa Aesar
    6629 chlorodi(o-tol Cc1ccccc1P(c2 57 3782980 http://www. Alfa Aesar
    6630 chlorodibrom C(Cl)(Br)Br -22 29036 http://www.aAlfa Aesar
    6631 chlorodifluoroC(=O)(C(F)(F)C 22 10800462 http://www.aAlfa Aesar
    6632 chlorodimethyCCCCCCCCCCCC 30 79156 http://www.aAlfa Aesar
    6633 chlorodimethyC[SiH](C)Cl -111 59496 http://www.aAlfa Aesar
    6634 chlorodiphenyc1ccc(cc1)P(c2 15 59567 http://www.aAlfa Aesar
    6635 chloroform C(Cl)(Cl)Cl -63 5977 http://www.aAlfa Aesar
    6636 chlorotriethyl CC[Si](CC)(CC) -75 13221 http://www.aAlfa Aesar
    6637 chlorotrimethyC[Si](C)(C)Cl -58 6157 http://www.aAlfa Aesar
    6638 chlorotriphenc1ccc(cc1)C(c 112 6214 http://www.aAlfa Aesar
    6639 chlorotriphenyc1ccc(cc1)[Si] 94 6216 http://www.aAlfa Aesar
    6640 cholesterol C[C@H](CCCC 149 5775 http://www.aAlfa Aesar
    6641 cholesteryl 2 C[C@H](CCCC 126 5883858 http://www.aAlfa Aesar
    6642 cholesteryl acC[C@H](CCCC 113 2006078 http://www.aAlfa Aesar
    6643 cholesteryl b C[C@H](CCCC 149 2005815 http://www.aAlfa Aesar
    6644 cholesteryl chC[C@H](CCCC 97 83818 http://www.aAlfa Aesar
    6645 cholesteryl c C[C@H](CCCC 118 99842 http://www.aAlfa Aesar
    6646 cholesteryl n CCCCCCCCC(= 77 2005816 http://www.aAlfa Aesar
    6647 cholesteryl ol CCCCCCCC/C= 46 4446726 http://www.aAlfa Aesar
    6648 cholesteryl st CCCCCCCCCCC 80 105677 http://www.aAlfa Aesar
    6649 cholic acid C[C@H](CCC( 201 192176 http://www.aAlfa Aesar
    6650 chromone-3-ca
    c1ccc2c(c1)c( 175 454719 http://www.aAlfa Aesar
    6651 chromone-3-cc1ccc2c(c1)c( 152 78579 http://www.aAlfa Aesar
    6652 chromone-3-ca
    c1ccc2c(c1)c( 201 157979 http://www.aAlfa Aesar
    6653 cinchonidine C=C[C@H]1C[ 204 91930 http://www.aAlfa Aesar
    6654 cinchonine C=C[C@H]1C[ 258 81667 http://www.aAlfa Aesar
    6655 cinnamyl alcoc1ccc(cc1)/C 34 21105870 http://www.aAlfa Aesar
    6656 cinnamyl chloc1ccc(cc1)/C= 7 555070 http://www.aAlfa Aesar
    6657 cinnamyliden c1ccc(cc1)C= 101 86024 http://www.aAlfa Aesar
    6658 cis-1,2-cycloh C1CC[C@@H]( 191 214819 http://www.aAlfa Aesar
    6659 cis-1,2-cycloh C1CC[C@@H]( 34 19972135 http://www.aAlfa Aesar
    6660 cis-1,4-dichlo C(/C=CCCl)Cl -48 4937374 http://www.aAlfa Aesar
    6661 cis-2,6-dimet C[C@@H]1CN -85 556778 http://www.aAlfa Aesar
    6662 cis-2,6-dimethC[C@@H]1CN 110 5323207 http://www.aAlfa Aesar
    6663 cis-2-butene-1C(/C=CCO)O 7 558888 http://www.aAlfa Aesar
    6664 cis-4-aminocyC1[C@@H](CC 300 19307692 http://www. Alfa Aesar
    6665 cis-4-cyclohexC1C=CC[C@@H 168 440284 http://www.aAlfa Aesar
    6666 cis-4-cyclohexC1C=CC[C@@H 100 16788472 http://www.aAlfa Aesar
    6667 cis-4-methylc C[C@H]1CC[C -10 10179026 http://www.aAlfa Aesar
    6668 cis-5-norborn C1C2C=CC1C3 166 12668 http://www.aAlfa Aesar
    6669 cis-aconitic acC(/C(=C/C(=O 118 558863 http://www.aAlfa Aesar
    6670 cis-cyclooctenC1CCC/C=CCC -16 553642 http://www.aAlfa Aesar
    6671 cis-decahydroC1N2[C@H]3N 30 10230918 http://www. Alfa Aesar
    6672 cis-stilbene c1ccc(cc1)/C= 2 4512351 http://www.aAlfa Aesar
    6673 citraconic aci C/C(=C/C(=O) 90 553689 http://www.aAlfa Aesar
    6674 citraconic anhCC1=CC(=O)O 8 11517 http://www.aAlfa Aesar
    6675 citraconic hydC/C(=C/C(=O) 286 14927694 http://www.aAlfa Aesar
    6676 citric acid, a C(C(=O)O)C(C 154 305 http://www.aAlfa Aesar
    6677 coniferyl alco COc1cc(ccc1O 76 1266063 http://www.aAlfa Aesar
    6678 coumarin c1ccc2c(c1)cc 70 13848793 http://www.aAlfa Aesar
    6679 coumarin-3-cac1ccc2c(c1)cc 186 176504 http://www. Alfa Aesar
    6680 coumarin-3-cac1ccc2c(c1)cc 192 10298 http://www.aAlfa Aesar
    6681 crotonaldehy C/C=C/C=O -76 394562 http://www.aAlfa Aesar
    6682 crystal violet CN(C)c1ccc(cc 182 66413 http://www.aAlfa Aesar
    6683 cumene CC(C)c1ccccc1 -96 7128 http://www.aAlfa Aesar
    6684 curcumin COc1c(ccc(c1 173 839564 http://www.aAlfa Aesar
    6685 cyanamide C(#N)N 45 9480 http://www.aAlfa Aesar
    6686 cyanoacetamiC(C#N)C(=O)N 120 7610 http://www.aAlfa Aesar
    6687 cyanoacetic acC(C#N)C(=O)O 67 9357 http://www.aAlfa Aesar
    6688 cyanoacetic a C(C#N)C(=O)N 108 8489 http://www.aAlfa Aesar
    6689 cyanogen bro C(#N)Br 52 10044 http://www.aAlfa Aesar
    6690 cyanuric chlorc1(nc(nc(n1)Cl 147 7666 http://www.aAlfa Aesar
    6691 cyanuric fluorc1(nc(nc(n1)F) -38 12143 http://www.aAlfa Aesar
    6692 cyclobutanecaC1CC(C1)C(=O -20 18370 http://www.aAlfa Aesar x probable outlier JCB
    6693 cyclobutanon C1CC(=O)C1 -51 13840 http://www.aAlfa Aesar
    6694 cyclododecanoC1CCCCCC(CC 78 14836 http://www.aAlfa Aesar
    6695 cyclododecanC1CCCCCC(=O 61 12690 http://www.aAlfa Aesar
    6696 cycloheptano C1CCCC(=O)C -21 9971 http://www.aAlfa Aesar
    6697 cycloheptatri C1C=CC=CC=C -80 10534 http://www.aAlfa Aesar
    6698 cycloheptylaceC1CCCC(CC1)C 15 197830 http://www.aAlfa Aesar
    6699 cycloheptylamC1CCCC(CC1) -18 2796 http://www.aAlfa Aesar
    6700 cyclohexane C1CCCCC1 7 7787 http://www.aAlfa Aesar
    6701 cyclohexanebuC1CCC(CC1)C 31 67746 http://www.aAlfa Aesar
    6702 cyclohexanec C1CCC(CC1)C 35 15443 http://www.aAlfa Aesar
    6703 cyclohexanecaC1CCC(CC1)C( 31 7135 http://www.aAlfa Aesar
    6704 cyclohexanethC1CCC(CC1)S -30 14555 http://www.aAlfa Aesar
    6705 cyclohexanol C1CCC(CC1)O 24 7678 http://www.aAlfa Aesar
    6706 cyclohexanonC1CCC(=O)CC -26 7679 http://www.aAlfa Aesar
    6707 cyclohexanonec1cc(c(cc1[N+ 159 66730 http://www.aAlfa Aesar
    6708 cyclohexanonC1CCC(=NO)C 89 7236 http://www.aAlfa Aesar
    6709 cyclohexene C1CCC=CC1 -104 7788 http://www.aAlfa Aesar
    6710 cyclohexyl isoC1CCC(CC1)N -80 17475 http://www.aAlfa Aesar
    6711 cyclohexyl meCC(=O)C1CCC -34 12652 http://www.aAlfa Aesar
    6712 cyclohexyl metCSC1CCCCC1 -80 73585 http://www.aAlfa Aesar
    6713 cyclohexyl ph c1ccc(cc1)C( 55 12307 http://www.aAlfa Aesar
    6714 cyclohexyl p- Cc1ccc(cc1)S 46 13127 http://www.aAlfa Aesar
    6715 cyclohexylamiC1CCC(CC1)N -18 7677 http://www.aAlfa Aesar
    6716 cyclohexylbenc1ccc(cc1)C2 6 12674 http://www.aAlfa Aesar
    6717 cyclohexyldip c1ccc(cc1)P(c 60 72911 http://www.aAlfa Aesar
    6718 cyclohexyldip c1ccc(cc1)P(= 167 75487 http://www.aAlfa Aesar
    6719 cyclohexylide C1CCC(=C(C#N 108 87964 http://www.aAlfa Aesar
    6720 cyclooctane C1CCCCCCC1 12 8909 http://www.aAlfa Aesar
    6721 cyclooctanol C1CCCC(CCC1 15 12241 http://www.aAlfa Aesar
    6722 cyclooctanon C1CCCC(=O)C 41 9974 http://www.aAlfa Aesar
    6723 cyclooctanon C1CCCC(=NO) 37 120590 http://www.aAlfa Aesar
    6724 cyclooctylami C1CCCC(CCC1 -48 2800 http://www.aAlfa Aesar
    6725 cyclopentade C1CCCCCCCC( 64 9980 http://www.aAlfa Aesar
    6726 cyclopentane C1CCCC1 -94 8896 http://www.aAlfa Aesar
    6727 cyclopentanecC1CCC(C1)C# -76 70325 http://www.aAlfa Aesar
    6728 cyclopentanecC1CCC(C1)C(= -7 17789 http://www.aAlfa Aesar
    6729 cyclopentanolC1CCC(C1)O -19 7026 http://www.aAlfa Aesar
    6730 cyclopentano C1CCC(=O)C1 -51 8141 http://www.aAlfa Aesar
    6731 cyclopentano C1CCC(=NO)C 56 13844 http://www.aAlfa Aesar
    6732 cyclopentene C1CC=CC1 -135 8544 http://www.aAlfa Aesar
    6733 cyclopentyl mCOC1CCCC1 -140 122157 http://www. Alfa Aesar
    6734 cyclopentylaceC1CCC(C1)CC( 12 64676 http://www.aAlfa Aesar
    6735 cyclopentylamC1CCC(C1)N -85 2803 http://www.aAlfa Aesar
    6736 cyclopropane C1CC1C(=O)N 124 72599 http://www.aAlfa Aesar
    6737 cyclopropanecC1CC1C(=O)O 5 14890 http://www.aAlfa Aesar x clearly out of range JCB
    6738 cyclopropyl 4 COc1ccc(cc1) 42 73610 http://www.aAlfa Aesar
    6739 cyclopropylamC1CC1N -10 63025 http://www.aAlfa Aesar x clearly out of range JCB
    6740 cyclopropylboB(C1CC1)(O)O 93 2041632 http://www. Alfa Aesar
    6741 cyclopropyldi c1ccc(cc1)C(c 85 72143 http://www.aAlfa Aesar
    6742 D-allo-threon C[C@H]([C@H 278 81824 http://www. Alfa Aesar
    6743 dansyl amide CN(C)c1cccc2 220 58587 http://www.aAlfa Aesar
    6744 dansyl chloridCN(C)c1cccc2c 72 11308 http://www.aAlfa Aesar
    6745 D-arabinose C([C@H]([C@ 156 59687 http://www.aAlfa Aesar
    6746 D-arabitol C(O)[C@@H]( 102 84971 http://www.aAlfa Aesar
    6747 D-arginine C(C[C@H](C(= 235 64224 http://www.aAlfa Aesar
    6748 D-biotin C1[C@H]2[C@ 230 149962 http://www.aAlfa Aesar
    6749 decaborane BBBBBBBBBB 101 14336390 http://www.aAlfa Aesar
    6750 decafluorobe c1(c(c(c(c(c1F 93 63257 http://www.aAlfa Aesar
    6751 decafluorobipc1(c(c(c(c(c1F 68 61266 http://www.aAlfa Aesar
    6752 decamethylcycC[Si]1(O[Si](O -44 10451 http://www.aAlfa Aesar
    6753 decanal CCCCCCCCCC= -5 7883 http://www.aAlfa Aesar
    6754 decanoic acid CCCCCCCCCC( 31 2863 http://www.aAlfa Aesar
    6755 decanonitrile CCCCCCCCCC# -15 67360 http://www.aAlfa Aesar
    6756 decanoyl chloCCCCCCCCCC(= -35 60340 http://www.aAlfa Aesar
    6757 dehydroaceticCC1=CC(=O)C( 111 13887609 http://www.aAlfa Aesar
    6758 dehydrocholicC[C@H](CCC( 237 6422 http://www.aAlfa Aesar
    6759 delta-hexanolCC1CCCC(=O) 18 12649 http://www.aAlfa Aesar
    6760 delta-nonanolCCCCC1CCCC( -26 17658 http://www.aAlfa Aesar
    6761 delta-tetrade CCCCCCCCCC1 133 453840 http://www.aAlfa Aesar
    6762 delta-valerol C1CCNC(=O)C 37 12144 http://www.aAlfa Aesar
    6763 delta-valerolaC1CCOC(=O)C -13 10488 http://www.aAlfa Aesar
    6764 deoxyanisoin COc1ccc(cc1)C 111 60468 http://www.aAlfa Aesar
    6765 deoxybenzoinc1ccc(cc1)CC( 55 9554 http://www.aAlfa Aesar
    6766 deoxycholic acC[C@H](CCC( 174 193196 http://www.aAlfa Aesar
    6767 D-epoxone CC1(OC[C@]2 102 5608259 http://www.aAlfa Aesar
    6768 desyl chloridec1ccc(cc1)C(C 67 86040 http://www.aAlfa Aesar
    6769 D-fructose C([C@@H]1[C 108 388775 http://www.aAlfa Aesar
    6770 D-fucose C[C@H]([C@@ 145 85076 http://www.aAlfa Aesar
    6771 D-galactose C([C@H]([C@ 166 2301265 http://www.aAlfa Aesar
    6772 D-glucose, an C([C@H]([C@ 151 96749 http://www.aAlfa Aesar
    6773 di(2-thienyl) dc1cc(sc1)SSc2 55 21832 http://www.aAlfa Aesar
    6774 di-2-thienyl k c1cc(sc1)C(=O 89 62914 http://www.aAlfa Aesar
    6775 diacetone acr CC(=O)CC(C)( 55 16896 http://www.aAlfa Aesar
    6776 diacetone-D-gCC1(OCC(O1) 109 2005820 http://www.aAlfa Aesar
    6777 diallyl maleat C=CCOC(=O)/ -47 4510486 http://www.aAlfa Aesar
    6778 diallyl phthalaC=CCOC(=O)c1 -70 8242 http://www.aAlfa Aesar
    6779 diallyl sulfide C=CCSCC=C -83 11128 http://www.aAlfa Aesar
    6780 diallylamine C=CCNCC=C -88 21106561 http://www.aAlfa Aesar
    6781 dibenzo[b,e]t c1ccc2c(c1)C 87 66383 http://www.aAlfa Aesar
    6782 dibenzo-18-c c1ccc2c(c1) 162 24722 http://www.aAlfa Aesar
    6783 dibenzofuran c1ccc2c(c1)c3 81 551 http://www.aAlfa Aesar
    6784 dibenzofuran-B(c1cccc2c1oc 289 2016080 http://www.aAlfa Aesar
    6785 dibenzosuber c1ccc2c(c1)C 126 74520 http://www.aAlfa Aesar
    6786 dibenzosuber c1ccc2c(c1)C 33 13927 http://www.aAlfa Aesar
    6787 dibenzosuberyc1ccc2c(c1)CC 107 13925 http://www.aAlfa Aesar
    6788 dibenzothiop c1ccc2c(c1)c3 99 2915 http://www.aAlfa Aesar
    6789 dibenzoyl-l-tac1ccc(cc1)C( 155 68470 http://www.aAlfa Aesar
    6790 dibenzyl 5-amc1ccc(cc1)COC 117 5386447 http://www.aAlfa Aesar
    6791 dibenzyl azod c1ccc(cc1)CO 45 4533726 http://www.aAlfa Aesar
    6792 dibenzyl carb c1ccc(cc1)CO 29 69448 http://www.aAlfa Aesar
    6793 dibenzyl disel c1ccc(cc1)C[S 92 86627 http://www.aAlfa Aesar x metal - AL
    6794 dibenzyl disul c1ccc(cc1)CSS 70 8662 http://www.aAlfa Aesar
    6795 dibenzyl etherc1ccc(cc1)COC 4 21105876 http://www.aAlfa Aesar
    6796 dibenzyl keto c1ccc(cc1)CC( 123 67099 http://www.aAlfa Aesar
    6797 dibenzyl phosc1ccc(cc1)CO 80 66798 http://www.aAlfa Aesar
    6798 dibenzyl phth c1ccc(cc1)CO 41 191496 http://www.aAlfa Aesar
    6799 dibenzyl succic1ccc(cc1)CO 45 7370 http://www.aAlfa Aesar
    6800 dibenzyl sulfi c1ccc(cc1)CSC 49 10407 http://www.aAlfa Aesar
    6801 dibenzyl sulfoc1ccc(cc1)CS( 151 62493 http://www.aAlfa Aesar
    6802 dibenzylamin c1ccc(cc1)CNC -26 7373 http://www.aAlfa Aesar
    6803 dibromomalo C(=O)(C(C(=O) 205 152825 http://www.aAlfa Aesar
    6804 dibromomethC(Br)Br -53 2916 http://www.aAlfa Aesar
    6805 dichloroaceticC(C(=O)O)(Cl)C 10 10771217 http://www.aAlfa Aesar
    6806 dichlorodiethyCC[Si](CC)(Cl)C -97 14830 http://www.aAlfa Aesar
    6807 dichlorodimetC[Si](C)(Cl)Cl -76 6158 http://www.aAlfa Aesar
    6808 dichlorometh C(Cl)Cl -95 6104 http://www.aAlfa Aesar
    6809 dichlorophenyB(c1ccccc1)(Cl 7 120441 http://www.aAlfa Aesar
    6810 dichlorophenyc1ccc(cc1)P(Cl -51 12053 http://www.aAlfa Aesar
    6811 dichloropropyCCCP(Cl)Cl 136 452825 http://www.aAlfa Aesar
    6812 dicyandiamid C(#N)NC(=N)N 210 9611 http://www.aAlfa Aesar
    6813 dicyclohexanoC1CCC2C(C1) 50 77536 http://www.aAlfa Aesar
    6814 dicyclohexyla C1CCC(CC1)N -2 7301 http://www.aAlfa Aesar
    6815 dicyclohexylmC1CCC(CC1)C 61 70573 http://www.aAlfa Aesar
    6816 dicyclohexylp c1ccc(cc1)P( 60 73056 http://www. Alfa Aesar
    6817 diethanolami C(CO)NCCO 29 13835604 http://www.aAlfa Aesar
    6818 diethoxydimetCCO[Si](C)(C) -70 56117 http://www.aAlfa Aesar
    6819 diethoxymethCCOCOCC -66 9630 http://www.aAlfa Aesar
    6820 diethyl (1h-b CCOC(=O)C(=N 100 3524077 http://www.aAlfa Aesar
    6821 diethyl (2,4,6 CCOC(=O)C(c1c 48 2062807 http://www. Alfa Aesar
    6822 diethyl (phth CCOP(=O)(CN1 62 1477946 http://www.aAlfa Aesar
    6823 diethyl 2,4-di CCOC(=O)c1c( 137 68052 http://www.aAlfa Aesar
    6824 diethyl 2-ami CCOC(=O)c1c( 115 70898 http://www.aAlfa Aesar
    6825 diethyl 2-hyd CCOC(=O)c1cc 46 25027427 http://www. Alfa Aesar
    6826 diethyl 3,4-d CCOC(=O)c1c( 140 630284 http://www.aAlfa Aesar
    6827 diethyl 4-ami CCOP(=O)(Cc1 93 79712 http://www.aAlfa Aesar
    6828 diethyl aceta CCOC(=O)C(C( 98 13422 http://www.aAlfa Aesar
    6829 diethyl acetyl CCOC(=O)C#C 2 63002 http://www.aAlfa Aesar
    6830 diethyl adipatCCOC(=O)CCC -20 13835108 http://www.aAlfa Aesar
    6831 diethyl amin CCOC(=O)C(= 63 197215 http://www.aAlfa Aesar
    6832 diethyl benz CCOC(=O)C(C( 63 60155 http://www.aAlfa Aesar
    6833 diethyl benzy CCOC(=O)C(=C 30 85490 http://www.aAlfa Aesar
    6834 diethyl bis(2 CCOC(=O)C(C 62 66665 http://www.aAlfa Aesar
    6835 diethyl bis(h CCOC(=O)C(CO 50 275761 http://www.aAlfa Aesar
    6836 diethyl carbo CCOC(=O)OCC -43 7478 http://www.aAlfa Aesar
    6837 diethyl disulfi CCSSCC -102 7786 http://www.aAlfa Aesar
    6838 diethyl ether CCOCC -116 3168 http://www.aAlfa Aesar
    6839 diethyl etho CCOC=C(C(=O -33 6609 http://www.aAlfa Aesar
    6840 diethyl ethyl CCC(C(=O)OCC 0 8291 http://www.aAlfa Aesar
    6841 diethyl form CCOC(=O)C(C 53 72806 http://www.aAlfa Aesar
    6842 diethyl fumar CCOC(=O)/C= 0 553702 http://www.aAlfa Aesar
    6843 diethyl ketomCCOC(=O)C(= -70 62322 http://www.aAlfa Aesar
    6844 diethyl l-tartr CCOC(=O)[C@ 17 104927 http://www.aAlfa Aesar
    6845 diethyl malea CCOC(=O)/C= -11 4436353 http://www.aAlfa Aesar
    6846 diethyl malonCCOC(=O)CC( -50 13863636 http://www.aAlfa Aesar
    6847 diethyl oxalat CCOC(=O)C(= -40 6998 http://www.aAlfa Aesar
    6848 diethyl pheny CCOC(OCC)Oc1 -26 76171 http://www.aAlfa Aesar
    6849 diethyl pheny CCOC(=O)C(c1 16 59885 http://www.aAlfa Aesar
    6850 diethyl phosp CCOP(O)OCC -70 12437 http://www.aAlfa Aesar
    6851 diethyl phthalCCOC(=O)c1cc -64 13837303 http://www.aAlfa Aesar
    6852 diethyl succin CCOC(=O)CCC -21 13865630 http://www.aAlfa Aesar
    6853 diethyl sulfateCCOS(=O)(=O -25 5931 http://www.aAlfa Aesar
    6854 diethyl sulfideCCSCC -104 9233 http://www.aAlfa Aesar
    6855 diethyl sulfon CCS(=O)(=O)C 72 62226 http://www.aAlfa Aesar
    6856 diethyl terephCCOC(=O)c1cc 45 11972 http://www.aAlfa Aesar
    6857 diethylamine CCNCC -50 7730 http://www.aAlfa Aesar
    6858 diethylcarbamCCN(CC)C(=O) -32 6650 http://www.aAlfa Aesar
    6859 diethylene glyC(COCCO)O -10 13835180 http://www.aAlfa Aesar
    6860 diethylene glyCCOCCOCCOC -44 21106583 http://www.aAlfa Aesar
    6861 diethylene glyCOCCOCCOC -64 13839575 http://www.aAlfa Aesar
    6862 diethylene gl CCOCCOCCO -80 13839107 http://www.aAlfa Aesar
    6863 diethylene gl CCOCCOCCOC( -25 13839516 http://www.aAlfa Aesar
    6864 diethylene gl COCCOCCO -70 13839440 http://www.aAlfa Aesar
    6865 diethylene gl CCCCOCCOCC -68 13839549 http://www.aAlfa Aesar
    6866 diethylene gl CCCCCCOCCO -40 7907 http://www.aAlfa Aesar
    6867 diethylenetri C(CNCCN)N -40 13835401 http://www.aAlfa Aesar
    6868 diethylsilane CC[SiH2]CC -132 61632 http://www.aAlfa Aesar
    6869 difluoroaceticC(C(=O)O)(F)F -1 10200426 http://www.aAlfa Aesar
    6870 difurfuryl sulf c1cc(oc1)CSC 31 55564 http://www.aAlfa Aesar
    6871 diglycolic acidC(C(=O)O)OCC 143 7797 http://www.aAlfa Aesar
    6872 dihydrocoumac1ccc2c(c1)C 25 640 http://www.aAlfa Aesar
    6873 diiodomethanC(I)I 6 6106 http://www.aAlfa Aesar
    6874 diisobutyl phtCC(C)COC(=O) -64 6524 http://www.aAlfa Aesar
    6875 diisobutylami CC(C)CNCC(C) -77 7794 http://www.aAlfa Aesar
    6876 diisopentylamCC(C)CCNCCC( -44 10523 http://www.aAlfa Aesar
    6877 diisopropanolCC(CNCC(C)O) 42 7795 http://www.aAlfa Aesar
    6878 diisopropyl azCC(C)OC(=O)/ 4 4515532 http://www.aAlfa Aesar
    6879 diisopropyl k CC(C)C(=O)C(C -69 10797 http://www.aAlfa Aesar
    6880 diisopropylamCC(C)NC(C)C -61 7624 http://www.aAlfa Aesar
    6881 dimedone CC1(CC(=O)CC 148 29091 http://www.aAlfa Aesar
    6882 dimesitylmet Cc1cc(c(c(c1) 130 62970 http://www.aAlfa Aesar
    6883 dimethoxydime
    CO[Si](C)(C)O -80 59573 http://www.aAlfa Aesar
    6884 dimethoxymeCOCOC -105 13837190 http://www.aAlfa Aesar
    6885 dimethyl (pht COP(=O)(CN1C 118 2054201 http://www.aAlfa Aesar
    6886 dimethyl 1,10COC(=O)CCCC 30 67007 http://www.aAlfa Aesar
    6887 dimethyl 2-fl COC(=O)c1ccc 82 71505 http://www.aAlfa Aesar
    6888 dimethyl 2-ni COC(=O)c1ccc( 74 20081 http://www.aAlfa Aesar
    6889 dimethyl 3,4- COC(=O)c1c(c 211 17922531 http://www.aAlfa Aesar
    6890 dimethyl 3-ni COC(=O)c1ccc 69 218854 http://www.aAlfa Aesar
    6891 dimethyl 4-ni COC(=O)c1ccc 67 62336 http://www.aAlfa Aesar
    6892 dimethyl 5-amCOC(=O)c1cc( 180 60195 http://www.aAlfa Aesar
    6893 dimethyl 5-hyCOC(=O)c1cc( 163 74937 http://www.aAlfa Aesar
    6894 dimethyl 5-nitCOC(=O)c1cc(c 122 75177 http://www.aAlfa Aesar
    6895 dimethyl acetCOC(=O)CC(= 17 67168 http://www.aAlfa Aesar
    6896 dimethyl acetCOC(=O)C#CC -18 12440 http://www.aAlfa Aesar
    6897 dimethyl adipCOC(=O)CCCC 8 11824 http://www.aAlfa Aesar
    6898 dimethyl azel COC(=O)CCCC 18 14852 http://www.aAlfa Aesar
    6899 dimethyl bipheCOC(=O)c1ccc( 214 12551 http://www.aAlfa Aesar
    6900 dimethyl carbCOC(=O)OC 4 11526 http://www.aAlfa Aesar
    6901 dimethyl cis-sCOC(=O)c1ccc 113 5874103 http://www.aAlfa Aesar
    6902 dimethyl disulCSSC -85 11731 http://www.aAlfa Aesar
    6903 dimethyl fumaCOC(=O)/C=C/ 104 553171 http://www.aAlfa Aesar
    6904 dimethyl glut COC(=O)CCCC -37 13605 http://www.aAlfa Aesar
    6905 dimethyl isop COC(=O)c1ccc 69 14360 http://www.aAlfa Aesar
    6906 dimethyl itac COC(=O)CC(=C 36 62453 http://www.aAlfa Aesar
    6907 dimethyl l-tar COC(=O)[C@H 59 19881 http://www.aAlfa Aesar
    6908 dimethyl maleCOC(=O)/C=C -19 4436352 http://www.aAlfa Aesar
    6909 dimethyl mal COC(=O)CC(= -62 21106102 http://www.aAlfa Aesar
    6910 dimethyl met COC=C(C(=O) 43 81955 http://www.aAlfa Aesar
    6911 dimethyl naphCOC(=O)c1ccc 190 55167 http://www.aAlfa Aesar
    6912 dimethyl oxal COC(=O)C(=O 52 10649 http://www.aAlfa Aesar
    6913 dimethyl oxazCOC(=O)c1c(o 75 716364 http://www. Alfa Aesar
    6914 dimethyl phthCOC(=O)c1ccc 5 13837329 http://www.aAlfa Aesar
    6915 dimethyl pyridCOC(=O)c1ccc 162 204905 http://www.aAlfa Aesar
    6916 dimethyl pyridCOC(=O)c1ccc 121 71857 http://www. Alfa Aesar
    6917 dimethyl sebaCOC(=O)CCCC 27 7541 http://www.aAlfa Aesar
    6918 dimethyl succCOC(=O)CCC( 19 13848341 http://www.aAlfa Aesar
    6919 dimethyl sulfi CSC -83 1039 http://www.aAlfa Aesar
    6920 dimethyl sulf CS(=O)(=O)C 110 5978 http://www.aAlfa Aesar
    6921 dimethyl sulfoCS(=O)C 18 659 http://www.aAlfa Aesar
    6922 dimethyl tere COC(=O)c1ccc 142 13863300 http://www.aAlfa Aesar
    6923 dimethyl tetr COC(=O)c1c(c( 157 2839 http://www.aAlfa Aesar
    6924 dimethyl transCOC(=O)c1ccc 235 4527298 http://www.aAlfa Aesar
    6925 dimethylcarbaCN(C)C(=O)Cl -33 6348 http://www.aAlfa Aesar
    6926 dimethylphenyC[SiH](C)c1cc -124 12473 http://www.aAlfa Aesar
    6927 dimethylphospCP(=O)(C)Cl 68 451905 http://www.aAlfa Aesar
    6928 di-n-butyl ethCCCCOCCCC -95 8569 http://www.aAlfa Aesar
    6929 di-n-butyl ph CCCCOP(=O)( -13 7593 http://www.aAlfa Aesar
    6930 di-n-butyl phtCCCCOC(=O)c1 -35 13837319 http://www.aAlfa Aesar
    6931 di-n-butyl sebCCCCOC(=O)C -11 13837584 http://www.aAlfa Aesar
    6932 di-n-butyl sulfCCCCSCCCC -80 10536 http://www.aAlfa Aesar
    6933 di-n-butyl sul CCCCS(=O)(=O 44 62236 http://www.aAlfa Aesar
    6934 di-n-butyl sul CCCCS(=O)CC 33 15708 http://www.aAlfa Aesar
    6935 di-n-butylami CCCCNCCCC -62 7856 http://www.aAlfa Aesar
    6936 di-n-decyl sulfCCCCCCCCCCS 27 62863 http://www.aAlfa Aesar
    6937 di-n-decylami CCCCCCCCCCN 37 13623 http://www.aAlfa Aesar
    6938 di-n-dodecyl sCCCCCCCCCCC 40 65707 http://www.aAlfa Aesar
    6939 di-n-hexyl ethCCCCCCOCCC -43 7906 http://www.aAlfa Aesar
    6940 di-n-hexylamiCCCCCCNCCCC 3 8580 http://www.aAlfa Aesar
    6941 di-n-nonyl sul CCCCCCCCCSC 15 457747 http://www.aAlfa Aesar
    6942 di-n-octadecylCCCCCCCCCCC 62 68149 http://www.aAlfa Aesar
    6943 di-n-octyl pht CCCCCCCCOC( -25 8043 http://www.aAlfa Aesar
    6944 di-n-octyl sulf CCCCCCCCSCC 1 68406 http://www.aAlfa Aesar
    6945 di-n-octylami CCCCCCCCNCC 14 2984 http://www.aAlfa Aesar
    6946 di-n-pentyl suCCCCCSCCCCC -51 12810 http://www.aAlfa Aesar
    6947 di-n-propyl di CCCSSCCC -86 11871 http://www.aAlfa Aesar
    6948 di-n-propyl etCCCOCCC -122 7823 http://www.aAlfa Aesar
    6949 di-n-propyl suCCCSCCC -102 7827 http://www.aAlfa Aesar
    6950 di-n-propylamCCCNCCC -63 8562 http://www.aAlfa Aesar
    6951 di-n-propylmalCCCC(CCC)(C( 155 66828 http://www.aAlfa Aesar
    6952 di-o-acetyl-l- CC(=O)O[C@@ 132 448369 http://www.aAlfa Aesar
    6953 dipentaerythriC(C(CO)(CO)C 217 29085 http://www.aAlfa Aesar
    6954 diphenic acid c1ccc(c(c1)c2 229 9795 http://www.aAlfa Aesar
    6955 diphenyl carb c1ccc(cc1)OC 79 7315 http://www.aAlfa Aesar
    6956 diphenyl cyanc1ccc(cc1)OC 157 599579 http://www.aAlfa Aesar
    6957 diphenyl diselc1ccc(cc1)[Se 62 14710 http://www.aAlfa Aesar x metal - AL
    6958 diphenyl disulc1ccc(cc1)SSc 60 12861 http://www.aAlfa Aesar
    6959 diphenyl ethec1ccc(cc1)Oc2 28 7302 http://www.aAlfa Aesar
    6960 diphenyl phosc1ccc(cc1)OP( 66 12722 http://www.aAlfa Aesar
    6961 diphenyl pho c1ccc(cc1)OP( 149 67401 http://www.aAlfa Aesar
    6962 diphenyl phthc1ccc(cc1)OC 75 6520 http://www.aAlfa Aesar
    6963 diphenyl sele c1ccc(cc1)[Se 3 13694 http://www.aAlfa Aesar x metal - AL
    6964 diphenyl sulfi c1ccc(cc1)Sc2 -40 8436 http://www.aAlfa Aesar
    6965 diphenyl sulf c1ccc(cc1)S(= 128 29117 http://www.aAlfa Aesar
    6966 diphenyl sulfoc1ccc(cc1)S(= 71 13090 http://www.aAlfa Aesar
    6967 diphenyl tere c1ccc(cc1)OC( 197 66398 http://www.aAlfa Aesar
    6968 diphenyl(o-to Cc1ccccc1P(c2 72 72293 http://www. Alfa Aesar
    6969 diphenyl(p-to Cc1ccc(cc1)P( 66 63744 http://www.aAlfa Aesar
    6970 diphenylaceticc1ccc(cc1)C(c 147 8030 http://www.aAlfa Aesar
    6971 diphenylaceton
    c1ccc(cc1)C(C 74 6576 http://www.aAlfa Aesar
    6972 diphenylacetylc1ccc(cc1)C(c 53 67212 http://www.aAlfa Aesar
    6973 diphenylacetyc1ccc(cc1)C#C 60 9961 http://www.aAlfa Aesar
    6974 diphenylaminc1ccc(cc1)Nc2 54 11003 http://www.aAlfa Aesar
    6975 diphenylcarbac1ccc(cc1)N(c 84 59164 http://www.aAlfa Aesar
    6976 diphenyldichl c1ccc(cc1)[Si] -22 6375 http://www.aAlfa Aesar
    6977 diphenylmethc1ccc(cc1)Cc2 24 7299 http://www.aAlfa Aesar
    6978 diphenylphospc1ccc(cc1)P(= 54 222625 http://www.aAlfa Aesar
    6979 diphenylphospc1ccc(cc1)P(= 195 14810 http://www.aAlfa Aesar
    6980 diphenylphospc1ccc(cc1)P(= 20 66543 http://www.aAlfa Aesar
    6981 di-p-tolyl sulf Cc1ccc(cc1)S( 157 62252 http://www.aAlfa Aesar
    6982 D-isosorbide C1[C@H]([C@ 60 12077 http://www.aAlfa Aesar
    6983 di-tert-butyl CC(C)(C)OC(= 91 4785913 http://www.aAlfa Aesar
    6984 di-tert-butyl CC(C)(C)OC(= 23 81704 http://www.aAlfa Aesar
    6985 di-tert-butyl CC(C)(C)OC(= -6 61619 http://www.aAlfa Aesar
    6986 di-tert-butyld CC(C)(C)[Si](C( -15 79051 http://www.aAlfa Aesar
    6987 divinyl sulfon C=CS(=O)(=O) -26 6251 http://www.aAlfa Aesar
    6988 dl-arabinose C([C@@H]([C 159 4573877 http://www.aAlfa Aesar
    6989 dl-lactide CC1C(=O)OC(C 124 7002 http://www.aAlfa Aesar
    6990 dl-malic acid C(C(C(=O)O)O 132 510 http://www.aAlfa Aesar
    6991 dl-menthol CC1CCC(C(C1) 29 1216 http://www.aAlfa Aesar
    6992 dl-n-acetylho CC(=O)NC1CC 110 13864 http://www.aAlfa Aesar
    6993 dl-panthenol CC(C)(CO)C(C 68 4516 http://www.aAlfa Aesar
    6994 D-lyxose C1[C@H]([C@ 112 388745 http://www.aAlfa Aesar
    6995 D-malic acid C([C@H](C(=O 102 83793 http://www.aAlfa Aesar
    6996 D-mannitol C([C@H]([C@ 166 6015 http://www.aAlfa Aesar
    6997 D-mannose C([C@@H]1[C 130 17893 http://www.aAlfa Aesar
    6998 dodecanal CCCCCCCCCCC 12 7902 http://www.aAlfa Aesar
    6999 dodecanedioicC(CCCCCC(=O 129 12213 http://www.aAlfa Aesar
    7000 dodecanoic acCCCCCCCCCCC 44 3756 http://www.aAlfa Aesar
    7001 dodecanonitriCCCCCCCCCCC 4 16177 http://www.aAlfa Aesar
    7002 dodecanoyl chCCCCCCCCCCC -17 7874 http://www.aAlfa Aesar
    7003 dotriacontaneCCCCCCCCCCC 70 10542 http://www.aAlfa Aesar
    7004 D-pantolactonCC1(COC(=O) 90 964 http://www.aAlfa Aesar
    7005 D-phenylalanic1ccc(cc1)C[ 92 745879 http://www.aAlfa Aesar
    7006 D-quinic acid C1[C@H]([C@ 165 16498843 http://www.aAlfa Aesar
    7007 D-ribose C([C@H]([C@ 84 4470639 http://www.aAlfa Aesar
    7008 D-salicin c1ccc(c(c1) 199 388601 http://www.aAlfa Aesar
    7009 D-sorbitol C([C@H]([C@ 99 5576 http://www.aAlfa Aesar
    7010 D-sorbose C([C@H]([C@ 164 96680 http://www.aAlfa Aesar
    7011 D-tagatose C([C@H]([C@ 135 83142 http://www.aAlfa Aesar
    7012 D-tartaric acid[C@H]([C@@H 168 388726 http://www.aAlfa Aesar
    7013 D-tyrosine c1cc(ccc1C[C 312 64252 http://www.aAlfa Aesar
    7014 dulcitol C([C@H]([C@ 189 11357 http://www.aAlfa Aesar
    7015 D-xylose C1[C@H]([C@ 149 119104 http://www.aAlfa Aesar
    7016 elaidic acid CCCCCCCC/C= 43 553123 http://www.aAlfa Aesar
    7017 endo-n-hydroxC1[C@@H]2C= 168 5023255 http://www.aAlfa Aesar
    7018 epichlorohydrC1C(O1)CCl -57 13837112 http://www.aAlfa Aesar
    7019 epsilon-capro C1CCC(=O)NC 70 7480 http://www.aAlfa Aesar
    7020 epsilon-capro C1CCC(=O)OC -2 9972 http://www.aAlfa Aesar
    7021 erucic acid CCCCCCCC/C= 31 4444561 http://www.aAlfa Aesar
    7022 erythro-aleuritC(CCC[C@@H] 99 5602481 http://www.aAlfa Aesar
    7023 ethanesulfonicCCS(=O)(=O)O -17 11178 http://www.aAlfa Aesar
    7024 ethanesulfonylCCS(=O)(=O)Cl -70 11177 http://www.aAlfa Aesar
    7025 ethanethiol CCS -148 6103 http://www.aAlfa Aesar
    7026 ethanol CCO -130 682 http://www.aAlfa Aesar x clearly out of range JCB
    7027 ethanolamineC(CO)N 10 13835336 http://www.aAlfa Aesar
    7028 ethoxymethyleCCOC=C(C#N) 65 60497 http://www.aAlfa Aesar
    7029 ethoxytrimethCCO[Si](C)(C) -83 14998 http://www.aAlfa Aesar
    7030 ethyl (e)-2-c CCO/C(=C(C#N 72 4905557 http://www. Alfa Aesar
    7031 ethyl (ethoxy CCOC=C(C#N) 50 71276 http://www.aAlfa Aesar
    7032 ethyl 1-(4-nit CCOC(=O)c1cnn 108 2018859 http://www. Alfa Aesar
    7033 ethyl 1,2,3-th CCOC(=O)c1cs 84 222925 http://www.aAlfa Aesar
    7034 ethyl 1,3-dith CCOC(=O)C1S 20 79897 http://www.aAlfa Aesar
    7035 ethyl 1h-indazCCOC(=O)c1c2 133 70625 http://www. Alfa Aesar
    7036 ethyl 1h-indazCCOC(=O)c1cc 123 1236823 http://www. Alfa Aesar
    7037 ethyl 1h-indazCCOC(=O)c1cc 125 14354351 http://www. Alfa Aesar
    7038 ethyl 1h-pyrazCCOC(=O)c1c[ 77 125418 http://www.aAlfa Aesar
    7039 ethyl 1-phenyCCOC(=O)c1cn 98 10255538 http://www. Alfa Aesar
    7040 ethyl 2-(3-am CCOC(=O)c1c(n 84 25027433 http://www. Alfa Aesar
    7041 ethyl 2-(4-am CCOC(=O)c1c(n 128 25027440 http://www. Alfa Aesar
    7042 ethyl 2,4-dih CCOC(=O)c1c( 212 10295990 http://www. Alfa Aesar
    7043 ethyl 2,4-dimeCCOC(=O)c1c( 49 524892 http://www.aAlfa Aesar
    7044 ethyl 2-aminoCCOC(=O)c1c(c 82 635397 http://www. Alfa Aesar
    7045 ethyl 2-aminoCCOC(=O)c1c( 75 635440 http://www. Alfa Aesar
    7046 ethyl 2-aminoCCOC(=O)c1c(c 106 615381 http://www. Alfa Aesar
    7047 ethyl 2-aminoCCOC(=O)c1cnc 180 2018798 http://www.aAlfa Aesar
    7048 ethyl 2-aminoCCOC(=O)c1cc 87 79839 http://www.aAlfa Aesar
    7049 ethyl 2-aminoCCOC(=O)c1c( 174 304740 http://www.aAlfa Aesar
    7050 ethyl 2-aminoCCOC(=O)c1c( 81 454566 http://www.aAlfa Aesar
    7051 ethyl 2-aminoCCOC(=O)c1c(n 172 65993 http://www.aAlfa Aesar
    7052 ethyl 2-aminoCCOC(=O)c1c( 92 65996 http://www. Alfa Aesar
    7053 ethyl 2-aminoCCOC(=O)c1cc 70 21242188 http://www.aAlfa Aesar
    7054 ethyl 2-aminoCCOC(=O)c1co 126 282901 http://www. Alfa Aesar
    7055 ethyl 2-aminoCCOC(=O)c1cs 177 65971 http://www. Alfa Aesar
    7056 ethyl 2-bromoCCC(C(=O)OCC -4 71371 http://www.aAlfa Aesar
    7057 ethyl 2-bromoCCOC(=O)Cc1c 37 2060308 http://www. Alfa Aesar
    7058 ethyl 2-chlor CCOC(=O)c1cc( 66 13493409 http://www. Alfa Aesar
    7059 ethyl 2-chlor CCOC(=O)c1co 98 2043873 http://www. Alfa Aesar
    7060 ethyl 2-cyano CCOC(=O)C(=C 20 120341 http://www.aAlfa Aesar
    7061 ethyl 2-ethylbCCC(CC)C(=O) 151 68803 http://www. Alfa Aesar
    7062 ethyl 2-furoatCCOC(=O)c1cc 34 11485 http://www.aAlfa Aesar
    7063 ethyl 2-hydro CCOC(=O)c1cc 189 21242463 http://www. Alfa Aesar
    7064 ethyl 2-methyCCOC(=O)c1cc( 97 2023709 http://www.aAlfa Aesar
    7065 ethyl 2-methyCCOC(=O)C(C) -45 21106586 http://www.aAlfa Aesar
    7066 ethyl 2-methyCCOC(=O)c1cs 55 258907 http://www.aAlfa Aesar
    7067 ethyl 2-nitro CCOC(=O)c1cc 28 62340 http://www.aAlfa Aesar
    7068 ethyl 3-(2-fur CCOC(=O)c1cc 136 5471638 http://www. Alfa Aesar
    7069 ethyl 3-(4-me CCOC(=O)CCC( 51 508604 http://www.aAlfa Aesar
    7070 ethyl 3-(dime CCOC(=O)/C=C 18 4520292 http://www.aAlfa Aesar
    7071 ethyl 3,4,5-t CCOC(=O)c1cc 150 12693 http://www.aAlfa Aesar
    7072 ethyl 3,4,5-tr CCOC(=O)c1c(c 126 121143 http://www.aAlfa Aesar
    7073 ethyl 3,4-dia CCOC(=O)c1cc 110 403820 http://www.aAlfa Aesar
    7074 ethyl 3,4-dic CCOC(=O)Cc1cc 25 2019062 http://www.aAlfa Aesar
    7075 ethyl 3,4-dih CCOC(=O)c1cc 134 69954 http://www.aAlfa Aesar
    7076 ethyl 3,4-dim CCOC(=O)c1cc 44 21171999 http://www.aAlfa Aesar
    7077 ethyl 3,5-dic CCOC(=O)c1cc( 111 26478 http://www.aAlfa Aesar
    7078 ethyl 3,5-dini CCOC(=O)c1cc( 92 62468 http://www.aAlfa Aesar
    7079 ethyl 3-aminoCCOC(=O)c1c[ 106 73512 http://www.aAlfa Aesar
    7080 ethyl 3-amino-CCOC(=O)/C=C( 25 4642858 http://www.aAlfa Aesar
    7081 ethyl 3-aminoCCOC(=O)c1c( 79 1554251 http://www. Alfa Aesar
    7082 ethyl 3-aminoCCOC(=O)c1cc 29 13860074 http://www.aAlfa Aesar
    7083 ethyl 3-aminoCCOC(=O)/C=C 32 558862 http://www.aAlfa Aesar
    7084 ethyl 3-cyano CCOC(=O)C(=O 127 21407 http://www. Alfa Aesar
    7085 ethyl 3-ethox CCOC(=CC(=O 30 71468 http://www.aAlfa Aesar
    7086 ethyl 3-ethox CCOCCC(=O)O -100 12449 http://www.aAlfa Aesar
    7087 ethyl 3-hydroxCCOC(=O)CC(C( 23 119986 http://www.aAlfa Aesar
    7088 ethyl 3-hydro CCOC(=O)c1cc 74 21170129 http://www.aAlfa Aesar
    7089 ethyl 3-methyCCOC(=O)c1cc 82 70048 http://www.aAlfa Aesar
    7090 ethyl 3-methyCCOC(=O)n1cc 124 28829 http://www.aAlfa Aesar
    7091 ethyl 3-methyCCOC(=O)C1=C 143 319861 http://www.aAlfa Aesar
    7092 ethyl 3-methyCCOC(=O)c1ccc 54 2075746 http://www.aAlfa Aesar
    7093 ethyl 3-nitro CCOC(=O)c1ccc 42 21106111 http://www.aAlfa Aesar
    7094 ethyl 3-nitro CCOC(=O)/C=C/ 75 4510472 http://www.aAlfa Aesar
    7095 ethyl 3-phenoCCOC(=O)CCOc 23 308810 http://www.aAlfa Aesar
    7096 ethyl 3-phenyCCOC(=O)N1CC 63 2052178 http://www. Alfa Aesar
    7097 ethyl 3-triflu CCOC(=O)c1c[n 144 518176 http://www.aAlfa Aesar
    7098 ethyl 4-(1-pyr CCOC(=O)c1cc 75 2018134 http://www. Alfa Aesar
    7099 ethyl 4-(benz CCOC(=O)c1cc 43 166228 http://www.aAlfa Aesar
    7100 ethyl 4-(bromCCOC(=O)c1cc 31 829439 http://www.aAlfa Aesar
    7101 ethyl 4,5,6,7- CCOC(=O)c1c(o 70 696847 http://www.aAlfa Aesar
    7102 ethyl 4,5-dim CCOC(=O)c1cc 101 2723269 http://www.aAlfa Aesar
    7103 ethyl 4-aceta CCOC(=O)c1ccc 96 2104705 http://www.aAlfa Aesar
    7104 ethyl 4-aminoCCOC(=O)c1cc 90 13854242 http://www.aAlfa Aesar
    7105 ethyl 4-aminoCCOC(=O)/C=C 73 643443 http://www.aAlfa Aesar
    7106 ethyl 4-aminoCCOC(=O)Cc1c 47 195773 http://www.aAlfa Aesar
    7107 ethyl 4-bromoCCOC(=O)c1c(n 102 21467837 http://www. Alfa Aesar
    7108 ethyl 4-bromoCCOC(=O)Cc1c 30 5383559 http://www.aAlfa Aesar
    7109 ethyl 4-chloroCCOC(=O)c1cn 62 72263 http://www.aAlfa Aesar
    7110 ethyl 4-chlor CCOC(=O)c1ccc 54 1064907 http://www.aAlfa Aesar
    7111 ethyl 4-chlor CCOC(=O)CC(= -8 62690 http://www.aAlfa Aesar
    7112 ethyl 4-cyano CCOC(=O)c1cc 99 713458 http://www. Alfa Aesar
    7113 ethyl 4-cyano CCOC(=O)Cc1c 92 246313 http://www. Alfa Aesar
    7114 ethyl 4-dimet CCOC(=O)c1cc 64 23472 http://www.aAlfa Aesar
    7115 ethyl 4-ethox CCOc1ccc(cc1 9 21106110 http://www.aAlfa Aesar
    7116 ethyl 4-fluor CCOC(=O)c1cc 26 21168776 http://www.aAlfa Aesar
    7117 ethyl 4-hydro CCOC(=O)/C=C 57 643791 http://www.aAlfa Aesar
    7118 ethyl 4-hydro CCOC(=O)c1ccc 70 79298 http://www.aAlfa Aesar
    7119 ethyl 4-hydro CCOC(=O)c1cc 117 13846749 http://www.aAlfa Aesar
    7120 ethyl 4-hydro CCOC(=O)C(c1 130 99912 http://www.aAlfa Aesar
    7121 ethyl 4-hydro CCOC(=O)Cc1c 37 26338 http://www.aAlfa Aesar
    7122 ethyl 4-meth CCOC(=O)c1cc 8 21159425 http://www.aAlfa Aesar
    7123 ethyl 4-methyCCOC(=O)c1c[ 74 205030 http://www.aAlfa Aesar
    7124 ethyl 4-nitro CCOC(=O)c1ccc 57 7177 http://www.aAlfa Aesar
    7125 ethyl 4-nitrobCCOC(=O)CC(=O 72 12721 http://www.aAlfa Aesar
    7126 ethyl 4-nitro CCOC(=O)/C=C/ 139 1064731 http://www.aAlfa Aesar
    7127 ethyl 4-nitro CCOC(=O)Cc1cc 64 71827 http://www.aAlfa Aesar
    7128 ethyl 4-nitropCCOC(=O)C(=O) 41 455666 http://www.aAlfa Aesar
    7129 ethyl 4-phenyCCOC(=O)c1c[ 127 3366275 http://www.aAlfa Aesar
    7130 ethyl 4-pyridi CCOC(=O)Cc1c 19 643447 http://www.aAlfa Aesar
    7131 ethyl 5,6-dim CCOC(=O)c1cc 177 77008 http://www.aAlfa Aesar
    7132 ethyl 5-acety CCOc1ccc(cc1 53 4228677 http://www.aAlfa Aesar
    7133 ethyl 5-amino-CCOC(=O)c1c( 124 1425878 http://www. Alfa Aesar
    7134 ethyl 5-aminoCCOC(=O)c1cn 100 238616 http://www.aAlfa Aesar
    7135 ethyl 5-aminoCCOC(=O)c1cn 100 76901 http://www.aAlfa Aesar
    7136 ethyl 5-aminoCCOC(=O)c1c( 108 595477 http://www. Alfa Aesar
    7137 ethyl 5-benzy CCOC(=O)c1cc 163 86410 http://www.aAlfa Aesar
    7138 ethyl 5-bromo-CCOC(=O)c1c( 77 9196085 http://www. Alfa Aesar
    7139 ethyl 5-bromoCCOC(=O)c1cc 41 124176 http://www.aAlfa Aesar
    7140 ethyl 5-chloroCCOC(=O)c1cc2 168 70879 http://www.aAlfa Aesar
    7141 ethyl 5-fluoro CCOC(=O)c1cc 150 2009907 http://www.aAlfa Aesar
    7142 ethyl 5-hydro CCOC(=O)c1cc 151 81871 http://www.aAlfa Aesar
    7143 ethyl 5-isoproCCOC(=O)c1cc 75 4927995 http://www.aAlfa Aesar
    7144 ethyl 5-methoCCOC(=O)c1cc 156 19687 http://www.aAlfa Aesar
    7145 ethyl 5-methyCCOC(=O)c1cc 163 203053 http://www.aAlfa Aesar
    7146 ethyl 5-methyCCOC(=O)c1cc 29 69138 http://www.aAlfa Aesar
    7147 ethyl 5-nitro- CCOC(=O)c1ccc 100 63522 http://www.aAlfa Aesar
    7148 ethyl 5-n-propCCCc1cc(n[nH 49 5691517 http://www.aAlfa Aesar
    7149 ethyl 6-aminoCCOC(=O)c1cc 165 9141639 http://www.aAlfa Aesar
    7150 ethyl 6-chloroCCOC(=O)c1cc 28 2078349 http://www.aAlfa Aesar
    7151 ethyl 7-methoCCOC(=O)c1cc 85 454707 http://www.aAlfa Aesar
    7152 ethyl 9-fluore CCOC(=O)C=C1 76 248850 http://www.aAlfa Aesar
    7153 ethyl acetami CCOC(=O)C(C# 129 86118 http://www.aAlfa Aesar
    7154 ethyl acetate CCOC(=O)C -84 8525 http://www.aAlfa Aesar
    7155 ethyl acetoac CCOC(=O)CC( -43 13865426 http://www.aAlfa Aesar
    7156 ethyl acrylate CCOC(=O)C=C -71 8490 http://www.aAlfa Aesar
    7157 ethyl anthraniCCOC(=O)c1cc 15 21106112 http://www.aAlfa Aesar
    7158 ethyl benzilat CCOC(=O)C(c1c 30 86894 http://www.aAlfa Aesar
    7159 ethyl benzoatCCOC(=O)c1cc -34 6897 http://www.aAlfa Aesar
    7160 ethyl benzofuCCOC(=O)c1ccc 67 643901 http://www.aAlfa Aesar
    7161 ethyl benzothCCOC(=O)c1nc 70 556052 http://www. Alfa Aesar
    7162 ethyl bromoacCCOC(=O)CBr -38 7462 http://www.aAlfa Aesar
    7163 ethyl butyrateCCCC(=O)OCC -93 7475 http://www.aAlfa Aesar
    7164 ethyl butyrylaCCCC(=O)CC( -44 208322 http://www.aAlfa Aesar
    7165 ethyl carbamaCCOC(=O)N 49 5439 http://www.aAlfa Aesar
    7166 ethyl carbazatCCOC(=O)NN 46 18903 http://www.aAlfa Aesar
    7167 ethyl chloroacCCOC(=O)CCl -26 7465 http://www.aAlfa Aesar
    7168 ethyl chlorof CCOC(=O)Cl -81 10465 http://www.aAlfa Aesar
    7169 ethyl cinnamaCCOC(=O)/C=C 7 553344 http://www.aAlfa Aesar
    7170 ethyl coumariCCOC(=O)c1cc 94 15023 http://www.aAlfa Aesar
    7171 ethyl cyanoacCCOC(=O)CC# -23 13856579 http://www.aAlfa Aesar
    7172 ethyl decanoaCCCCCCCCCC( -20 7757 http://www.aAlfa Aesar
    7173 ethyl dodecanCCCCCCCCCCC -2 7512 http://www.aAlfa Aesar
    7174 ethyl formate CCOC=O -81 7734 http://www.aAlfa Aesar
    7175 ethyl heptanoCCCCCCC(=O) -66 7509 http://www.aAlfa Aesar
    7176 ethyl hexanoaCCCCCC(=O)O -67 29005 http://www.aAlfa Aesar
    7177 ethyl hippuratCCOC(=O)CNC( 59 197038 http://www.aAlfa Aesar
    7178 ethyl imidazolCCOC(=O)c1[n 177 478030 http://www.aAlfa Aesar
    7179 ethyl indole-2CCOC(=O)c1cc 124 65903 http://www.aAlfa Aesar
    7180 ethyl indole-3CCOC(=O)Cc1c 43 12523 http://www.aAlfa Aesar
    7181 ethyl indole-3CCOC(=O)/C=C 120 4524065 http://www.aAlfa Aesar
    7182 ethyl isobutyrCCOC(=O)C(C) -88 7065 http://www.aAlfa Aesar
    7183 ethyl isobutyrCCOC(=O)CC(= -9 21169498 http://www.aAlfa Aesar
    7184 ethyl isonitr CCOC(=O)C(= 130 4911431 http://www.aAlfa Aesar
    7185 ethyl isothioc CCN=C=S -6 10501 http://www.aAlfa Aesar
    7186 ethyl isovaler CCOC(=O)CC(C -99 7657 http://www.aAlfa Aesar
    7187 ethyl l-lactateCCOC(=O)[C@ -25 83800 http://www.aAlfa Aesar
    7188 ethyl mercaptCCOC(=O)CS -80 11685 http://www.aAlfa Aesar
    7189 ethyl methacrCCOC(=O)C(=C -60 7066 http://www.aAlfa Aesar
    7190 ethyl methyl sCCSC -106 11729 http://www.aAlfa Aesar
    7191 ethyl n-(2,4- CCOC(=NOc1ccc 112 2006568 http://www. Alfa Aesar
    7192 ethyl n-hydro CCOC(=NO)C 24 90256 http://www.aAlfa Aesar
    7193 ethyl nicotina CCOC(=O)c1cc 9 62402 http://www.aAlfa Aesar
    7194 ethyl nonanoaCCCCCCCCC(= -44 28991 http://www.aAlfa Aesar
    7195 ethyl octanoaCCCCCCCC(=O -47 7511 http://www.aAlfa Aesar
    7196 ethyl oleate CCCCCCCC/C= -32 4515636 http://www.aAlfa Aesar
    7197 ethyl oxanilat CCOC(=O)C(=O 67 66460 http://www.aAlfa Aesar
    7198 ethyl palmitatCCCCCCCCCCC 24 11860 http://www.aAlfa Aesar
    7199 ethyl phenyl sCCS(=O)(=O)c 42 62254 http://www.aAlfa Aesar
    7200 ethyl phenyla CCOC(=O)Cc1c -29 13885245 http://www.aAlfa Aesar
    7201 ethyl picolina CCOC(=O)c1cc 2 16377 http://www.aAlfa Aesar
    7202 ethyl propiolaCCOC(=O)C#C 9 11682 http://www.aAlfa Aesar
    7203 ethyl propion CCC(=O)OCC -73 7463 http://www.aAlfa Aesar
    7204 ethyl p-tolue CCOS(=O)(=O) 32 6386 http://www.aAlfa Aesar
    7205 ethyl pyrrole- CCOC(=O)c1cc 38 224184 http://www.aAlfa Aesar
    7206 ethyl pyruvat CCOC(=O)C(=O -58 11544 http://www.aAlfa Aesar
    7207 ethyl salicylat CCOC(=O)c1cc 1 21105897 http://www.aAlfa Aesar
    7208 ethyl stearateCCCCCCCCCCC 35 7830 http://www.aAlfa Aesar
    7209 ethyl tetrade CCCCCCCCCCC 12 29023 http://www.aAlfa Aesar
    7210 ethyl thiooxa CCOC(=O)C(=S 63 2015197 http://www. Alfa Aesar
    7211 ethyl trans-4 CCOC(=O)/C= -9 5382498 http://www.aAlfa Aesar
    7212 ethyl trimethyCCOC(=O)C(C) -90 18688 http://www.aAlfa Aesar
    7213 ethyl undecanCCCCCCCCCCC -15 11822 http://www.aAlfa Aesar
    7214 ethyl valerateCCCCC(=O)OC -91 10420 http://www.aAlfa Aesar
    7215 ethyl vanillateCCOC(=O)c1cc 44 11541 http://www.aAlfa Aesar
    7216 ethyl vinyl et CCOC=C -115 7732 http://www.aAlfa Aesar
    7217 ethyl xanthenCCOC(=O)C1c2 67 205650 http://www.aAlfa Aesar
    7218 ethylbenzene CCc1ccccc1 -95 7219 http://www.aAlfa Aesar
    7219 ethylboronic aB(CC)(O)O 86 454591 http://www.aAlfa Aesar
    7220 ethylene 1,2- C(CSC#N)SC# 90 62624 http://www.aAlfa Aesar
    7221 ethylene carbC(COC(=O)[O- 36 15846387 http://www.aAlfa Aesar
    7222 ethylene chlo ClP1(=O)OCC 12 73155 http://www.aAlfa Aesar
    7223 ethylene glycoC(CO)O -13 13835235 http://www.aAlfa Aesar
    7224 ethylenediamC(CN)N 10 13835550 http://www.aAlfa Aesar
    7225 ethylidenecycCC=C1CCCC1 -130 67620 http://www.aAlfa Aesar
    7226 ethylmalonic CCC(C(=O)O)C 113 11263 http://www.aAlfa Aesar
    7227 ethylphosphonCCP(=O)(O)O 60 177126 http://www.aAlfa Aesar
    7228 ethyltriethoxyCCO[Si](CC)( -78 6268 http://www.aAlfa Aesar
    7229 eugenol COc1cc(ccc1O -10 13876103 http://www.aAlfa Aesar
    7230 exo-7-oxabicyC1=C[C@H]2[ 119 448370 http://www.aAlfa Aesar
    7231 exo-7-oxabicyC1C[C@@H]2[ 114 19973467 http://www.aAlfa Aesar
    7232 fenchone C[C@]12CC[C@ 6 1013316 http://www.aAlfa Aesar
    7233 fenchone C[C@@]12CC[ 4 74207 http://www.aAlfa Aesar
    7234 flavanone c1ccc(cc1)C2 77 9833 http://www.aAlfa Aesar
    7235 flavone c1ccc(cc1)c2c 97 10230 http://www.aAlfa Aesar
    7236 flufenamic acic1ccc(c(c1)C( 134 3254 http://www.aAlfa Aesar
    7237 fluorene c1ccc-2c(c1)C 115 6592 http://www.aAlfa Aesar
    7238 fluorene-1-carc1ccc-2c(c1)C 247 72677 http://www.aAlfa Aesar
    7239 fluorene-2-ca c1ccc-2c(c1)C 84 32028 http://www.aAlfa Aesar
    7240 fluorene-4-carc1ccc-2c(c1)C 192 73450 http://www.aAlfa Aesar
    7241 fluorene-9-acec1ccc2c(c1)-c 134 85581 http://www.aAlfa Aesar
    7242 fluorene-9-carc1ccc2c(c1)-c 229 67376 http://www.aAlfa Aesar
    7243 fluorescaminec1ccc(cc1)C2 157 34768 http://www.aAlfa Aesar
    7244 fluorescein c1ccc2c(c1)C 320 15968 http://www.aAlfa Aesar
    7245 fluorobenzen c1ccc(cc1)F -42 9614 http://www.aAlfa Aesar
    7246 fluorocyclohe C1CCC(CC1)F 13 71321 http://www.aAlfa Aesar
    7247 formamide C(=O)N 2 693 http://www.aAlfa Aesar
    7248 formanilide c1ccc(cc1)NC 47 7388 http://www.aAlfa Aesar
    7249 formic acid C(=O)O 8 278 http://www.aAlfa Aesar
    7250 formic acid hyC(=O)NN 57 11728 http://www.aAlfa Aesar
    7251 fumaronitrile C(=C/C#N)C#N 97 553503 http://www.aAlfa Aesar
    7252 fumaryl chloriC(=C/C(=O)Cl) -2 4482991 http://www.aAlfa Aesar
    7253 furan c1ccoc1 -85 7738 http://www.aAlfa Aesar
    7254 furan-3-boroniB(c1ccoc1)(O) 142 2016110 http://www.aAlfa Aesar
    7255 furfuryl alcohoc1cc(oc1)CO -31 7083 http://www.aAlfa Aesar
    7256 furfurylaminec1cc(oc1)CN -70 3320 http://www.aAlfa Aesar
    7257 gamma-hexano
    CCC1CCC(=O) -18 12232 http://www.aAlfa Aesar
    7258 gamma-valeroCC1CCC(=O)O -31 7633 http://www.aAlfa Aesar
    7259 geraniol CC(=CCC/C(=C -15 13849989 http://www.aAlfa Aesar
    7260 glutaraldehydC(CC=O)CC=O -21 3365 http://www.aAlfa Aesar
    7261 glutaric acid C(CC(=O)O)CC 97 723 http://www.aAlfa Aesar
    7262 glutaric anhydC(CC(=O)O)CC 55 19952808 http://www.aAlfa Aesar
    7263 glutaronitrile C(CC#N)CC#N -29 21106442 http://www.aAlfa Aesar
    7264 glybenzcyclamCOc1ccc(cc1C 173 3368 http://www.aAlfa Aesar
    7265 glycerol C(C(CO)O)O 18 733 http://www.aAlfa Aesar
    7266 glycerol triaceCC(=O)OCC(CO 3 13835706 http://www.aAlfa Aesar
    7267 glycerol tribu CCCC(=O)OCC -75 13849665 http://www.aAlfa Aesar
    7268 glycerol tripa CCCCCCCCCCC 62 10674 http://www.aAlfa Aesar
    7269 glycidyl 4-me COc1ccc(cc1) 47 15783 http://www.aAlfa Aesar
    7270 glycidyl methaCC(=C)C(=O) -82 7549 http://www.aAlfa Aesar
    7271 glycidyl phenyc1ccc(cc1)OC 4 28958 http://www.aAlfa Aesar
    7272 glycolic acid C(C(=O)O)O 77 737 http://www.aAlfa Aesar
    7273 glyoxal C(=O)C=O -14 7572 http://www.aAlfa Aesar x out of range - probably refers to aqueous
    7274 glyoxylic acid C(=O)C(=O)O -93 740 http://www.aAlfa Aesar x refers to aq. solution, not pure compound
    7275 griseofulvin C[C@@H]1CC(= 219 389934 http://www.aAlfa Aesar
    7276 guaiazulene Cc1ccc(cc-2c( 32 3395 http://www.aAlfa Aesar
    7277 harmine Cc1c2c(ccn1)c 264 4444445 http://www.aAlfa Aesar
    7278 heptadecanoicCCCCCCCCCCC 61 10033 http://www.aAlfa Aesar
    7279 heptafluorobut
    C(=O)(C(C(C(F) -18 9394 http://www.aAlfa Aesar
    7280 heptafluorobuC(=O)(C(C(C(F) -43 60962 http://www.aAlfa Aesar
    7281 heptanal CCCCCCC=O -43 7838 http://www.aAlfa Aesar
    7282 heptanenitrileCCCCCCC#N -64 11866 http://www.aAlfa Aesar
    7283 heptanoic aci CCCCCCC(=O) -8 7803 http://www.aAlfa Aesar
    7284 heptanoyl chl CCCCCCC(=O)C -84 16383 http://www.aAlfa Aesar
    7285 hexachloro-1,C(=C(Cl)Cl)(C(= -21 6635 http://www.aAlfa Aesar
    7286 hexachloroac C(=O)(C(Cl)(Cl) -2 13873693 http://www.aAlfa Aesar
    7287 hexachloropr C(=C(Cl)Cl)(C(C -73 15113 http://www.aAlfa Aesar
    7288 hexaethyldisi CC[Si](CC)(CC) -115 63621 http://www.aAlfa Aesar
    7289 hexafluorobe c1(c(c(c(c(c1F) 5 13836549 http://www.aAlfa Aesar
    7290 hexafluoroglutC(=O)(C(C(C(C( 95 61144 http://www.aAlfa Aesar
    7291 hexahydro-1,3,c1ccc(cc1)N2C 191 6798 http://www.aAlfa Aesar
    7292 hexamethylbeCc1c(c(c(c(c1C 165 6642 http://www.aAlfa Aesar
    7293 hexamethylcycC[Si]1(O[Si](O 65 10452 http://www.aAlfa Aesar
    7294 hexamethyldisC[Si](C)(C)[Si] 12 66675 http://www.aAlfa Aesar
    7295 hexamethyldisC[Si](C)(C)N[Si -78 13238 http://www.aAlfa Aesar
    7296 hexamethyldisC[Si](C)(C)O[Si -67 23150 http://www.aAlfa Aesar
    7297 hexamethylenC1CCCNCC1 -37 7828 http://www.aAlfa Aesar
    7298 hexamethylphCN(C)P(N(C)C) -44 14616 http://www.aAlfa Aesar
    7299 hexanal CCCCCC=O -56 5949 http://www.aAlfa Aesar
    7300 hexanamide CCCCCC(=O)N 101 11827 http://www. Alfa Aesar
    7301 hexanoic acid CCCCCC(=O)O -4 8552 http://www.aAlfa Aesar
    7302 hexanoic anhyCCCCCC(=O)O -40 67479 http://www.aAlfa Aesar
    7303 hexanoyl chloCCCCCC(=O)Cl -87 60671 http://www.aAlfa Aesar
    7304 hexaphenylcycc1ccc(cc1)[Si] 180 61494 http://www.aAlfa Aesar
    7305 hexaphenyldisc1ccc(cc1)[Si] 369 66677 http://www.aAlfa Aesar
    7306 hippuric acid c1ccc(cc1)C( 190 451 http://www.aAlfa Aesar
    7307 homophthalicc1ccc2c(c1)C 142 12274 http://www.aAlfa Aesar
    7308 homopiperaziC1CNCCNC1 41 61471 http://www.aAlfa Aesar
    7309 homovanillic aCOc1cc(ccc1O 143 1675 http://www.aAlfa Aesar
    7310 hydantoin C1C(=O)NC(= 222 9612 http://www.aAlfa Aesar
    7311 hydrazobenzec1ccc(cc1)NNc 125 28962 http://www.aAlfa Aesar
    7312 hydrobenzamic1ccc(cc1)C=N 104 60070 http://www. Alfa Aesar
    7313 hydrochlorothc1c2c(cc(c1Cl 269 3513 http://www.aAlfa Aesar
    7314 hydrocortisonC[C@]12CCC( 214 5551 http://www.aAlfa Aesar
    7315 hydroquinonec1cc(ccc1O)O 171 764 http://www.aAlfa Aesar
    7316 hydroxy(tosyl Cc1ccc(cc1)S( 134 288160 http://www.aAlfa Aesar
    7317 hydroxyaceto CC(=O)CO -17 21106125 http://www.aAlfa Aesar
    7318 hyodeoxycholiC[C@H](CCC( 198 4446908 http://www.aAlfa Aesar
    7319 imidazole c1cnc[nH]1 90 773 http://www.aAlfa Aesar
    7320 imidazole-4-c c1c(nc[nH]1) 176 68900 http://www.aAlfa Aesar
    7321 iminodiacetoniC(C#N)NCC#N 77 62621 http://www.aAlfa Aesar
    7322 iminodibenzylc1ccc2c(c1)C 107 9886 http://www.aAlfa Aesar
    7323 iminostilbene c1ccc2c(c1)C 198 8857 http://www.aAlfa Aesar
    7324 indane c1ccc2c(c1)C -51 9903 http://www.aAlfa Aesar
    7325 indole c1ccc2c(c1)cc 52 776 http://www.aAlfa Aesar
    7326 indole-3-acetic1ccc2c(c1)c( 144 20291 http://www.aAlfa Aesar
    7327 indole-3-acetoc1ccc2c(c1)c( 36 312357 http://www.aAlfa Aesar
    7328 indole-3-butyrc1ccc2c(c1)c( 123 8298 http://www.aAlfa Aesar
    7329 indole-3-carboc1ccc2c(c1)c( 180 200562 http://www.aAlfa Aesar
    7330 indole-3-carb c1ccc2c(c1)c( 197 9838 http://www.aAlfa Aesar
    7331 indole-3-methc1ccc2c(c1)c( 98 3581 http://www.aAlfa Aesar
    7332 indole-3-propic1ccc2c(c1)c( 134 3613 http://www.aAlfa Aesar
    7333 indole-4-carb c1cc(c2cc[nH 141 295698 http://www. Alfa Aesar
    7334 indole-5-boronB(c1ccc2c(c1) 173 2016113 http://www. Alfa Aesar
    7335 indole-5-carboc1cc2c(cc[nH] 106 25604 http://www.aAlfa Aesar
    7336 indole-5-carb c1cc2c(cc[nH 98 512041 http://www.aAlfa Aesar
    7337 indole-5-carboc1cc2c(cc[nH] 210 66885 http://www.aAlfa Aesar
    7338 indole-6-carboc1cc(cc2c1cc[ 130 76792 http://www.aAlfa Aesar
    7339 indole-7-carb c1cc2cc[nH]c 88 2016373 http://www.aAlfa Aesar
    7340 indoline c1ccc2c(c1)C -21 9905 http://www.aAlfa Aesar
    7341 indomethacinCc1c(c2cc(ccc 160 3584 http://www.aAlfa Aesar
    7342 iodoacetic aci C(C(=O)O)I 81 5050 http://www.aAlfa Aesar
    7343 iodobenzene c1ccc(cc1)I -31 11087 http://www.aAlfa Aesar
    7344 iodoethane CCI -108 6100 http://www.aAlfa Aesar
    7345 iodoform C(I)(I)I 122 6134 http://www.aAlfa Aesar
    7346 iodomethane CI -67 6088 http://www.aAlfa Aesar
    7347 isobutanol CC(C)CO -108 6312 http://www.aAlfa Aesar
    7348 isobutyl 4-hy CC(C)COC(=O) 76 19066 http://www.aAlfa Aesar
    7349 isobutyl acetaCC(C)COC(=O) -99 7747 http://www.aAlfa Aesar
    7350 isobutyl acryl CC(C)COC(=O) -61 7531 http://www.aAlfa Aesar
    7351 isobutyl chlo CC(C)COC(=O) -80 56154 http://www.aAlfa Aesar
    7352 isobutyl isobuCC(C)COC(=O) -81 7073 http://www.aAlfa Aesar
    7353 isobutylamineCC(C)CN -85 6310 http://www.aAlfa Aesar
    7354 isobutylboroniB(CC(C)C)(O)O 109 2016147 http://www. Alfa Aesar
    7355 isobutyraldehCC(C)C=O -65 6313 http://www.aAlfa Aesar
    7356 isobutyramideCC(C)C(=O)N 128 61707 http://www.aAlfa Aesar
    7357 isobutyric aci CC(C)C(=O)O -47 6341 http://www.aAlfa Aesar
    7358 isobutyric anhCC(C)C(=O)OC -56 7069 http://www.aAlfa Aesar
    7359 isobutyronitri CC(C)C#N -72 6311 http://www.aAlfa Aesar
    7360 isobutyrophe CC(C)C(=O)c1c 1 62359 http://www.aAlfa Aesar
    7361 isobutyryl chl CC(C)C(=O)Cl -90 56120 http://www.aAlfa Aesar
    7362 isoeugenol, ci C/C=C/c1ccc( -10 21106129 http://www.aAlfa Aesar
    7363 isonicotinami c1cnccc1C(=O 157 14346 http://www.aAlfa Aesar
    7364 isonicotinic a c1cnccc1C(=O 172 3635 http://www.aAlfa Aesar
    7365 isonicotinic a c1c[n+](ccc1C 270 24341 http://www.aAlfa Aesar
    7366 isonipecotamiC1CNCCC1C(= 149 3640 http://www.aAlfa Aesar
    7367 isonitrosoace c1ccc(cc1)C( 127 7840755 http://www.aAlfa Aesar
    7368 isopentyl acetCC(C)CCOC(=O -78 29016 http://www.aAlfa Aesar
    7369 isopentyl butyCCCC(=O)OCCC -73 7507 http://www.aAlfa Aesar
    7370 isopentylaminCC(C)CCN -60 7606 http://www.aAlfa Aesar
    7371 isophorone CC1=CC(=O)CC -8 6296 http://www.aAlfa Aesar
    7372 isophorone diCC1(CC(CC(C1 -60 147926 http://www.aAlfa Aesar
    7373 isophthalonitrc1cc(cc(c1)C# 161 11773 http://www.aAlfa Aesar
    7374 isophthaloyl dc1cc(cc(c1)C( 44 7171 http://www.aAlfa Aesar
    7375 isoprene CC(=C)C=C -146 6309 http://www.aAlfa Aesar
    7376 isopropenyl a CC(=C)OC(=O) -93 7628 http://www.aAlfa Aesar
    7377 isopropyl 3-acCC(C)OC(=O)c 40 2987003 http://www.aAlfa Aesar
    7378 isopropyl 4-h CC(C)OC(=O)c 85 18995 http://www.aAlfa Aesar
    7379 isopropyl acetCC(C)OC(=O)C -73 7627 http://www.aAlfa Aesar
    7380 isopropyl ace CC(C)OC(=O)C -27 21171506 http://www.aAlfa Aesar
    7381 isopropyl for CC(C)OC=O -93 11755 http://www.aAlfa Aesar
    7382 isopropyl n-p CC(C)OC(=O)N 88 23083 http://www.aAlfa Aesar
    7383 isopropyl palmCCCCCCCCCCC 12 8567 http://www.aAlfa Aesar
    7384 isopropylaminCC(C)N -101 6123 http://www.aAlfa Aesar
    7385 isopropyl-betaCC(C)S[C@H] 112 571154 http://www.aAlfa Aesar
    7386 isopropyldiphCC(C)P(c1cccc 40 72909 http://www. Alfa Aesar
    7387 isopropyliden CC1(OC(=O)CC 94 15418 http://www.aAlfa Aesar
    7388 isopropylmaloCC(C)C(C(=O) 89 62259 http://www.aAlfa Aesar
    7389 isoquinoline c1ccc2cnccc2 26 8098 http://www.aAlfa Aesar
    7390 isoquinoline nc1ccc2c[n+](c 104 256210 http://www.aAlfa Aesar
    7391 isoquinoline-1c1ccc2c(c1)c 89 270569 http://www.aAlfa Aesar
    7392 isoquinoline-3c1ccc2cnc(cc 127 4253348 http://www.aAlfa Aesar
    7393 isoquinoline- c1cc2cnccc2c 115 5379862 http://www.aAlfa Aesar
    7394 isoquinoline-5c1cc2cnccc2c( 280 229042 http://www.aAlfa Aesar
    7395 isovaleraldeh CC(C)CC=O -51 11065 http://www.aAlfa Aesar
    7396 isovaleramideCC(C)CC(=O)N 136 10467 http://www.aAlfa Aesar
    7397 isovaleric acidCC(C)CC(=O)O -33 10001 http://www.aAlfa Aesar
    7398 isovaleric anhCC(C)CC(=O)O -65 66481 http://www.aAlfa Aesar
    7399 isoxazole-5-cac1cnoc1C(=O) 143 1553137 http://www.aAlfa Aesar
    7400 itaconic acid C=C(CC(=O)O) 167 789 http://www.aAlfa Aesar
    7401 itaconic anhydC=C(CC(=O)O) 70 19970689 http://www.aAlfa Aesar
    7402 julolidine c1cc2c3c(c1) 35 61383 http://www.aAlfa Aesar
    7403 kojic acid c1c(occ(c1=O 154 3708 http://www.aAlfa Aesar
    7404 lactic acid CC(C(=O)O)O 18 592 http://www.aAlfa Aesar
    7405 L-adrenaline CNC[C@@H](c1 218 5611 http://www.aAlfa Aesar
    7406 L-arabitol C(O)[C@H](O 101 388391 http://www.aAlfa Aesar
    7407 L-ascorbic aci CCCCCCCCCCC 114 16736579 http://www.aAlfa Aesar
    7408 lawesson's re COc1ccc(cc1)P 223 79346 http://www.aAlfa Aesar
    7409 lepidine Cc1ccnc2c1cc 10 13854818 http://www.aAlfa Aesar
    7410 leucomalachitCN(C)c1ccc(cc 101 60551 http://www.aAlfa Aesar
    7411 levulinic acid CC(=O)CCC(=O 29 11091 http://www.aAlfa Aesar
    7412 L-fucose C[C@H]1[C@H 139 388645 http://www.aAlfa Aesar
    7413 L-glutamic acic1ccc(cc1)CO 169 109087 http://www.aAlfa Aesar
    7414 linoleic acid CCCCC/C=CC/ -12 4444105 http://www.aAlfa Aesar
    7415 L-lactic acid, C[C@@H](C(= 53 96860 http://www.aAlfa Aesar
    7416 L-leucine-4-niCC(C)C[C@@H] 90 2015088 http://www.aAlfa Aesar
    7417 L-lyxose C([C@@H]([C 110 559211 http://www.aAlfa Aesar
    7418 L-menthol C[C@@H]1CC[ 44 15803 http://www.aAlfa Aesar
    7419 L-methioninolCSCC[C@@H]( 32 2006549 http://www.aAlfa Aesar
    7420 L-m-tyrosine c1cc(cc(c1)O 265 5323512 http://www. Alfa Aesar
    7421 lovastatin CC[C@H](C)C 175 48085 http://www. Alfa Aesar
    7422 L-phenylalani c1ccc(cc1)C[ 92 394370 http://www.aAlfa Aesar
    7423 L-ribose C([C@H]1[C@ 87 9979598 http://www.aAlfa Aesar
    7424 L-tartaric acid[C@@H]([C@H 169 392277 http://www.aAlfa Aesar
    7425 lupinine C1CCN2CCC[C 64 82587 http://www.aAlfa Aesar
    7426 L-valine CC(C)[C@@H] 315 6050 http://www.aAlfa Aesar
    7427 maleic acid C(=CC(=O)O)C 134 392248 http://www.aAlfa Aesar
    7428 maleic anhydrC1=CC(=O)OC 54 7635 http://www.aAlfa Aesar
    7429 maleimide C1=CC(=O)NC 92 10471 http://www.aAlfa Aesar
    7430 malonamide C(C(=O)N)C(= 169 7623 http://www.aAlfa Aesar
    7431 malonic acid C(C(=O)NN)C( 154 69844 http://www.aAlfa Aesar
    7432 malononitrile C(C#N)C#N 32 13884495 http://www.aAlfa Aesar
    7433 maltitol C([C@@H]1[C 151 432001 http://www.aAlfa Aesar
    7434 mandelic acidc1ccc(cc1)C(C 120 1253 http://www.aAlfa Aesar
    7435 mandelic acidc1ccc(cc1)C( 130 65904 http://www.aAlfa Aesar
    7436 mandelonitril c1ccc(cc1)C(C -10 10304 http://www.aAlfa Aesar
    7437 m-anisidine COc1cccc(c1) -1 13869480 http://www.aAlfa Aesar
    7438 m-cresol Cc1cccc(c1)O 11 21105871 http://www.aAlfa Aesar
    7439 mercaptoacetiC(C(=O)O)S -11 1101 http://www.aAlfa Aesar
    7440 mercaptosucciC(C(C(=O)O)S 152 6032 http://www.aAlfa Aesar
    7441 mesitaldehyd Cc1cc(c(c(c1) 14 21168786 http://www.aAlfa Aesar
    7442 mesityl oxide CC(=CC(=O)C) -59 8526 http://www.aAlfa Aesar
    7443 mesitylacetic Cc1cc(c(c(c1) 169 70500 http://www.aAlfa Aesar
    7444 mesitylacetoniCc1cc(c(c(c1) 79 454183 http://www.aAlfa Aesar
    7445 mesitylene Cc1cc(cc(c1)C -45 7659 http://www.aAlfa Aesar
    7446 mesitylene-2-sCc1cc(c(c(c1) 55 12504 http://www.aAlfa Aesar
    7447 mesitylglyoxylCc1cc(c(c(c1) 121 3086623 http://www.aAlfa Aesar
    7448 meso-erythritC(C(C(CO)O)O 122 13835932 http://www.aAlfa Aesar
    7449 meso-hydrobec1ccc(cc1)[C 135 745455 http://www.aAlfa Aesar
    7450 methacrolein CC(=C)C=O -81 6314 http://www.aAlfa Aesar
    7451 methacrylamiCC(=C)C(=O)N 110 6346 http://www.aAlfa Aesar
    7452 methacrylic acCC(=C)C(=O)O 16 3951 http://www.aAlfa Aesar
    7453 methacryloyl CC(=C)C(=O)Cl -60 12940 http://www.aAlfa Aesar
    7454 methanesulfoCS(=O)(=O)N 90 65711 http://www.aAlfa Aesar
    7455 methanesulfon
    CS(=O)(=O)O 20 6155 http://www.aAlfa Aesar
    7456 methanesulfon
    CS(=O)(=O)OS 67 73591 http://www.aAlfa Aesar
    7457 methanesulfon
    CS(=O)(=O)Cl -33 29037 http://www.aAlfa Aesar
    7458 methanol CO -98 864 http://www.aAlfa Aesar
    7459 methoxyaceticCOCC(=O)O 8 11750 http://www.aAlfa Aesar
    7460 methyl (3,5-d COC(=O)Nc1cc( 121 30430 http://www.aAlfa Aesar
    7461 methyl (S)-lacC[C@@H](C(= -44 85180 http://www.aAlfa Aesar
    7462 methyl 1,2,5-tCc1cc(c(n1C) 117 2023703 http://www.aAlfa Aesar
    7463 methyl 1h-benCOC(=O)c1ccc 174 4917802 http://www.aAlfa Aesar
    7464 methyl 1h-indCOC(=O)c1ccc 143 252615 http://www. Alfa Aesar
    7465 methyl 1-methCn1cncc1C(=O 57 2018549 http://www.aAlfa Aesar
    7466 methyl 2-(chl COC(=O)c1ccc 62 105293 http://www.aAlfa Aesar
    7467 methyl 2-(metCOC(=O)c1ccc 65 246187 http://www.aAlfa Aesar
    7468 methyl 2,1,3- COC(=O)c1ccc 91 606694 http://www.aAlfa Aesar
    7469 methyl 2,4,6- COC(=O)c1c(c 177 69065 http://www.aAlfa Aesar
    7470 methyl 2,4-di COC(=O)c1ccc 118 15663 http://www.aAlfa Aesar
    7471 methyl 2,4-d Cc1cc(cc(c1C 49 523143 http://www.aAlfa Aesar
    7472 methyl 2,5-di COC(=O)c1cc(c 39 16951 http://www.aAlfa Aesar
    7473 methyl 2,5-di COC(=O)c1cc( 87 67629 http://www.aAlfa Aesar
    7474 methyl 2,5-di Cc1cc(c([nH]1 120 515258 http://www.aAlfa Aesar
    7475 methyl 2,6-di COC(=O)c1c(cc 28 521213 http://www.aAlfa Aesar
    7476 methyl 2-ace CC(=O)Nc1ccc 134 643353 http://www.aAlfa Aesar
    7477 methyl 2-acetCC(=O)Nc1ccc 130 3830514 http://www.aAlfa Aesar
    7478 methyl 2-acetCC(=O)NC(=C) 50 89087 http://www.aAlfa Aesar
    7479 methyl 2-ami COC(=O)c1cc(c 88 62290 http://www.aAlfa Aesar
    7480 methyl 2-aminCOC(=O)c1c2c 128 2037316 http://www. Alfa Aesar
    7481 methyl 2-ami COc1cc(c(cc1 129 531250 http://www.aAlfa Aesar
    7482 methyl 2-aminCOC(=O)c1ccc 67 72256 http://www.aAlfa Aesar
    7483 methyl 2-ami COC(=O)c1cc( 72 643354 http://www.aAlfa Aesar
    7484 methyl 2-aminCOC(=O)c1cc(c 68 5383866 http://www.aAlfa Aesar
    7485 methyl 2-aminCOC(=O)c1cc( 69 71213 http://www.aAlfa Aesar
    7486 methyl 2-aminCOC(=O)c1cc( 23 2063542 http://www.aAlfa Aesar
    7487 methyl 2-aminCOC(=O)c1ccn 147 206890 http://www.aAlfa Aesar
    7488 methyl 2-benzCOC(=O)c1ccc 47 220170 http://www.aAlfa Aesar
    7489 methyl 2-bro COC(=O)c1cc(c 39 247004 http://www.aAlfa Aesar
    7490 methyl 2-bromCOC(=O)c1cc(c 81 214752 http://www.aAlfa Aesar
    7491 methyl 2-bromCOC(=O)c1cnc 63 2053918 http://www. Alfa Aesar
    7492 methyl 2-chloCOC(=O)c1ccc( 76 75202 http://www.aAlfa Aesar
    7493 methyl 2-chloCOC(=O)c1cc(c 71 21331 http://www.aAlfa Aesar
    7494 methyl 2-diphCOC(=O)c1c2cc 108 9935119 http://www. Alfa Aesar
    7495 methyl 2-formCOC(=O)c1cc( 115 715475 http://www. Alfa Aesar
    7496 methyl 2-hydrCOC(=O)c1c2c 80 520288 http://www.aAlfa Aesar
    7497 methyl 2-hydrCc1cccc(c1O) 29 29521 http://www.aAlfa Aesar
    7498 methyl 2-hydrCOC(=O)c1cccc 131 518879 http://www.aAlfa Aesar
    7499 methyl 2-hyd COc1ccc(c(c1 48 71833 http://www.aAlfa Aesar
    7500 methyl 2-hydrCOC(=O)c1cc(c 116 78515 http://www.aAlfa Aesar
    7501 methyl 2-methCOc1ccc(cc1C( 101 5383867 http://www.aAlfa Aesar
    7502 methyl 2-nap COC(=O)c1ccc 77 121266 http://www.aAlfa Aesar
    7503 methyl 2-nitr COc1cc(c(c(c1 68 71104 http://www.aAlfa Aesar
    7504 methyl 2-nitr COC(=O)c1cccc -13 62292 http://www.aAlfa Aesar
    7505 methyl 2-oxo-COC(=O)c1ccc 76 105184 http://www. Alfa Aesar
    7506 methyl 2-trif COC(=O)c1c2cc 42 9210171 http://www.aAlfa Aesar
    7507 methyl 3-(1-p COC(=O)c1c(c 61 455830 http://www.aAlfa Aesar
    7508 methyl 3-(2-h COC(=O)CCc1c 42 2073461 http://www.aAlfa Aesar
    7509 methyl 3-(br COC(=O)c1ccc 44 451930 http://www.aAlfa Aesar
    7510 methyl 3-(thieCOC(=O)/C=C/ 49 4647637 http://www.aAlfa Aesar
    7511 methyl 3,3-di CC(=CC(=O)OC -41 12958 http://www.aAlfa Aesar
    7512 methyl 3,4,5- COC(=O)c1cc( 201 7150 http://www.aAlfa Aesar
    7513 methyl 3,4,5- COc1cc(cc(c1 83 15161 http://www.aAlfa Aesar
    7514 methyl 3,4-di COC(=O)c1ccc 107 119379 http://www.aAlfa Aesar
    7515 methyl 3,4-di COC(=O)c1ccc( 45 68676 http://www.aAlfa Aesar
    7516 methyl 3,4-di COC(=O)Cc1ccc 29 1064916 http://www.aAlfa Aesar
    7517 methyl 3,4-di COC(=O)CC1C( 143 566479 http://www. Alfa Aesar
    7518 methyl 3,4-di COC(=O)c1ccc 136 253113 http://www.aAlfa Aesar
    7519 methyl 3,4-d COc1ccc(cc1O 59 21159598 http://www.aAlfa Aesar
    7520 methyl 3,4-di Cc1ccc(cc1C) 36 454358 http://www.aAlfa Aesar
    7521 methyl 3,5-di COC(=O)c1cc( 133 5374001 http://www.aAlfa Aesar
    7522 methyl 3,5-di Cc1c(c(c(c(c1 110 3335024 http://www.aAlfa Aesar
    7523 methyl 3,5-di Cc1c(c(c(c(c1 60 452770 http://www.aAlfa Aesar
    7524 methyl 3,5-d COC(=O)c1cc(c 151 542282 http://www.aAlfa Aesar
    7525 methyl 3,5-d COC(=O)c1cc(c 124 634827 http://www.aAlfa Aesar
    7526 methyl 3,5-d Cc1c(cc(cc1Br 88 542120 http://www.aAlfa Aesar
    7527 methyl 3,5-d COC(=O)c1cc(c 63 540387 http://www.aAlfa Aesar
    7528 methyl 3,5-di COC(=O)c1cc(c 59 68675 http://www.aAlfa Aesar
    7529 methyl 3,5-di COC(=O)c1cc( 166 67628 http://www.aAlfa Aesar
    7530 methyl 3,5-di COc1cc(cc(c1 106 63351 http://www.aAlfa Aesar
    7531 methyl 3,5-d COc1cc(cc(c1 42 21159597 http://www.aAlfa Aesar
    7532 methyl 3,5-di Cc1cc(cc(c1)C 32 30388 http://www.aAlfa Aesar
    7533 methyl 3,5-di COC(=O)c1cc(c 110 192748 http://www.aAlfa Aesar
    7534 methyl 3,5-di CC(C)(C)c1cc( 165 68160 http://www.aAlfa Aesar
    7535 methyl 3-aminCOC(=O)c1c(c( 207 2058853 http://www. Alfa Aesar
    7536 methyl 3-ami COC(=O)c1ccc( 135 10255335 http://www.aAlfa Aesar
    7537 methyl 3-ami COc1ccc(cc1N 85 2016558 http://www.aAlfa Aesar
    7538 methyl 3-ami Cc1ccc(cc1N) 115 299371 http://www.aAlfa Aesar
    7539 methyl 3-aminCc1csc(c1N)C 86 110178 http://www.aAlfa Aesar
    7540 methyl 3-aminCOC(=O)c1c(nc 232 66462 http://www. Alfa Aesar
    7541 methyl 3-aminCOC(=O)c1c(cc 147 610521 http://www.aAlfa Aesar
    7542 methyl 3-ami COC(=O)c1ccc 51 70646 http://www.aAlfa Aesar
    7543 methyl 3-ami C/C(=C/C(=O) 83 559012 http://www.aAlfa Aesar
    7544 methyl 3-aminCOC(=O)c1c(n 171 65527 http://www. Alfa Aesar
    7545 methyl 3-aminCOC(=O)c1c(c 65 80916 http://www.aAlfa Aesar
    7546 methyl 3-bro COC(=O)c1ccc( 109 3965598 http://www. Alfa Aesar
    7547 methyl 3-bro COc1ccc(cc1B 97 531699 http://www. Alfa Aesar
    7548 methyl 3-bro COC(=O)c1cc(c 133 25027441 http://www. Alfa Aesar
    7549 methyl 3-bro COC(=O)c1cccc 32 11573 http://www.aAlfa Aesar
    7550 methyl 3-chloCOC(=O)c1ccc( 107 69985 http://www.aAlfa Aesar
    7551 methyl 3-chl COc1ccc(cc1C 95 110065 http://www.aAlfa Aesar
    7552 methyl 3-chloCc1ccc(cc1Cl) 29 2080117 http://www. Alfa Aesar
    7553 methyl 3-chloCOC(=O)c1cc(c 42 21242187 http://www.aAlfa Aesar
    7554 methyl 3-chloCOC(=O)c1c(c2 81 527697 http://www.aAlfa Aesar
    7555 methyl 3-chloCOC(=O)c1cccc 21 21106541 http://www.aAlfa Aesar
    7556 methyl 3-chloCOC(=O)c1c(cc 38 2057844 http://www.aAlfa Aesar
    7557 methyl 3-cya COc1ccc(cc1C 122 2079724 http://www.aAlfa Aesar
    7558 methyl 3-ethoCCOc1ccsc1C( 73 2057926 http://www.aAlfa Aesar
    7559 methyl 3-fluo COc1ccc(cc1F 71 515367 http://www. Alfa Aesar
    7560 methyl 3-hydrCOC(=O)c1cc2 73 63350 http://www.aAlfa Aesar
    7561 methyl 3-hydrCOC(=O)c1ccc( 91 260147 http://www.aAlfa Aesar
    7562 methyl 3-hyd COC(=O)c1ccc 71 79453 http://www.aAlfa Aesar
    7563 methyl 3-hydrCOC(=O)c1c(c 46 10412272 http://www.aAlfa Aesar
    7564 methyl 3-iod COc1ccc(cc1I 94 280542 http://www.aAlfa Aesar
    7565 methyl 3-methCOc1cccc(c1[N 143 71522 http://www.aAlfa Aesar
    7566 methyl 3-met Cc1ccc(cc1OC 49 513874 http://www.aAlfa Aesar
    7567 methyl 3-methCOc1cc(ccc1[N 85 253330 http://www.aAlfa Aesar
    7568 methyl 3-methCOc1ccsc1C(= 62 611542 http://www.aAlfa Aesar
    7569 methyl 3-methCc1ccoc1C(=O 35 310946 http://www.aAlfa Aesar
    7570 methyl 3-methCc1cc(ccc1[N+ 81 229035 http://www.aAlfa Aesar
    7571 methyl 3-met C/C(=C/C(=O) 62 4642926 http://www.aAlfa Aesar
    7572 methyl 3-methCc1c2ccccc2s 104 236169 http://www.aAlfa Aesar
    7573 methyl 3-nitr COC(=O)c1cccc 79 62472 http://www.aAlfa Aesar
    7574 methyl 4-(3-t COC(=O)c1ccc( 162 3343253 http://www. Alfa Aesar
    7575 methyl 4-(bocCC(C)(C)OC(= 81 21328473 http://www. Alfa Aesar
    7576 methyl 4-(br COC(=O)c1ccc 56 225139 http://www.aAlfa Aesar
    7577 methyl 4-(chl COC(=O)c1ccc( 40 33683 http://www.aAlfa Aesar
    7578 methyl 4-(hydCOC(=O)c1cc( 75 16124129 http://www. Alfa Aesar
    7579 methyl 4-(me CNc1ccc(cc1) 95 123800 http://www.aAlfa Aesar
    7580 methyl 4-(metCOC(=O)c1ccc 165 2082914 http://www.aAlfa Aesar
    7581 methyl 4-(tri CS(=O)(=O)c1c 67 2057629 http://www.aAlfa Aesar
    7582 methyl 4-(tri COC(=O)c1ccc( 14 453979 http://www.aAlfa Aesar
    7583 methyl 4,5-di COC(=O)c1c(c( 127 14639494 http://www.aAlfa Aesar
    7584 methyl 4,5-di COC(=O)c1cc(c 79 2009722 http://www. Alfa Aesar
    7585 methyl 4,5-di COc1cc(c(cc1O 143 105324 http://www.aAlfa Aesar
    7586 methyl 4,6-o- CO[C@@H]1[C 165 558408 http://www.aAlfa Aesar
    7587 methyl 4-ace CC(=O)Nc1cc( 155 70121 http://www.aAlfa Aesar
    7588 methyl 4-acetCC(=O)c1ccc( 86 121635 http://www.aAlfa Aesar
    7589 methyl 4-ami COc1cc(ccc1C 156 147573 http://www.aAlfa Aesar
    7590 methyl 4-aminCOC(=O)c1ccc( 113 1246664 http://www.aAlfa Aesar
    7591 methyl 4-ami COC(=O)c1ccc 120 5383569 http://www.aAlfa Aesar
    7592 methyl 4-ami COC(=O)c1ccc 112 11585 http://www.aAlfa Aesar
    7593 methyl 4-aminCOC(=O)c1cnc 173 514939 http://www.aAlfa Aesar
    7594 methyl 4-benzCOC(=O)c1ccc 98 264867 http://www.aAlfa Aesar
    7595 methyl 4-bro COc1cc(ccc1C 33 11204165 http://www. Alfa Aesar
    7596 methyl 4-bromCOC(=O)c1c(c( 80 10649597 http://www.aAlfa Aesar
    7597 methyl 4-bro Cc1cc(ccc1Br 42 2542779 http://www.aAlfa Aesar
    7598 methyl 4-bro COC(=O)c1ccc( 79 11584 http://www.aAlfa Aesar
    7599 methyl 4-chloCOC(=O)c1ccc( 80 642951 http://www.aAlfa Aesar
    7600 methyl 4-chloCOC(=O)c1ccc( 43 13669 http://www.aAlfa Aesar
    7601 methyl 4-chloCOC(=O)/C=C/c 76 4473725 http://www.aAlfa Aesar
    7602 methyl 4-cyanCOC(=O)c1cc( 118 13280185 http://www. Alfa Aesar
    7603 methyl 4-cya COC(=O)c1ccc 67 63956 http://www.aAlfa Aesar
    7604 methyl 4-dim CN(C)c1ccc(c 100 64155 http://www.aAlfa Aesar
    7605 methyl 4-eth CCOc1ccc(cc1 36 81458 http://www.aAlfa Aesar
    7606 methyl 4-ethyCOC(=O)c1ccc 93 555532 http://www. Alfa Aesar
    7607 methyl 4-fluo COC(=O)c1ccc( 90 13630726 http://www.aAlfa Aesar
    7608 methyl 4-fluorCOC(=O)c1ccc 39 2055745 http://www.aAlfa Aesar
    7609 methyl 4-formCOC(=O)c1ccc 61 14559 http://www.aAlfa Aesar
    7610 methyl 4-hyd COc1cc(ccc1O 64 4512663 http://www.aAlfa Aesar
    7611 methyl 4-hydrCOC(=O)c1ccc( 75 60199 http://www.aAlfa Aesar
    7612 methyl 4-hydrCC1CC(=CC(=O 123 14083998 http://www.aAlfa Aesar
    7613 methyl 4-hyd COC(=O)c1ccc 127 7176 http://www.aAlfa Aesar
    7614 methyl 4-hydrCOC(=O)Cc1cc 57 452661 http://www.aAlfa Aesar
    7615 methyl 4-iodoCc1cc(ccc1I)C 61 201942 http://www.aAlfa Aesar
    7616 methyl 4-iodoCOC(=O)c1ccc( 103 263038 http://www.aAlfa Aesar
    7617 methyl 4-iodoCOC(=O)c1ccc( 115 62484 http://www.aAlfa Aesar
    7618 methyl 4-iodosCOC(=O)c1ccc( 69 9555321 http://www.aAlfa Aesar
    7619 methyl 4-methCOc1ccc(cc1[N 111 523425 http://www.aAlfa Aesar
    7620 methyl 4-met COc1ccc(cc1) 50 21108577 http://www.aAlfa Aesar
    7621 methyl 4-methCOc1cccc2c1c 141 599655 http://www. Alfa Aesar
    7622 methyl 4-methCc1ccc(cc1[N+ 51 73829 http://www.aAlfa Aesar
    7623 methyl 4-nitr COC(=O)c1ccc( 96 11586 http://www.aAlfa Aesar
    7624 methyl 4-n-ocCCCCCCCCOc1c 35 2018569 http://www.aAlfa Aesar
    7625 methyl 5-acetyCC(=O)c1ccc( 60 77058 http://www.aAlfa Aesar
    7626 methyl 5-aminCOC(=O)c1ccc 133 4248947 http://www.aAlfa Aesar
    7627 methyl 5-bromCOC(=O)c1ccc 64 521295 http://www.aAlfa Aesar
    7628 methyl 5-bromCOC(=O)c1cc( 97 609405 http://www.aAlfa Aesar
    7629 methyl 5-bromCOC(=O)c1ccc 101 5379469 http://www.aAlfa Aesar
    7630 methyl 5-chloCOC(=O)c1cc( 46 70085 http://www.aAlfa Aesar
    7631 methyl 5-chloCOC(=O)c1cc(c 49 149513 http://www.aAlfa Aesar
    7632 methyl 5-iodosCOC(=O)c1cc(c 77 217932 http://www.aAlfa Aesar
    7633 methyl 5-methCc1cc(no1)C( 92 79608 http://www.aAlfa Aesar
    7634 methyl 5-methCc1cc(cnc1)C 44 224779 http://www.aAlfa Aesar
    7635 methyl 5-nitroCOC(=O)c1ccc( 80 85609 http://www.aAlfa Aesar
    7636 methyl 6-aminCOC(=O)c1ccc 155 644524 http://www. Alfa Aesar
    7637 methyl 6-bro COC(=O)c1ccc2 122 746508 http://www.aAlfa Aesar
    7638 methyl 6-chloCOC(=O)c1ccc( 86 222852 http://www.aAlfa Aesar
    7639 methyl 6-methCOc1ccc(cn1) 51 509413 http://www.aAlfa Aesar
    7640 methyl 6-methCc1ccc(cn1)C 34 201753 http://www.aAlfa Aesar
    7641 methyl acetatCC(=O)OC -98 6335 http://www.aAlfa Aesar
    7642 methyl acetoaCC(=O)CC(=O) -80 13874867 http://www.aAlfa Aesar
    7643 methyl acryla COC(=O)C=C -75 7022 http://www.aAlfa Aesar
    7644 methyl alpha-CO[C@@H]1[C 169 58473 http://www.aAlfa Aesar
    7645 methyl anthraCOC(=O)c1ccc 24 13858096 http://www.aAlfa Aesar
    7646 methyl benzenCOS(=O)(=O)c -4 6378 http://www.aAlfa Aesar
    7647 methyl benzil COC(=O)C(c1cc 75 59546 http://www.aAlfa Aesar
    7648 methyl benzo[COC(=O)c1cc2 70 2079069 http://www.aAlfa Aesar
    7649 methyl benzo COC(=O)c1ccc -12 6883 http://www.aAlfa Aesar
    7650 methyl beta-dCO[C@H]1[C@ 177 85024 http://www.aAlfa Aesar
    7651 methyl beta-l CO[C@@H]1[C 170 92301 http://www.aAlfa Aesar
    7652 methyl biphenCOC(=O)c1ccc( 118 62956 http://www.aAlfa Aesar
    7653 methyl bromoCOC(=O)CBr -50 54945 http://www.aAlfa Aesar
    7654 methyl butyraCCCC(=O)OC -85 11680 http://www.aAlfa Aesar
    7655 methyl butyryCCCC(=O)CC( -43 108588 http://www.aAlfa Aesar
    7656 methyl carba COC(=O)N 55 11229 http://www.aAlfa Aesar
    7657 methyl carbazCOC(=O)NN 72 72718 http://www.aAlfa Aesar
    7658 methyl chloroCOC(=O)CCl -32 13872667 http://www.aAlfa Aesar
    7659 methyl cholatC[C@H](CCC( 156 9136051 http://www.aAlfa Aesar
    7660 methyl coumaCOC(=O)c1ccc 70 72362 http://www.aAlfa Aesar
    7661 methyl cyanoaCOC(=O)CC#N -23 13867413 http://www.aAlfa Aesar
    7662 methyl decan CCCCCCCCCC( -18 7759 http://www.aAlfa Aesar
    7663 methyl dichlo COC(=O)C(Cl)C -52 8013 http://www.aAlfa Aesar
    7664 methyl diphenCOC(=O)C(c1c 60 69465 http://www.aAlfa Aesar
    7665 methyl dodecCCCCCCCCCCC 5 7847 http://www.aAlfa Aesar
    7666 methyl eicosaCCCCCCCCCCC 48 13621 http://www.aAlfa Aesar
    7667 methyl elaida CCCCCCCC/C= 10 4444205 http://www. Alfa Aesar
    7668 methyl forma COC=O -100 7577 http://www.aAlfa Aesar
    7669 methyl heptafCOC(=O)C(C(C(F -86 61060 http://www.aAlfa Aesar
    7670 methyl hexan CCCCCC(=O)O -71 7536 http://www.aAlfa Aesar
    7671 methyl indoleCOC(=O)c1c[n 151 512092 http://www.aAlfa Aesar
    7672 methyl indoleCOC(=O)c1ccc 70 2015445 http://www.aAlfa Aesar
    7673 methyl indoleCOC(=O)c1ccc2 125 2019267 http://www.aAlfa Aesar
    7674 methyl indoleCOC(=O)c1ccc 79 555233 http://www.aAlfa Aesar
    7675 methyl isobutCC(C)C(=O)OC -85 10571 http://www.aAlfa Aesar
    7676 methyl isobutCC(C)C(=O)CC -75 2040717 http://www.aAlfa Aesar
    7677 methyl isonicoCOC(=O)c1ccn 8 197537 http://www.aAlfa Aesar
    7678 methyl isoqui COC(=O)c1cc2 86 633378 http://www.aAlfa Aesar
    7679 methyl isothi CN=C=S 32 10694 http://www.aAlfa Aesar
    7680 methyl isoxaz COC(=O)c1ccn 49 2018545 http://www.aAlfa Aesar
    7681 methyl linoleaCCCCC/C=CC/ -35 4447491 http://www.aAlfa Aesar
    7682 methyl malonCOC(=O)CC(= 39 2831361 http://www.aAlfa Aesar
    7683 methyl mercaCOC(=O)CS -3 16019 http://www.aAlfa Aesar
    7684 methyl methacCC(=C)C(=O)O -48 6406 http://www.aAlfa Aesar
    7685 methyl methylCOC(=O)CS(=O 61 2040666 http://www.aAlfa Aesar
    7686 methyl nicoti COC(=O)c1ccc 42 21111785 http://www.aAlfa Aesar
    7687 methyl n-methCNc1ccccc1C( 18 21108245 http://www.aAlfa Aesar
    7688 methyl n-propy
    CCCSC -113 18607 http://www.aAlfa Aesar
    7689 methyl octanoCCCCCCCC(=O -40 7800 http://www.aAlfa Aesar
    7690 methyl palmitCCCCCCCCCCC 31 7889 http://www.aAlfa Aesar
    7691 methyl pentafCOC(=O)Oc1c(c 29 16093605 http://www.aAlfa Aesar
    7692 methyl phenylCS(=O)(=O)c1c 87 17347 http://www.aAlfa Aesar
    7693 methyl phenylCS(=O)c1ccccc 29 13860 http://www.aAlfa Aesar
    7694 methyl phenylCOC(=O)CS(=O 30 483123 http://www.aAlfa Aesar
    7695 methyl propioCCC(=O)OC -88 10653 http://www.aAlfa Aesar
    7696 methyl p-tolu Cc1ccc(cc1)C 34 7175 http://www.aAlfa Aesar
    7697 methyl p-tolu Cc1ccc(cc1)S( 26 6393 http://www.aAlfa Aesar
    7698 methyl p-tolylCc1ccc(cc1)S( 88 17493 http://www.aAlfa Aesar
    7699 methyl pyrazi COC(=O)c1cnc 58 65523 http://www.aAlfa Aesar
    7700 methyl pyridaCOC(=O)c1ccn 66 10437212 http://www. Alfa Aesar
    7701 methyl quinoxCOC(=O)c1ccc 98 2061423 http://www.aAlfa Aesar
    7702 methyl red CN(C)c1ccc(c 181 9881 http://www.aAlfa Aesar
    7703 methyl salicyl COC(=O)c1ccc -9 13848808 http://www.aAlfa Aesar
    7704 methyl stearaCCCCCCCCCCC 40 7909 http://www.aAlfa Aesar
    7705 methyl tetradCCCCCCCCCCC 18 29024 http://www.aAlfa Aesar
    7706 methyl thiocyCSC#N -5 10695 http://www. Alfa Aesar
    7707 methyl trichloCOC(=O)C(Cl)( -18 11246 http://www.aAlfa Aesar
    7708 methyl trifluoCOC(=O)C(F)(F -78 9509 http://www.aAlfa Aesar
    7709 methyl undecCCCCCCCCCCC -10 14847 http://www.aAlfa Aesar
    7710 methyl valeraCCCCC(=O)OC -91 11706 http://www.aAlfa Aesar
    7711 methyl vanillaCOc1cc(ccc1O 64 18693 http://www.aAlfa Aesar
    7712 methyl vinyl CC(=O)C=C -7 6322 http://www.aAlfa Aesar
    7713 methylboronicB(C)(O)O 92 122904 http://www.aAlfa Aesar
    7714 methylcycloh CC1CCCCC1 -126 7674 http://www.aAlfa Aesar
    7715 methylcyclop CC1CCCC1 -143 7024 http://www.aAlfa Aesar
    7716 methyldiphenyCP(=O)(c1cccc 113 67594 http://www.aAlfa Aesar
    7717 methylene ditC(SC#N)SC#N 105 21349 http://www.aAlfa Aesar
    7718 methylenebis(tC(CC(=O)S)CC 128 14241874 http://www.aAlfa Aesar
    7719 methylenedif C(NC=O)NC=O 142 73388 http://www.aAlfa Aesar
    7720 methylenediph
    C(P(=O)(O)O) 203 15308 http://www.aAlfa Aesar
    7721 methyl-p-ben CC1=CC(=O)C 69 10651 http://www.aAlfa Aesar
    7722 methylphenylpCP(=O)(c1cccc 133 306384 http://www.aAlfa Aesar
    7723 methylphospho
    CP(=O)(O)O 105 13220 http://www.aAlfa Aesar
    7724 methylsulfonylCS(=O)(=O)CC 117 2963173 http://www.aAlfa Aesar
    7725 methylsulfonylCS(=O)(=O)CC 84 67825 http://www.aAlfa Aesar
    7726 methylthiometCc1ccc(cc1)S( 79 477264 http://www. Alfa Aesar
    7727 methyltrichlorC[Si](Cl)(Cl)Cl -78 6159 http://www.aAlfa Aesar
    7728 methyltriphenC[Si](c1ccccc1 67 455964 http://www.aAlfa Aesar
    7729 michler's ket CN(C)c1ccc(cc 175 6764 http://www.aAlfa Aesar
    7730 mono-n-dodecCCCCCCCCCCC 42 68325 http://www.aAlfa Aesar
    7731 morpholine C1COCCN1 -5 13837537 http://www.aAlfa Aesar
    7732 m-phenylenedc1cc(cc(c1)N) 63 13836283 http://www.aAlfa Aesar
    7733 m-terphenyl c1ccc(cc1)c2c 87 6809 http://www.aAlfa Aesar
    7734 m-toluamide Cc1cccc(c1)C( 95 62466 http://www.aAlfa Aesar
    7735 m-toluic acid Cc1cccc(c1)C( 109 7140 http://www.aAlfa Aesar
    7736 m-toluic hydr Cc1cccc(c1)C 96 74952 http://www.aAlfa Aesar
    7737 m-toluidine Cc1cccc(c1)N -30 13860692 http://www.aAlfa Aesar
    7738 m-tolunitrile Cc1cccc(c1)C -27 11607 http://www.aAlfa Aesar
    7739 m-toluoyl chloCc1cccc(c1)C( -23 66968 http://www.aAlfa Aesar
    7740 m-toluoylaceto
    Cc1cccc(c1)C 73 126245 http://www.aAlfa Aesar
    7741 m-tolylacetic Cc1cccc(c1)C 64 11623 http://www.aAlfa Aesar
    7742 mucobromic aC(=O)/C(=C(C( 123 2298535 http://www.aAlfa Aesar
    7743 mucochloric aC(=O)/C(=C(C( 127 2052308 http://www.aAlfa Aesar
    7744 m-xylene Cc1cccc(c1)C -47 7641 http://www.aAlfa Aesar
    7745 m-xylylene di BrCc1cccc(c1) 75 62581 http://www.aAlfa Aesar
    7746 m-xylylene dicClCc1cccc(CCl 35 21168838 http://www.aAlfa Aesar
    7747 myo-inositol [C@@H]1([C@ 226 10239179 http://www.aAlfa Aesar
    7748 N-(1-naphthylCC(=C)C(=O)N( 115 3757168 http://www. Alfa Aesar
    7749 N-(1-naphthylc1ccc2c(c1)cc 188 643492 http://www.aAlfa Aesar
    7750 N-(2,3,5,6-tet Cc1cc(c(c(c1C 167 637873 http://www. Alfa Aesar
    7751 N-(2,4-dichlo c1cc(c(cc1Cl) 179 11971607 http://www.aAlfa Aesar
    7752 N-(2,4-difluo c1cc(c(cc1F)F 191 17960106 http://www.aAlfa Aesar
    7753 N-(2,5-dichlo c1cc(c(cc1Cl) 142 1267846 http://www.aAlfa Aesar
    7754 N-(2-bromoben
    c1ccc(c(c1)C 107 519965 http://www.aAlfa Aesar
    7755 N-(2-bromoeth
    c1ccc2c(c1)C 82 10848 http://www.aAlfa Aesar
    7756 N-(2-butynyl) CC#CCN1C(=O 221 6366743 http://www. Alfa Aesar
    7757 N-(2-carboxypc1ccc2c(c1)C 219 237158 http://www.aAlfa Aesar
    7758 N-(2-chloroet c1ccc(cc1)C(= 103 91663 http://www.aAlfa Aesar
    7759 N-(2-hydroxyeC(CNCCO)N -28 7821 http://www.aAlfa Aesar
    7760 N-(2-hydroxyec1ccc2c(c1)C 128 69908 http://www.aAlfa Aesar
    7761 N-(2-hydroxyeC1CC(=O)N(C 60 206268 http://www.aAlfa Aesar
    7762 N-(2-methoxyCOc1ccccc1NC 144 1267539 http://www.aAlfa Aesar
    7763 N-(2-pentynylCCC#CCN1C(= 99 6366745 http://www. Alfa Aesar
    7764 N-(3-acetyl-4 CCCC(=O)Nc1c 125 643457 http://www.aAlfa Aesar
    7765 N-(3-aminoproC1CCC(CC1)N -18 17674 http://www.aAlfa Aesar
    7766 N-(3-bromopro
    c1ccc2c(c1)C 74 20311 http://www.aAlfa Aesar
    7767 N-(3-chloro-4 Cc1ccc(cc1Cl 146 616537 http://www.aAlfa Aesar
    7768 N-(3-chlorophc1cc(cc(c1)Cl 198 1267542 http://www.aAlfa Aesar
    7769 N-(3-hydroxypc1ccc2c(c1)C 78 63347 http://www.aAlfa Aesar
    7770 N-(4-acetylphCc1ccc(n1c2cc 111 456043 http://www.aAlfa Aesar
    7771 N-(4-acetylphCC(=O)c1ccc( 156 63826 http://www.aAlfa Aesar
    7772 N-(4-aminoben
    c1cc(ccc1C(= 152 628110 http://www.aAlfa Aesar
    7773 N-(4-aminobenz
    CCOC(=O)CCC( 141 224760 http://www.aAlfa Aesar
    7774 N-(4-bromobuc1ccc2c(c1)C 71 5383607 http://www.aAlfa Aesar
    7775 N-(4-bromobut
    c1ccc2c(c1)C 79 84471 http://www.aAlfa Aesar
    7776 N-(4-bromophc1cc(ccc1N2C 129 109906 http://www.aAlfa Aesar
    7777 N-(4-carboxypc1ccc2c(c1)C( 293 215704 http://www.aAlfa Aesar
    7778 N-(4-chloro-2 c1ccc2c(c1)C 118 207405 http://www.aAlfa Aesar
    7779 N-(4-chlorophCN(C)C(=O)Nc1 173 8470 http://www.aAlfa Aesar
    7780 N-(4-chlorophc1ccc2c(c1)C( 197 73876 http://www.aAlfa Aesar
    7781 N-(4-ethylpheCCc1ccc(cc1) 66 455887 http://www.aAlfa Aesar
    7782 N-(4-fluorophc1cc(ccc1NC( 208 1267495 http://www.aAlfa Aesar
    7783 N-(4-hydroxypc1ccc2c(c1)C( 296 221039 http://www.aAlfa Aesar
    7784 N-(4-iodophenc1cc(ccc1NC( 194 1266705 http://www.aAlfa Aesar
    7785 N-(4'-methoxyCC(C(=O)O)NS( 179 21476889 http://www. Alfa Aesar
    7786 N-(4'-methoxyCOc1ccc(cc1) 190 21476895 http://www. Alfa Aesar
    7787 N-(4'-methoxy-
    COc1ccc(cc1) 186 21476888 http://www. Alfa Aesar
    7788 N-(4'-methoxyCOc1ccc(cc1)c 179 21476894 http://www. Alfa Aesar
    7789 N-(4'-methoxyCOc1ccc(cc1)c 174 21476892 http://www. Alfa Aesar
    7790 N-(4'-methoxyCC(C)C(C(=O)O 178 8219816 http://www. Alfa Aesar
    7791 N-(4-methoxyb
    COc1ccc(cc1) 63 10445965 http://www.aAlfa Aesar
    7792 N-(4-pentynylC#CCCCN1C(= 89 9944505 http://www. Alfa Aesar
    7793 N-(5-bromopen
    c1ccc2c(c1)C 60 120527 http://www.aAlfa Aesar
    7794 N-(5-chloro-2 Cc1ccc(cc1NC 120 4642780 http://www.aAlfa Aesar
    7795 N-(5-hexynyl) C#CCCCCN1C( 70 2592585 http://www. Alfa Aesar
    7796 N-(5-nitro-2- c1cc(ncc1[N+ 127 109156 http://www. Alfa Aesar
    7797 N-(6-bromohex
    c1ccc2c(c1)C 57 124480 http://www.aAlfa Aesar
    7798 N-(9-fluoreny c1ccc2c(c1)- 152 118264 http://www.aAlfa Aesar
    7799 N(alpha)-benzc1ccc(cc1)CO 124 91414 http://www.aAlfa Aesar
    7800 N(alpha)-boc-CC(C)(C)OC(= 119 75510 http://www.aAlfa Aesar
    7801 N(alpha)-fmocc1ccc2c(c1)c 184 848067 http://www.aAlfa Aesar
    7802 N(alpha)-fmocc1ccc2c(c1)c 184 848066 http://www.aAlfa Aesar
    7803 N-(benzyloxycc1ccc(cc1)CO 68 17853 http://www.aAlfa Aesar
    7804 N-(benzyloxycc1ccc(cc1)CO 80 75039 http://www.aAlfa Aesar
    7805 N-(bromomethc1ccc2c(c1)C 147 71569 http://www.aAlfa Aesar
    7806 N-(chloroacetyC(C(=O)O)NC( 102 203576 http://www.aAlfa Aesar
    7807 N-(chloromethc1ccc2c(c1)C( 133 78619 http://www.aAlfa Aesar
    7808 N-(cyclohexyl C1CCC(CC1)N 165 86582 http://www.aAlfa Aesar
    7809 N-(diphenylmeCCOC(=O)CN=C 53 282865 http://www.aAlfa Aesar
    7810 N-(diphenylmet
    CC(C)(C)OC(=O 114 599654 http://www. Alfa Aesar
    7811 N-(ethoxycarbCCOC(=O)N1C( 81 28929 http://www.aAlfa Aesar
    7812 N-(hydroxymeCC(=O)NCO 50 62574 http://www.aAlfa Aesar
    7813 N-(hydroxymec1ccc(cc1)C( 95 72693 http://www.aAlfa Aesar
    7814 N-(hydroxymeCCCCCCCCC(= 85 309632 http://www.aAlfa Aesar
    7815 N-(hydroxymet
    c1ccc2c(c1)C 144 8051 http://www.aAlfa Aesar
    7816 N-(N-butyl)phCCCCN1C(=O) 34 66447 http://www.aAlfa Aesar
    7817 N-(N-propyl)mCCCN1C(=O)C 25 80338 http://www.aAlfa Aesar
    7818 N-(phenylselec1ccc(cc1)[S 180 513232 http://www.aAlfa Aesar x metal - AL
    7819 N-(p-toluenesuCc1ccc(cc1)S 148 63819 http://www. Alfa Aesar
    7820 N-(trimethylsiCCN(CC)[Si](C) -10 63633 http://www.aAlfa Aesar
    7821 N,N'-(1,2-dih C=CC(=O)NC(C 142 92576 http://www.aAlfa Aesar
    7822 N,N,N',N'-tet CC(=O)N(CCN( 151 59725 http://www.aAlfa Aesar
    7823 N,N,N',N'-tet CN(C)CCN(C)C -55 7746 http://www.aAlfa Aesar
    7824 N,N,N',N'-tet CN(C)CN(C)C -55 5624 http://www.aAlfa Aesar
    7825 N,N,N',N'-tet CN(C)c1ccc(cc 50 21106585 http://www.aAlfa Aesar
    7826 N,N',N''-triph c1ccc(cc1)NC( 144 7258 http://www.aAlfa Aesar
    7827 N,N-bis(2-chl Cc1ccc(cc1)S( 46 86703 http://www.aAlfa Aesar
    7828 N,N'-bis(3-amC(CN)CN/C=C -2 11374430 http://www.aAlfa Aesar
    7829 N,N'-bis(sali c1ccc(c(c1)C 52 21159477 http://www.aAlfa Aesar
    7830 N,N'-bis(salic c1ccc(c(c1)C 130 20481328 http://www.aAlfa Aesar
    7831 N,N'-di(o-toly Cc1ccccc1NCC 72 60125 http://www.aAlfa Aesar
    7832 N,N'-diacetyl CC(=O)NCCNC 174 63285 http://www.aAlfa Aesar
    7833 N,N'-diacetyl CC(=O)NNC(= 140 65716 http://www.aAlfa Aesar
    7834 N,N'-dibenzoyc1ccc(cc1)C( 239 12540 http://www.aAlfa Aesar
    7835 N,N-dibenzylac1ccc(cc1)CN( 70 60047 http://www. Alfa Aesar
    7836 N,N'-dibenzyl c1ccc(cc1)CN 24 8463 http://www.aAlfa Aesar
    7837 N,N-dibenzylhc1ccc(cc1)CN( 123 62508 http://www.aAlfa Aesar
    7838 N,N'-dicycloh C1CCC(CC1)N 35 10408 http://www.aAlfa Aesar
    7839 N,N'-dicycloh C1CCC(CC1)N 232 4126 http://www.aAlfa Aesar
    7840 N,N-diethyl-1 CCN(CC)CCCN -60 54972 http://www.aAlfa Aesar
    7841 N,N-diethyl-4-CCN(CC)c1ccc 82 60463 http://www.aAlfa Aesar
    7842 N,N-diethylaniCCN(CC)c1ccc -38 6794 http://www.aAlfa Aesar
    7843 N,N-diethylb CCN(CC)C(=O) 30 14786 http://www.aAlfa Aesar
    7844 N,N-diethyld CCCCCCCCCCC 4 17736 http://www.aAlfa Aesar
    7845 N,N-diethylhyCCN(CC)O -25 18340 http://www.aAlfa Aesar
    7846 N,N'-diethylo CCNC(=O)C(= 180 62423 http://www.aAlfa Aesar
    7847 N,N'-diethylthCCNC(=S)NCC 77 2016737 http://www.aAlfa Aesar
    7848 N,N'-diethylu CCNC(=O)NCC 110 11694 http://www.aAlfa Aesar
    7849 N,N-diisopropCC(C)N(C(C)C) 70 79867 http://www.aAlfa Aesar
    7850 N,N-diisopro CC(C)N(C=O)C 10 68417 http://www.aAlfa Aesar
    7851 N,N-dimethyl CN(C)CCCN -70 7703 http://www.aAlfa Aesar
    7852 N,N-dimethyl-3
    CN(C)c1cccc(c 59 21168823 http://www.aAlfa Aesar
    7853 N,N-dimethyl-4
    CN(C)c1ccc(c 128 20572102 http://www. Alfa Aesar
    7854 N,N-dimethyl-4
    CN(C)c1ccc(cc 165 7210 http://www.aAlfa Aesar
    7855 N,N-dimethyl-CN(C)c1ccc(c 86 8419 http://www.aAlfa Aesar
    7856 N,N-dimethyl CC(=O)N(C)C -20 29107 http://www.aAlfa Aesar
    7857 N,N-dimethylaCN(C)c1ccccc1 2 924 http://www.aAlfa Aesar
    7858 N,N-dimethyl CN(C)C(=O)c1 44 11422 http://www.aAlfa Aesar
    7859 N,N-dimethylcCN(C)C1CCCC -60 7137 http://www.aAlfa Aesar
    7860 N,N-dimethyl CCCCCCCCCCC -20 7876 http://www.aAlfa Aesar
    7861 N,N-dimethyl CCN(C)C -140 11230 http://www.aAlfa Aesar
    7862 N,N-dimethyl CN(C)C=O -61 5993 http://www.aAlfa Aesar
    7863 N,N-dimethylfCN(C)C(OC)OC -85 70742 http://www.aAlfa Aesar
    7864 N,N-dimethylgCN(C)CC(=O)O 181 653 http://www.aAlfa Aesar
    7865 N,N-dimethyl CN(C)S(=O)(= 48 63377 http://www.aAlfa Aesar
    7866 N,N-dimethyl-Cc1cccc(c1)N( -15 8175 http://www.aAlfa Aesar
    7867 N,N-dimethyl-CCCCCCCCN(C -57 15396 http://www.aAlfa Aesar
    7868 N,N'-dimethy CNC(=O)C(=O 216 62418 http://www.aAlfa Aesar
    7869 N,N-dimethyl CN(C)c1ccc(cc 36 13884246 http://www.aAlfa Aesar
    7870 N,N-dimethyl-Cc1ccc(cc1)N( -25 7191 http://www.aAlfa Aesar
    7871 N,N-dimethylsCN(C)C(=O)CC 85 68235 http://www.aAlfa Aesar
    7872 N,N'-dimethylCNC(=O)NC 102 7021 http://www.aAlfa Aesar
    7873 N,N-dimethyl CN(C)C(=O)N 180 11244 http://www.aAlfa Aesar
    7874 N,N-di-n-butyCCCCN(CCCC) -70 1564 http://www.aAlfa Aesar
    7875 N,N'-di-n-butyCCCCNC(=S)N 66 2005824 http://www.aAlfa Aesar
    7876 N,N'-di-n-butyCCCCNC(=O)N 72 67104 http://www.aAlfa Aesar
    7877 N,N'-di-o-toly Cc1ccccc1NC( 158 599522 http://www.aAlfa Aesar
    7878 N,N'-diphenylc1ccc(cc1)Nc2 248 61577 http://www.aAlfa Aesar
    7879 N,N'-diphenylc1ccc(cc1)N/C 138 85615 http://www.aAlfa Aesar
    7880 N,N'-diphenylc1ccc(cc1)Nc2 147 6080 http://www.aAlfa Aesar
    7881 N,N'-diphenylc1ccc(cc1)NC( 152 610932 http://www.aAlfa Aesar
    7882 N,N'-diphenylc1ccc(cc1)NC 242 7314 http://www.aAlfa Aesar
    7883 N,N'-ethyleneC=CC(=O)NCC 142 147790 http://www.aAlfa Aesar
    7884 N-[tris(hydro C=CC(=O)NC(C 136 75609 http://www.aAlfa Aesar
    7885 N-acetyl-beta CC(=O)NCCC( 77 68881 http://www. Alfa Aesar
    7886 N-acetyl-dl-4-CC(=O)NC(Cc1 152 2015097 http://www.aAlfa Aesar
    7887 N-acetyl-dl-al C[C@@H](C(= 137 79449 http://www.aAlfa Aesar
    7888 N-acetyl-dl-mCC(=O)N[C@@ 115 395338 http://www.aAlfa Aesar
    7889 N-acetyl-dl-vaCC(C)[C@@H]( 148 60154 http://www.aAlfa Aesar
    7890 N-acetylethyl CC(=O)NCCN 47 59472 http://www.aAlfa Aesar
    7891 N-acetylglyci CC(=O)NC(=O 138 68309 http://www.aAlfa Aesar
    7892 N-acetylindol CC(=O)n1cc(c 162 81163 http://www.aAlfa Aesar
    7893 N-acetyl-l-cys CC(=O)N[C@@ 110 11540 http://www.aAlfa Aesar
    7894 N-acetyl-l-glu CC(=O)N[C@@ 197 64077 http://www.aAlfa Aesar
    7895 N-acetyl-l-leu CC(C)C[C@@H 178 64075 http://www.aAlfa Aesar
    7896 N-acetyl-l-pheCC(=O)N[C@@H 168 67404 http://www.aAlfa Aesar
    7897 N-acetyl-l-proCC(=O)N1CCC 118 59528 http://www.aAlfa Aesar
    7898 N-acetyl-l-tyr CC(=O)N[C@@H 153 61606 http://www.aAlfa Aesar
    7899 N-acetylmorphCC(=O)N1CCO 10 14787 http://www.aAlfa Aesar
    7900 N-acetyl-N'-p CC(=O)NNc1cc 130 7951 http://www.aAlfa Aesar
    7901 N-acetylphthaCC(=O)N1C(=O 137 212667 http://www.aAlfa Aesar
    7902 N-acetyl-transCC(=O)N1C[C 132 59203 http://www.aAlfa Aesar
    7903 nalidixic acid CCn1cc(c(=O)c 229 4268 http://www.aAlfa Aesar
    7904 N-allylthioureC=CCNC(=S)N 74 1266393 http://www.aAlfa Aesar
    7905 N-amidinothi C(=N)(N)NC(= 164 2006692 http://www.aAlfa Aesar
    7906 naphthalene c1ccc2ccccc2c 81 906 http://www.aAlfa Aesar
    7907 naphthalene-1,
    c1ccc2c(ccc(c 210 68887 http://www.aAlfa Aesar
    7908 naphthalene-1,
    c1ccc2c(c1)c( 323 62286 http://www.aAlfa Aesar
    7909 naphthalene-1c1ccc2c(c1)cc 36 6585 http://www.aAlfa Aesar
    7910 naphthalene- c1ccc2c(c1)cc 208 67788 http://www.aAlfa Aesar
    7911 naphthalene-1c1ccc2c(c1)cc 68 59930 http://www.aAlfa Aesar
    7912 naphthalene-2c1ccc2cc(ccc2 65 11450 http://www.aAlfa Aesar
    7913 naphthalene- c1ccc2cc(ccc2 195 67789 http://www.aAlfa Aesar
    7914 naphthalene-2c1ccc2cc(ccc2 219 203125 http://www.aAlfa Aesar
    7915 naphthalene-2c1ccc2cc(ccc2 76 6858 http://www.aAlfa Aesar
    7916 naphthalene- c1ccc2cc(ccc2 151 2079058 http://www. Alfa Aesar
    7917 N-benzoyl-dl- C[C@@H](C(=O 165 618965 http://www.aAlfa Aesar
    7918 N-benzoyl-N- c1ccc(cc1)C(= 119 60858 http://www.aAlfa Aesar
    7919 N-benzyl-4-meCOc1ccc(cc1) 49 453065 http://www.aAlfa Aesar
    7920 N-benzylacryl C=CC(=O)NCc1 61 122953 http://www.aAlfa Aesar
    7921 N-benzylbenz c1ccc(cc1)CNC 106 66512 http://www.aAlfa Aesar
    7922 N-benzyldimeCN(C)Cc1cccc -75 7398 http://www.aAlfa Aesar
    7923 N-benzyletha c1ccc(cc1)CN -30 4195 http://www.aAlfa Aesar
    7924 N-benzylformc1ccc(cc1)CN 61 72839 http://www.aAlfa Aesar
    7925 N-benzylideneFc1ccc(cc1)CC 44 4171978 http://www.aAlfa Aesar
    7926 N-benzylidenec1ccc(cc1)/C= 53 10400 http://www.aAlfa Aesar
    7927 N-benzylmaleac1ccc(cc1)CN 137 1266562 http://www.aAlfa Aesar
    7928 N-benzylmalec1ccc(cc1)CN 69 66812 http://www.aAlfa Aesar
    7929 N-benzylmethCNCc1ccccc1 -55 7386 http://www.aAlfa Aesar
    7930 N-benzyloxycaC[C@H](C(=O) 85 63996 http://www.aAlfa Aesar
    7931 N-benzyloxycaC[C@H](CO)NC 83 5324160 http://www.aAlfa Aesar
    7932 N-benzyloxycaCCCC[C@H](C( 57 5369511 http://www.aAlfa Aesar
    7933 N-benzyloxycac1ccc(cc1)C[ 86 588434 http://www.aAlfa Aesar
    7934 N-benzyloxycac1ccc(cc1)C[ 94 643305 http://www. Alfa Aesar
    7935 N-benzyloxycac1ccc(cc1)C 77 99805 http://www.aAlfa Aesar
    7936 N-benzyloxycac1ccc(cc1)CO 118 428541 http://www.aAlfa Aesar
    7937 N-benzyloxycaCC([C@H](C(= 103 21242803 http://www.aAlfa Aesar
    7938 N-benzyloxycaCC(C)[C@H](C 59 621440 http://www.aAlfa Aesar
    7939 N-benzyloxycac1ccc(cc1)CO 121 13710 http://www.aAlfa Aesar
    7940 N-benzyloxycaC[C@@H](C(= 85 643244 http://www.aAlfa Aesar
    7941 N-benzyloxycar
    c1ccc(cc1)CO 118 2006119 http://www.aAlfa Aesar
    7942 N-benzyloxycar
    c1ccc(cc1)CO 106 43310 http://www.aAlfa Aesar
    7943 N-benzyloxycac1ccc(cc1)CO 119 64029 http://www.aAlfa Aesar
    7944 N-benzyloxycaCOC(=O)[C@H] 67 2015207 http://www. Alfa Aesar
    7945 N-benzyloxycaCSCC[C@@H]( 69 1267337 http://www.aAlfa Aesar
    7946 N-benzyloxycaCCCC[C@@H]( 57 5361482 http://www.aAlfa Aesar
    7947 N-benzyloxycac1ccc(cc1)C[ 86 64041 http://www.aAlfa Aesar
    7948 N-benzyloxycac1ccc(cc1)C[ 94 745884 http://www.aAlfa Aesar
    7949 N-benzyloxycac1ccc(cc1)CO 76 92134 http://www.aAlfa Aesar
    7950 N-benzyloxycac1ccc(cc1)CO 119 90648 http://www.aAlfa Aesar
    7951 N-benzyloxycar
    c1ccc(cc1)CO 83 5361084 http://www.aAlfa Aesar
    7952 N-benzyloxycaC[C@H]([C@@ 98 79584 http://www.aAlfa Aesar
    7953 N-benzyloxycaCC([C@@H](C( 80 23350013 http://www.aAlfa Aesar
    7954 N-benzyloxycac1ccc(cc1)CO 96 621444 http://www.aAlfa Aesar
    7955 N-benzyloxycaCC(C)[C@@H]( 60 634839 http://www.aAlfa Aesar
    7956 N-benzyl-tert CC(C)(C)NCc1c -28 69359 http://www.aAlfa Aesar
    7957 N-boc-2-(2-naC[C@](c1ccc2 98 25027437 http://www. Alfa Aesar
    7958 N-boc-2,4-dic CC(C)(C)OC(= 135 2016427 http://www. Alfa Aesar
    7959 N-boc-3-(2-thiCC(C)(C)OC(= 74 2016234 http://www. Alfa Aesar
    7960 N-boc-3-fluor CC(C)(C)OC(= 77 5383778 http://www. Alfa Aesar
    7961 N-boc-3-fluor CC(C)(C)OC(= 78 2016242 http://www. Alfa Aesar
    7962 N-boc-3-iodo-LCC(C)(C)OC(= 81 2037564 http://www. Alfa Aesar
    7963 N-boc-4,4-diflCC(C)(C)OC(= 122 19185368 http://www. Alfa Aesar
    7964 N-boc-4-bromo
    CC(C)(C)OC(= 119 2016228 http://www. Alfa Aesar
    7965 N-boc-4-chlorCC(C)(C)OC(= 110 5381765 http://www. Alfa Aesar
    7966 N-boc-4-methy
    CC(C)(C)OC(= 112 10316621 http://www. Alfa Aesar
    7967 N-boc-4-methy
    Cc1ccc(cc1)C 86 2042202 http://www. Alfa Aesar
    7968 N-boc-4-oxo-LCC(C)(C)OC(= 38 9163680 http://www. Alfa Aesar
    7969 N-boc-4-oxo-L-CC(C)(C)OC(= 66 9521608 http://www. Alfa Aesar
    7970 N-boc-beta-alCC(C)(C)OC(= 75 69265 http://www.aAlfa Aesar
    7971 N-boc-D-alaniC[C@H](C(=O) 83 553207 http://www.aAlfa Aesar
    7972 N-boc-D-alaniC[C@H](CO)NC 60 17206508 http://www. Alfa Aesar
    7973 N-boc-D-methCC(C)(C)OC(= 49 99692 http://www.aAlfa Aesar
    7974 N-boc-D-pheny
    CC(C)(C)OC(= 87 553211 http://www.aAlfa Aesar
    7975 N-boc-D-pheny
    CC(C)(C)OC(= 95 5382335 http://www. Alfa Aesar
    7976 N-boc-D-proli CC(C)(C)OC( 134 599517 http://www.aAlfa Aesar
    7977 N-boc-D-proli CC(C)(C)OC( 61 599754 http://www.aAlfa Aesar
    7978 N-boc-D-serinCC(C)(C)OC(= 90 553204 http://www.aAlfa Aesar
    7979 N-boc-D-valinCC(C)[C@H](C 78 553206 http://www.aAlfa Aesar
    7980 N-boc-ethyla CCNC(=O)OC(C 40 9373555 http://www. Alfa Aesar
    7981 N-boc-glycineCC(C)(C)OC(= 89 70660 http://www.aAlfa Aesar
    7982 N-boc-hydrox CC(C)(C)OC(= 57 88031 http://www.aAlfa Aesar
    7983 N-boc-L-alani C[C@@H](C(=O 82 76745 http://www.aAlfa Aesar
    7984 N-boc-L-alani C[C@@H](CO) 59 5385967 http://www.aAlfa Aesar
    7985 N-boc-L-aspartCC(C)(C)OC(= 117 90093 http://www.aAlfa Aesar
    7986 N-boc-L-aspartCC(C)(C)OC(= 96 5380880 http://www.aAlfa Aesar
    7987 N-boc-L-aspartCC(C)(C)OC(= 111 1284382 http://www.aAlfa Aesar
    7988 N-boc-L-glutam
    CC(C)(C)OC(= 111 5361511 http://www.aAlfa Aesar
    7989 N-boc-L-isole CCC(C)[C@@H] 69 8596843 http://www.aAlfa Aesar
    7990 N-boc-L-methCC(C)(C)OC(= 50 81110 http://www.aAlfa Aesar
    7991 N-boc-L-norvaCCC[C@@H](C( 45 2015520 http://www.aAlfa Aesar
    7992 N-boc-L-phenyCC(C)(C)OC(= 87 70249 http://www.aAlfa Aesar
    7993 N-boc-L-phenyCC(C)(C)OC(= 97 2015451 http://www.aAlfa Aesar
    7994 N-boc-L-proli CC(C)(C)OC(= 134 76746 http://www.aAlfa Aesar
    7995 N-boc-L-prolinCC(C)(C)OC( 61 558593 http://www.aAlfa Aesar
    7996 N-boc-L-threoCC([C@@H](C( 79 2011821 http://www.aAlfa Aesar
    7997 N-boc-L-tyros CC(C)(C)OC(= 107 5382098 http://www.aAlfa Aesar
    7998 N-boc-L-valin CC(C)[C@@H]( 79 75516 http://www.aAlfa Aesar
    7999 N-boc-N-ethylCCN(CC(=O)O) 88 11531866 http://www. Alfa Aesar
    8000 N-boc-N-methy
    C[C@@H](C(=O 90 5373170 http://www. Alfa Aesar
    8001 N-boc-o-benzyCC(C)(C)OC(= 62 2015469 http://www.aAlfa Aesar
    8002 N-boc-o-benzyC[C@H]([C@@H 116 1266377 http://www.aAlfa Aesar
    8003 N-boc-o-benzyCC(C)(C)OC(= 109 89201 http://www.aAlfa Aesar
    8004 N-boc-propar CC(C)(C)OC(= 42 9248797 http://www. Alfa Aesar
    8005 N-boc-sarcosi CC(C)(C)OC(= 91 75515 http://www.aAlfa Aesar
    8006 N-bromoacet CC(=O)NBr 104 4200 http://www.aAlfa Aesar
    8007 N-bromo-epsiC1CCC(=O)N(C 64 68066 http://www.aAlfa Aesar
    8008 N-bromophthac1ccc2c(c1)C 206 68067 http://www.aAlfa Aesar
    8009 N-butyl 4-hydCCCCOC(=O)c1 69 6916 http://www.aAlfa Aesar
    8010 N-butyl aceta CCCCOC(=O)C -78 29012 http://www.aAlfa Aesar
    8011 N-butyl acrylaCCCCOC(=O)C -64 8514 http://www.aAlfa Aesar
    8012 N-butyl benzoCCCCOC(=O)c1 -22 8374 http://www.aAlfa Aesar
    8013 N-butyl butyr CCCCOC(=O)C -92 7694 http://www.aAlfa Aesar
    8014 N-butyl dodecCCCCCCCCCCC -10 54975 http://www.aAlfa Aesar
    8015 N-butyl ethyl CCCCOCC -124 11849 http://www.aAlfa Aesar
    8016 N-butyl formaCCCCOC=O -92 11125 http://www.aAlfa Aesar
    8017 N-butyl methaCCCCOC(=O)C( -75 7076 http://www.aAlfa Aesar
    8018 N-butyl phenyCCCCOc1ccccc -19 13673 http://www.aAlfa Aesar
    8019 N-butyl vinyl CCCCOC=C -113 7817 http://www.aAlfa Aesar
    8020 N-butylbenze CCCCc1ccccc1 -88 7419 http://www.aAlfa Aesar
    8021 N-butylcyclohCCCCC1CCCCC -78 14753 http://www.aAlfa Aesar
    8022 N-butylurea CCCCNC(=O)N 95 11107 http://www.aAlfa Aesar
    8023 N-carbamoylmC(=CC(=O)O)C 158 4512096 http://www.aAlfa Aesar
    8024 N-carbamoylmC1=CC(=O)N(C 159 69319 http://www.aAlfa Aesar
    8025 N-chloroacetylC1CN(CCC1C(= 110 1512834 http://www.aAlfa Aesar
    8026 N-chlorosucci C1CC(=O)N(C1 148 29129 http://www.aAlfa Aesar
    8027 N-cyclohexylan
    c1ccc(cc1)NC 15 67145 http://www.aAlfa Aesar
    8028 N-cyclohexyleC1CCC(CC1)N 36 16846 http://www.aAlfa Aesar
    8029 N-cyclohexylmC1CCC(CC1)N 90 66811 http://www.aAlfa Aesar
    8030 N-cyclohexyl- Cc1ccc(cc1)S 88 6381 http://www.aAlfa Aesar
    8031 N-decane CCCCCCCCCC -30 14840 http://www.aAlfa Aesar
    8032 N-decyltrimetCCCCCCCCCC[S -37 2038782 http://www.aAlfa Aesar
    8033 N-docosane CCCCCCCCCCC 45 11899 http://www.aAlfa Aesar
    8034 N-dodecane CCCCCCCCCCC -10 7890 http://www.aAlfa Aesar
    8035 N-dodecyl 4- CCCCCCCCCCCC 55 16611 http://www.aAlfa Aesar
    8036 N-dodecyl gallCCCCCCCCCCCC 97 13777 http://www.aAlfa Aesar
    8037 N-dodecylbenCCCCCCCCCCC -7 28977 http://www.aAlfa Aesar
    8038 N-dodecyltrimCCCCCCCCCCCC -40 68949 http://www.aAlfa Aesar
    8039 N-eicosane CCCCCCCCCCC 37 7929 http://www.aAlfa Aesar
    8040 neopentyl alc CC(C)(C)CO 54 6164 http://www.aAlfa Aesar
    8041 neopentyl chl CC(C)(C)CCl -20 12416 http://www.aAlfa Aesar
    8042 N-ethylaceta CCNC(=O)C -32 11752 http://www.aAlfa Aesar
    8043 N-ethylanilineCCNc1ccccc1 -64 7387 http://www.aAlfa Aesar
    8044 N-ethyldiisop CCN(C(C)C)C(C -46 73565 http://www.aAlfa Aesar
    8045 N-ethylmaleam
    CCNC(=O)/C= 125 4528631 http://www.aAlfa Aesar
    8046 N-ethylmalei CCN1C(=O)C= 45 4209 http://www.aAlfa Aesar
    8047 N-ethylphthalCCN1C(=O)c2c 76 19862 http://www.aAlfa Aesar
    8048 N-fmoc-L-isol CCC(C)[C@@H] 147 16737161 http://www.aAlfa Aesar
    8049 N-fmoc-L-leucCC(C)C[C@@H] 154 1266097 http://www.aAlfa Aesar
    8050 N-fmoc-L-metCSCC[C@@H](C 134 2006759 http://www.aAlfa Aesar
    8051 N-fmoc-L-norlCCCC[C@@H](C 141 5373216 http://www.aAlfa Aesar
    8052 N-fmoc-L-phenc1ccc(cc1)C[ 183 848054 http://www.aAlfa Aesar
    8053 N-fmoc-L-prolc1ccc2c(c1)- 115 599620 http://www.aAlfa Aesar
    8054 N-fmoc-L-vali CC(C)[C@@H]( 144 599697 http://www.aAlfa Aesar
    8055 N-fmoc-s-trityc1ccc(cc1)C( 171 113695 http://www. Alfa Aesar
    8056 N-formylglyci C(C(=O)O)NC 149 68130 http://www. Alfa Aesar
    8057 N-formylurea C(=O)NC(=O)N 169 64084 http://www.aAlfa Aesar
    8058 N-heneicosanCCCCCCCCCCC 41 11897 http://www.aAlfa Aesar
    8059 N-heptacosanCCCCCCCCCCC 59 11146 http://www.aAlfa Aesar
    8060 N-heptadecanCCCCCCCCCCC 22 11892 http://www.aAlfa Aesar
    8061 N-heptane CCCCCCC -91 8560 http://www.aAlfa Aesar
    8062 N-heptyl 4-hy CCCCCCCOC(=O 48 13515 http://www.aAlfa Aesar
    8063 N-heptylbenz CCCCCCCc1ccc -48 13492 http://www.aAlfa Aesar
    8064 N-hexacosaneCCCCCCCCCCC 57 11901 http://www.aAlfa Aesar
    8065 N-hexadecaneCCCCCCCCCCC 18 10540 http://www.aAlfa Aesar
    8066 N-hexane CCCCCC -95 7767 http://www.aAlfa Aesar
    8067 N-hexatriaconCCCCCCCCCCC 76 11906 http://www.aAlfa Aesar
    8068 N-hexyl aceta CCCCCCOC(=O -80 8568 http://www.aAlfa Aesar
    8069 N-hexyl acrylaCCCCCCOC(=O -45 16338 http://www.aAlfa Aesar
    8070 N-hexyl formaCCCCCCOC=O -63 55123 http://www.aAlfa Aesar
    8071 N-hexyl methaCCCCCCOC(=O) -57 8538 http://www.aAlfa Aesar
    8072 N-hexylphosphCCCCCCP(=O) 109 276412 http://www.aAlfa Aesar
    8073 N-hexylsulfonyCCCCCCS(=O) 42 2095858 http://www.aAlfa Aesar
    8074 N-hydroxy-N- CN(C(=O)Cc1c 96 114473 http://www.aAlfa Aesar
    8075 N-hydroxysuccC1CC(=O)N(C 97 72416 http://www.aAlfa Aesar
    8076 nicofuranose c1cc(cnc1)C( 135 23791 http://www.aAlfa Aesar
    8077 nicotinamide c1cc(cnc1)C(= 130 911 http://www.aAlfa Aesar
    8078 nicotinanilide c1ccc(cc1)NC( 120 67050 http://www.aAlfa Aesar
    8079 nicotinic acid c1cc(cnc1)C(= 238 913 http://www.aAlfa Aesar
    8080 nicotinic hydr c1cc(cnc1)C( 162 10641 http://www.aAlfa Aesar
    8081 N-isopropyl-2 CC(C)NC(=O)C 59 68655 http://www.aAlfa Aesar
    8082 N-isopropylaniCC(C)Nc1cccc -32 12490 http://www.aAlfa Aesar
    8083 N-isopropyl-n CC(C)Nc1ccc(c 77 7292 http://www.aAlfa Aesar
    8084 nitrobenzene c1ccc(cc1)[N+ 6 7138 http://www.aAlfa Aesar
    8085 nitroethane CC[N+](=O)[O- -89 6338 http://www.aAlfa Aesar
    8086 nitromethaneC[N+](=O)[O-] -29 6135 http://www.aAlfa Aesar
    8087 N-methyl-1,3 CNCCCN -72 72710 http://www.aAlfa Aesar
    8088 N-methyl-2,2,CNC(=O)C(F)(F 51 63141 http://www.aAlfa Aesar
    8089 N-methyl-2-niCNc1ccccc1[N+ 35 62372 http://www.aAlfa Aesar
    8090 N-methyl-4-niCNS(=O)(=O)Cc 152 613100 http://www. Alfa Aesar
    8091 N-methyl-4-niCNc1ccc(cc1)[ 153 7203 http://www.aAlfa Aesar
    8092 N-methylacet CC(=O)NC 27 6334 http://www.aAlfa Aesar
    8093 N-methylanili CNc1ccccc1 -57 7234 http://www.aAlfa Aesar
    8094 N-methylbenzCNC(=O)c1ccc 79 11460 http://www.aAlfa Aesar
    8095 N-methylcycl CNC1CCCCC1 -8 7233 http://www.aAlfa Aesar
    8096 N-methyl-D-g CNC[C@@H]([ 130 8249 http://www.aAlfa Aesar
    8097 N-methyldiet CN(CCO)CCO -21 7479 http://www.aAlfa Aesar
    8098 N-methyldodeCCCCCCCCCCC 68 124703 http://www.aAlfa Aesar
    8099 N-methylepheC[C@@H]([C@ 87 58315 http://www.aAlfa Aesar
    8100 N-methylformCNC=O -4 28994 http://www.aAlfa Aesar
    8101 N-methylforma
    CN(C=O)c1ccc 11 60103 http://www.aAlfa Aesar
    8102 N-methylmaleCNC(=O)/C=C 156 4511007 http://www.aAlfa Aesar
    8103 N-methylmaleiO=C1C=C/C(= 218 85864 http://www.aAlfa Aesar
    8104 N-methylmaleCN1C(=O)C=C 95 63446 http://www.aAlfa Aesar
    8105 N-methyl-N-[2CN(c1ccc(cc1[ 66 2055792 http://www.aAlfa Aesar
    8106 N-methylphthCN1C(=O)c2cc 134 10603 http://www.aAlfa Aesar
    8107 N-methylsuccCN1C(=O)CCC 66 63882 http://www.aAlfa Aesar
    8108 N-methylvale CCCCC(=O)NC -26 21181 http://www.aAlfa Aesar
    8109 N-N-butyldietCCCCN(CCO)C -70 7338 http://www.aAlfa Aesar
    8110 N-nonadecan CCCCCCCCCCC 33 11895 http://www.aAlfa Aesar
    8111 N-nonane CCCCCCCCC -53 7849 http://www.aAlfa Aesar
    8112 N-octacosaneCCCCCCCCCCC 62 11902 http://www.aAlfa Aesar
    8113 N-octadecaneCCCCCCCCCCC 28 11145 http://www.aAlfa Aesar
    8114 N-octadecyltriCCCCCCCCCCCCC 20 7865 http://www.aAlfa Aesar
    8115 N-octane CCCCCCCC -57 349 http://www.aAlfa Aesar
    8116 N-octyl 4-hyd CCCCCCCCOC(= 52 13976 http://www.aAlfa Aesar
    8117 N-octyl gallat CCCCCCCCOC(= 99 55194 http://www.aAlfa Aesar
    8118 N-octylbenze CCCCCCCCc1cc -36 15747 http://www.aAlfa Aesar
    8119 nonanoic acidCCCCCCCCC(= 10 7866 http://www.aAlfa Aesar
    8120 nonanoyl chloCCCCCCCCC(=O -61 63017 http://www.aAlfa Aesar
    8121 norbornane-2-C1CC2CC1CC2 40 71444 http://www.aAlfa Aesar
    8122 norbornene C1CC2CC1C=C 46 9925 http://www.aAlfa Aesar
    8123 norcamphor C1CC2CC1CC2 95 9919 http://www.aAlfa Aesar
    8124 nordihydroguai
    C[C@H](Cc1cc 186 64490 http://www.aAlfa Aesar
    8125 N-pentacosanCCCCCCCCCCC 53 11900 http://www.aAlfa Aesar
    8126 N-pentadecanCCCCCCCCCCC 10 11885 http://www.aAlfa Aesar
    8127 N-pentyl 4-a CCCCCOC(=O)c 52 23947 http://www.aAlfa Aesar
    8128 N-pentyl 4-hy CCCCCOC(=O)c 38 21543 http://www.aAlfa Aesar
    8129 N-pentyl acet CCCCCOC(=O) -100 11843 http://www.aAlfa Aesar
    8130 N-pentylbenz CCCCCc1ccccc -75 10404 http://www.aAlfa Aesar
    8131 N-pentylcycloCCCCCC1CCCC -58 19110 http://www.aAlfa Aesar
    8132 N-phenylanthra
    c1ccc(cc1)Nc 187 4233 http://www.aAlfa Aesar
    8133 N-phenylbenzc1ccc(cc1)C(= 119 173218 http://www.aAlfa Aesar
    8134 N-phenyldiet c1ccc(cc1)N( 57 8109 http://www.aAlfa Aesar
    8135 N-phenylethac1ccc(cc1)NC -30 28975 http://www.aAlfa Aesar
    8136 N-phenylglyci c1ccc(cc1)NC 118 59416 http://www.aAlfa Aesar
    8137 N-phenylglycinCCOC(=O)CNc1 57 21159611 http://www.aAlfa Aesar
    8138 N-phenylmalec1ccc(cc1)NC 177 1267410 http://www.aAlfa Aesar
    8139 N-phenylmalec1ccc(cc1)N2 89 13073 http://www.aAlfa Aesar
    8140 N-phenyl-o-p c1ccc(cc1)Nc2 79 61594 http://www.aAlfa Aesar
    8141 N-phenyl-p-p c1ccc(cc1)Nc2 74 7283 http://www.aAlfa Aesar
    8142 N-phthaloylgl c1ccc2c(c1)C 196 19600 http://www.aAlfa Aesar
    8143 N-propargyloxC#CCON1C(=O 151 70727 http://www.aAlfa Aesar
    8144 N-propargylphC#CCN1C(=O)c 150 73669 http://www. Alfa Aesar
    8145 N-propyl 3,4, CCCOC(=O)c1c 148 4778 http://www.aAlfa Aesar
    8146 N-propyl 4-a CCCOC(=O)c1c 74 6906 http://www.aAlfa Aesar
    8147 N-propyl 4-hyCCCOC(=O)c1c 97 6907 http://www.aAlfa Aesar
    8148 N-propyl acet CCCOC(=O)C -92 7706 http://www.aAlfa Aesar
    8149 N-propyl formCCCOC=O -93 7782 http://www.aAlfa Aesar
    8150 N-propyl hexaCCCCCC(=O)O -69 11790 http://www.aAlfa Aesar
    8151 N-propyl propCCCOC(=O)CC -76 7515 http://www.aAlfa Aesar
    8152 N-propylbenz CCCc1ccccc1 -100 7385 http://www.aAlfa Aesar
    8153 N-propylurea CCCNC(=O)N 102 11800 http://www.aAlfa Aesar
    8154 N-tert-butyl- CC(C)(C)NSc1n 108 6960 http://www.aAlfa Aesar
    8155 N-tert-butyla CC(=O)NC(C)( 97 12445 http://www.aAlfa Aesar
    8156 N-tert-butyla CC(C)(C)NC(= 129 7589 http://www.aAlfa Aesar
    8157 N-tert-butyl- CC(C)(C)/[N+] 73 554348 http://www.aAlfa Aesar
    8158 N-tert-butylb CC(C)(C)NC(=O 134 122237 http://www.aAlfa Aesar
    8159 N-tert-butylf CC(C)(C)NC=O 16 16146 http://www.aAlfa Aesar
    8160 N-tetracontanCCCCCCCCCCC 81 18983 http://www.aAlfa Aesar
    8161 N-tetracosaneCCCCCCCCCCC 51 12072 http://www.aAlfa Aesar
    8162 N-tetradecan CCCCCCCCCCC 106 62698 http://www.aAlfa Aesar
    8163 N-tetradecan CCCCCCCCCCC 6 11883 http://www.aAlfa Aesar
    8164 N-tetradecylbCCCCCCCCCCC 9 14358 http://www.aAlfa Aesar
    8165 N-triacontaneCCCCCCCCCCC 67 12018 http://www.aAlfa Aesar
    8166 N-tricosane CCCCCCCCCCC 49 12017 http://www.aAlfa Aesar
    8167 N-tridecane CCCCCCCCCCC -5 11882 http://www.aAlfa Aesar
    8168 N-tridecylbenCCCCCCCCCCC 10 28978 http://www.aAlfa Aesar
    8169 N-trimethylsi CC(=O)N[Si](C 41 24208 http://www.aAlfa Aesar
    8170 N-tritylglycineCCOC(=O)CNC(c 114 230779 http://www.aAlfa Aesar
    8171 N-undecane CCCCCCCCCCC -26 13619 http://www.aAlfa Aesar
    8172 N-vinylphthal C=CN1C(=O)c2 86 69481 http://www.aAlfa Aesar
    8173 o-(tert-butyldCC(C)(C)[Si](C 64 3879081 http://www.aAlfa Aesar
    8174 o-acetylsalicylCC(=O)Oc1ccc 138 2157 http://www.aAlfa Aesar
    8175 o-acetylsalicylCC(=O)Oc1ccc 49 71968 http://www.aAlfa Aesar
    8176 o-anisidine COc1ccccc1N 6 13860775 http://www.aAlfa Aesar
    8177 o-benzoic sulfc1ccc2c(c1)C 229 4959 http://www.aAlfa Aesar
    8178 o-cresol Cc1ccccc1O 32 13835772 http://www.aAlfa Aesar
    8179 o-cresolphthaCc1cc(ccc1O)C 224 62217 http://www.aAlfa Aesar
    8180 octafluoronapc12c(c(c(c(c1F 87 60886 http://www.aAlfa Aesar
    8181 octafluorotol c1(c(c(c(c(c1F) -66 9522 http://www.aAlfa Aesar
    8182 octamethylcycC[Si]1(N[Si](N 96 59489 http://www.aAlfa Aesar
    8183 octamethylcycC[Si]1(O[Si](O 18 10696 http://www.aAlfa Aesar
    8184 octanal CCCCCCCC=O 13 441 http://www.aAlfa Aesar
    8185 octanenitrile CCCCCCCC#N -45 29026 http://www.aAlfa Aesar
    8186 octanoic acid CCCCCCCC(=O 17 370 http://www.aAlfa Aesar
    8187 octanoyl chlorCCCCCCCC(=O) -63 7832 http://www.aAlfa Aesar
    8188 octaphenylcycc1ccc(cc1)[Si] 201 61642 http://www.aAlfa Aesar
    8189 o-dianisidine COc1cc(ccc1N) 136 8104 http://www.aAlfa Aesar
    8190 oleic acid CCCCCCCC/C= 14 393217 http://www.aAlfa Aesar
    8191 oleyl alcohol CCCCCCCC/C= 6 4447562 http://www.aAlfa Aesar
    8192 o-phenetidineCCOc1ccccc1 -4 21106580 http://www.aAlfa Aesar
    8193 o-phenylenedc1ccc(c(c1)N) 102 13837582 http://www.aAlfa Aesar
    8194 orotic acid, a c1c([nH]c(=O 346 942 http://www.aAlfa Aesar
    8195 orthophosphorOP(=O)(O)O 20 979 http://www.aAlfa Aesar
    8196 o-terphenyl c1ccc(cc1)c2c 57 6508 http://www.aAlfa Aesar
    8197 o-tolidine Cc1cc(ccc1N)c 130 8106 http://www.aAlfa Aesar
    8198 o-tolualdehydCc1ccccc1C=O -35 21106524 http://www.aAlfa Aesar
    8199 o-toluenesulf Cc1ccccc1S(= 156 6658 http://www.aAlfa Aesar
    8200 o-toluenesulfoCc1ccccc1S(=O 10 8304 http://www.aAlfa Aesar
    8201 o-toluic acid Cc1ccccc1C(= 105 8070 http://www.aAlfa Aesar
    8202 o-toluic hydraCc1ccccc1C(= 123 74105 http://www.aAlfa Aesar
    8203 o-toluidine Cc1ccccc1N -24 13854136 http://www.aAlfa Aesar
    8204 o-tolunitrile Cc1ccccc1C#N -14 21106523 http://www.aAlfa Aesar
    8205 o-tolylacetic aCc1ccccc1CC( 88 62724 http://www.aAlfa Aesar
    8206 oxalyl chlorid C(=O)(C(=O)Cl -12 59021 http://www.aAlfa Aesar
    8207 oxazole c1cocn1 -86 8898 http://www.aAlfa Aesar
    8208 oxindole c1ccc2c(c1)C 126 284794 http://www.aAlfa Aesar
    8209 o-xylene Cc1ccccc1C -25 6967 http://www.aAlfa Aesar
    8210 o-xylylene di c1ccc(c(c1)CB 94 60032 http://www.aAlfa Aesar
    8211 o-xylylene dicClCc1ccccc1CC 55 21111896 http://www.aAlfa Aesar
    8212 palmitic acid CCCCCCCCCCC 61 960 http://www.aAlfa Aesar
    8213 palmitic acid CCCCCCCCCCC 151 196071 http://www.aAlfa Aesar
    8214 palmitoyl chloCCCCCCCCCCC 11 7914 http://www.aAlfa Aesar
    8215 p-anisidine COc1ccc(cc1) 58 13869414 http://www.aAlfa Aesar
    8216 papaverine COc1ccc(cc1O 147 4518 http://www.aAlfa Aesar
    8217 p-benzoquinoC1=CC(=O)C= 114 4489 http://www.aAlfa Aesar
    8218 p-cresol Cc1ccc(cc1)O 33 13839082 http://www.aAlfa Aesar
    8219 p-cymene Cc1ccc(cc1)C( -68 7183 http://www.aAlfa Aesar
    8220 pentabromopc1(c(c(c(c(c1B 226 11359 http://www.aAlfa Aesar
    8221 pentachloroanc1(c(c(c(c(c1Cl 232 10243 http://www.aAlfa Aesar
    8222 pentachloroe C(C(Cl)(Cl)Cl)( -29 6179 http://www.aAlfa Aesar
    8223 pentachloropyc1(c(c(nc(c1Cl) 125 15724 http://www.aAlfa Aesar
    8224 pentadecanediC(CCCCCCC(= 114 141102 http://www.aAlfa Aesar
    8225 pentadecanoicCCCCCCCCCCC 53 13249 http://www.aAlfa Aesar
    8226 pentadecanolC1CCCCCCCOC 35 205386 http://www.aAlfa Aesar
    8227 pentaerythritoC(C(CO)(CO)C 262 7984 http://www.aAlfa Aesar
    8228 pentaerythrityC(C(CCl)(CCl)C 95 69160 http://www.aAlfa Aesar
    8229 pentafluorob C(=O)c1c(c(c(c 26 21106527 http://www.aAlfa Aesar
    8230 pentafluorobec1(c(c(c(c(c1F 102 11277 http://www.aAlfa Aesar
    8231 pentafluorobeC(#N)c1c(c(c(c 2 63077 http://www.aAlfa Aesar
    8232 pentafluorophc1(c(c(c(c(c1F 34 12499 http://www.aAlfa Aesar
    8233 pentafluorophc1(c(c(c(c(c1F 76 12681 http://www.aAlfa Aesar
    8234 pentafluorothc1(c(c(c(c(c1F) -24 12500 http://www.aAlfa Aesar
    8235 pentamethylbe
    Cc1c(c(c(c(c1 80 513036 http://www.aAlfa Aesar
    8236 pentamethylbe
    Cc1c(c(c(c(c1 159 71159 http://www.aAlfa Aesar
    8237 pentamethylph
    Cc1c(c(c(c(c1 112 125190 http://www.aAlfa Aesar
    8238 pentane CCCCC -130 7712 http://www. Alfa Aesar
    8239 pentaphenylc c1ccc(cc1)C2C 256 551189 http://www. Alfa Aesar
    8240 perfluorohexaC(C(C(C(F)(F)F) -90 9262 http://www.aAlfa Aesar
    8241 perfluoronon C(C(C(C(C(F)(F) -16 454320 http://www.aAlfa Aesar
    8242 periodic acid OI(=O)(=O)=O 128 58684 http://www.aAlfa Aesar
    8243 perylene c1cc2cccc3c2c 278 8788 http://www.aAlfa Aesar
    8244 phenanthrenec1ccc2c(c1)cc 99 970 http://www.aAlfa Aesar
    8245 phenanthrenec1ccc2c(c1)cc 102 70806 http://www.aAlfa Aesar
    8246 phenazine c1ccc2c(c1)nc 176 4593 http://www.aAlfa Aesar
    8247 phenetole CCOc1ccccc1 -30 7391 http://www.aAlfa Aesar
    8248 phenol c1ccc(cc1)O 42 971 http://www.aAlfa Aesar
    8249 phenolphthalec1ccc2c(c1)C( 260 4600 http://www.aAlfa Aesar
    8250 phenothiazinec1ccc2c(c1)Nc 184 21106365 http://www.aAlfa Aesar
    8251 phenoxathiin c1ccc2c(c1)Oc 57 8862 http://www.aAlfa Aesar
    8252 phenoxazine c1ccc2c(c1)N 156 60610 http://www.aAlfa Aesar
    8253 phenoxyaceticc1ccc(cc1)OC 100 18107 http://www.aAlfa Aesar
    8254 phenyl 2-pyri c1ccc(cc1)C(= 155 21159541 http://www. Alfa Aesar
    8255 phenyl benzoac1ccc(cc1)C(= 69 6901 http://www.aAlfa Aesar
    8256 phenyl beta-Dc1ccc(cc1)O 154 92439 http://www. Alfa Aesar
    8257 phenyl carba c1ccc(cc1)OC 151 62532 http://www.aAlfa Aesar
    8258 phenyl chloroc1ccc(cc1)OC( -38 15104 http://www.aAlfa Aesar
    8259 phenyl isocya c1ccc(cc1)N= -33 7389 http://www.aAlfa Aesar
    8260 phenyl isothi c1ccc(cc1)N= -21 7390 http://www.aAlfa Aesar
    8261 phenyl nicotinc1ccc(cc1)OC( 72 69464 http://www.aAlfa Aesar
    8262 phenyl phosp c1ccc(cc1)OP( 183 73959 http://www.aAlfa Aesar
    8263 phenyl phosphc1ccc(cc1)OP( -1 12496 http://www.aAlfa Aesar
    8264 phenyl p-tolylCc1ccc(cc1)S( 127 62703 http://www.aAlfa Aesar
    8265 phenyl salicyl c1ccc(cc1)OC 43 8058 http://www.aAlfa Aesar
    8266 phenyl vinyl s C=CS(=O)(=O) 69 71964 http://www.aAlfa Aesar
    8267 phenylacetic ac1ccc(cc1)CC( 77.5 10181341 http://www.aAlfa Aesar
    8268 phenylacetonitc1ccc(cc1)CC -24 13839308 http://www.aAlfa Aesar
    8269 phenylacetyleC#Cc1ccccc1 -45 10364 http://www.aAlfa Aesar
    8270 phenylbutazo CCCCC1C(=O)N 107 4617 http://www.aAlfa Aesar
    8271 phenylglyoxylic1ccc(cc1)C(= 65 11421 http://www.aAlfa Aesar
    8272 phenylhydrazic1ccc(cc1)NN 19 7235 http://www.aAlfa Aesar
    8273 phenylmalonicc1ccc(cc1)COC 66 104803 http://www.aAlfa Aesar
    8274 phenylphosphic1ccc(cc1)P(= 84 10449255 http://www.aAlfa Aesar
    8275 phenylphospho
    c1ccc(cc1)P(= 161 14560 http://www.aAlfa Aesar
    8276 phenylpropiolic1ccc(cc1)C# 137 62682 http://www.aAlfa Aesar
    8277 phenylsulfonylc1ccc(cc1)S(= 112 74075 http://www.aAlfa Aesar
    8278 phenyltrichlorc1ccc(cc1)[Si]( -127 7094 http://www.aAlfa Aesar
    8279 phenyltrimethCO[Si](c1cccc -25 17131 http://www.aAlfa Aesar
    8280 phloroglucinoc1c(cc(cc1O)O 218 352 http://www.aAlfa Aesar
    8281 phthalamic acc1ccc(c(c1)C( 142 6691 http://www.aAlfa Aesar
    8282 phthalazine c1ccc2cnncc2 91 8852 http://www.aAlfa Aesar
    8283 phthalhydrazic1ccc(c(c1)C 344 9542473 http://www.aAlfa Aesar
    8284 phthalic anhy c1ccc2c(c1)C 132 6552 http://www.aAlfa Aesar
    8285 phthalide c1ccc2c(c1)C 74 6621 http://www.aAlfa Aesar
    8286 phthalide-3-acc1ccc2c(c1)C 151 512638 http://www.aAlfa Aesar
    8287 phthalimide c1ccc2c(c1)C 234 6550 http://www.aAlfa Aesar
    8288 phthalonitrile c1ccc(c(c1)C# 140 6775 http://www.aAlfa Aesar
    8289 phthaloyl chloc1ccc(c(c1)C( 12 13865683 http://www.aAlfa Aesar
    8290 pimelic acid C(CCC(=O)O)C 104 376 http://www.aAlfa Aesar
    8291 pinacol, anhy CC(C)(C(C)(C) 44 21109330 http://www.aAlfa Aesar
    8292 pinacolone CC(=O)C(C)(C) -53 6176 http://www.aAlfa Aesar
    8293 pinane, endo CC1CCC2CC1C -53 9724 http://www.aAlfa Aesar
    8294 piperazine, a C1CNCCN1 110 13835459 http://www.aAlfa Aesar
    8295 piperidine C1CCNCC1 -11 7791 http://www.aAlfa Aesar
    8296 piperidine-1- C1CCN(CC1)C( 128 1267623 http://www.aAlfa Aesar
    8297 piperine c1cc2c(cc1/C 131 553590 http://www.aAlfa Aesar
    8298 piperonal c1cc2c(cc1C= 36 13859497 http://www.aAlfa Aesar
    8299 piperonaldox c1cc2c(cc1C 115 24590597 http://www.aAlfa Aesar
    8300 piperonylic acc1cc2c(cc1C( 233 6928 http://www.aAlfa Aesar
    8301 piperonylonitrc1cc2c(cc1C# 93 70512 http://www.aAlfa Aesar
    8302 p-phenetidineCCOc1ccc(cc1 3 21106155 http://www.aAlfa Aesar
    8303 p-phenylenedc1cc(ccc1N)N 140 13835179 http://www.aAlfa Aesar
    8304 p-quaterphenyc1ccc(cc1)c2c 317 8353 http://www.aAlfa Aesar
    8305 probenecid CCCN(CCC)S(= 199 4742 http://www.aAlfa Aesar
    8306 propargyl alcoC#CCO -53 21106466 http://www.aAlfa Aesar
    8307 propargyl bro C#CCBr -61 7554 http://www.aAlfa Aesar
    8308 propiolic acid C#CC(=O)O 18 9706 http://www.aAlfa Aesar
    8309 propionaldeh CCC=O -81 512 http://www.aAlfa Aesar
    8310 propionamideCCC(=O)N 78 6330 http://www.aAlfa Aesar
    8311 propionic acidCCC(=O)O -21 1005 http://www.aAlfa Aesar
    8312 propionic anhCCC(=O)OC(= -44 29003 http://www.aAlfa Aesar
    8313 propionitrile CCC#N -92 7566 http://www.aAlfa Aesar
    8314 propionyl chloCCC(=O)Cl -94 56119 http://www.aAlfa Aesar
    8315 propiophenonCCC(=O)c1ccc 18 6881 http://www.aAlfa Aesar
    8316 propylene carCC1COC(=O)O -49 7636 http://www.aAlfa Aesar
    8317 propylene oxi CC1CO1 -112 6138 http://www.aAlfa Aesar
    8318 propylenediphCC(CP(=O)(O) 178 10466693 http://www.aAlfa Aesar
    8319 p-terphenyl c1ccc(cc1)c2c 214 6848 http://www.aAlfa Aesar
    8320 p-tolualdehydCc1ccc(cc1)C -6 13865424 http://www.aAlfa Aesar
    8321 p-toluamide Cc1ccc(cc1)C( 159 62485 http://www.aAlfa Aesar
    8322 p-toluenesulf Cc1ccc(cc1)S( 138 6033 http://www.aAlfa Aesar
    8323 p-toluenesulf Cc1ccc(cc1)S( 128 70170 http://www.aAlfa Aesar
    8324 p-toluenesulfoCc1ccc(cc1)S( 69 7119 http://www.aAlfa Aesar
    8325 p-toluenesulfoCc1ccc(cc1)S( 41 9571 http://www.aAlfa Aesar
    8326 p-toluenesulf Cc1ccc(cc1)S 5 70104 http://www.aAlfa Aesar
    8327 p-toluenesulfoCc1ccc(cc1)S( 118 69945 http://www.aAlfa Aesar
    8328 p-toluenesulfoCc1ccc(cc1)S 150 72071 http://www.aAlfa Aesar
    8329 p-toluenesulf Cc1ccc(cc1)S( 112 142204 http://www.aAlfa Aesar
    8330 p-toluic acid Cc1ccc(cc1)C( 180 7190 http://www.aAlfa Aesar
    8331 p-toluic hydraCc1ccc(cc1)C 117 69607 http://www.aAlfa Aesar
    8332 p-toluidine Cc1ccc(cc1)N 44 13835151 http://www.aAlfa Aesar
    8333 p-tolunitrile Cc1ccc(cc1)C 28 21106167 http://www.aAlfa Aesar
    8334 p-toluoyl chloCc1ccc(cc1)C( -2 12831 http://www.aAlfa Aesar
    8335 p-toluoylacetoCc1ccc(cc1)C 102 455791 http://www.aAlfa Aesar
    8336 p-tolyl isothi Cc1ccc(cc1)N 25 11650 http://www.aAlfa Aesar
    8337 p-tolylacetic aCc1ccc(cc1)C 92 217532 http://www.aAlfa Aesar
    8338 p-tolylacetonitCc1ccc(cc1)C 18 21159744 http://www.aAlfa Aesar
    8339 p-tolylacetyle Cc1ccc(cc1)C# 21 12477 http://www.aAlfa Aesar
    8340 p-xylene Cc1ccc(cc1)C 12 7521 http://www.aAlfa Aesar
    8341 pyrazine c1cnccn1 53 8904 http://www.aAlfa Aesar
    8342 pyrazine-2-carc1cnc(cn1)C# 19 65936 http://www.aAlfa Aesar
    8343 pyrazine-2-th c1cnc(cn1)C(= 200 2076273 http://www. Alfa Aesar
    8344 pyrazolo[1,5- c1cc2ccnn2c( 85 9041756 http://www. Alfa Aesar
    8345 pyrene c1cc2ccc3cccc 150 29153 http://www.aAlfa Aesar
    8346 pyridazine c1ccnnc1 -8 8902 http://www.aAlfa Aesar
    8347 pyridine c1ccncc1 -42 1020 http://www.aAlfa Aesar
    8348 pyridine n-oxic1cc[n+](cc1)[ 64 12229 http://www.aAlfa Aesar
    8349 pyridine-2,3-dc1cc(c(nc1)C( 136 19969994 http://www.aAlfa Aesar
    8350 pyridine-2,4-dc1cnc(cc1C#N 90 107258 http://www.aAlfa Aesar
    8351 pyridine-2,6-dc1cc(nc(c1)C( 59 69752 http://www. Alfa Aesar
    8352 pyridine-2-ca c1ccnc(c1)C= -21 13635 http://www.aAlfa Aesar
    8353 pyridine-2-ca c1ccc2c(c1)cc 205 91702 http://www.aAlfa Aesar
    8354 pyridine-2-ca c1ccnc(c1)C=N 258 255555 http://www.aAlfa Aesar
    8355 pyridine-2-ca c1ccnc(c1)C= 111 20481350 http://www.aAlfa Aesar
    8356 pyridine-2-ca c1ccnc(c1)C(= 106 14342 http://www.aAlfa Aesar
    8357 pyridine-2-th c1ccnc(c1)C(= 123 1266383 http://www. Alfa Aesar
    8358 pyridine-3,4-dc1cncc(c1C#N 80 66819 http://www.aAlfa Aesar
    8359 pyridine-3,4-dc1cncc(c1C(= 77 20002741 http://www.aAlfa Aesar
    8360 pyridine-3-ca c1cc(cnc1)C= 8 9943 http://www.aAlfa Aesar
    8361 pyridine-3-ca c1cc(cnc1)C= 150 674 http://www.aAlfa Aesar
    8362 pyridine-4-ca c1cnccc1C=O -4 12816 http://www.aAlfa Aesar
    8363 pyridine-4-ca c1cnccc1C=N 132 21403085 http://www.aAlfa Aesar
    8364 pyrido[2,3-b] c1cc2c(nc1)nc 143 60901 http://www.aAlfa Aesar
    8365 pyrimidine c1cncnc1 21 8903 http://www.aAlfa Aesar
    8366 pyrogallol c1cc(c(c(c1)O 133 13835557 http://www.aAlfa Aesar
    8367 pyromellitic a c1c(c(cc(c1C 283 6695 http://www.aAlfa Aesar
    8368 pyrrole-2-car c1cc([nH]c1) 43 13254 http://www.aAlfa Aesar
    8369 pyrrole-2-car c1cc([nH]c1) 165 24590663 http://www.aAlfa Aesar
    8370 pyrrolidine C1CCNC1 -63 29008 http://www.aAlfa Aesar
    8371 pyrrolidine-2-C1CC(=S)NC1 111 2055633 http://www.aAlfa Aesar
    8372 pyruvic acid CC(=O)C(=O)O 11 1031 http://www.aAlfa Aesar
    8373 pyruvic aldeh CC(=O)C(OC)O -57 72835 http://www.aAlfa Aesar
    8374 quinaldic acidc1ccc2c(c1)cc 158 6857 http://www.aAlfa Aesar
    8375 quinaldine Cc1ccc2ccccc -2 13870160 http://www.aAlfa Aesar
    8376 quinazoline c1ccc2c(c1)cn 47 8855 http://www.aAlfa Aesar
    8377 quinidine COc1ccc2c(c 170 389880 http://www.aAlfa Aesar
    8378 quinoline c1ccc2c(c1)cc -15 6780 http://www.aAlfa Aesar
    8379 quinoline-2-cac1ccc2c(c1)cc 95 66650 http://www.aAlfa Aesar
    8380 quinoline-2-c c1ccc2c(c1)cc 68 71926 http://www.aAlfa Aesar
    8381 quinoline-3-c c1ccc2c(c1)cc 70 75465 http://www.aAlfa Aesar
    8382 quinoline-4-c c1ccc2c(c1)c( 50 70450 http://www.aAlfa Aesar
    8383 quinoline-4-cac1ccc2c(c1)c( 254 9826 http://www.aAlfa Aesar
    8384 quinoline-5-boB(c1cccc2c1cc 146 4326504 http://www.aAlfa Aesar
    8385 quinoline-5-c c1cc(c2cccnc 96 2781680 http://www.aAlfa Aesar
    8386 quinoline-6-cac1cc2cc(ccc2n 295 74515 http://www.aAlfa Aesar
    8387 quinoline-8-c c1cc2cccnc2c 93 148744 http://www.aAlfa Aesar
    8388 quinoline-8-cac1cc2cccnc2c( 187 59951 http://www.aAlfa Aesar
    8389 quinoline-8-suc1cc2cccnc2c( 129 27177 http://www.aAlfa Aesar
    8390 quinoxaline c1ccc2c(c1)nc 30 21106470 http://www.aAlfa Aesar
    8391 reserpine COc1ccc2c(c 265 5566 http://www.aAlfa Aesar
    8392 resorcinol c1cc(cc(c1)O) 111 4878 http://www.aAlfa Aesar
    8393 resorcinol dig c1cc(cc(c1)O 34 7305 http://www.aAlfa Aesar
    8394 resorcinol m c1ccc(cc1)C(= 132 8366 http://www.aAlfa Aesar
    8395 resorcinol-o,o'c1cc(cc(c1)O 194 60246 http://www.aAlfa Aesar
    8396 retinoic acid CC1=C(C(CCC1 181 392618 http://www.aAlfa Aesar
    8397 rhodanine C1C(=O)NC(=S 169 1013337 http://www.aAlfa Aesar
    8398 rhodanine-3-ac
    C1C(=O)N(C(= 147 72086 http://www.aAlfa Aesar
    8399 rubrene c1ccc(cc1)c2c 333 61510 http://www. Alfa Aesar
    8400 S,S-dimethyl- Cc1ccc(cc1)S( 168 89644 http://www.aAlfa Aesar
    8401 salicylaldehydc1ccc(c(c1)C= -7 13863618 http://www.aAlfa Aesar
    8402 salicylaldehy c1ccc(c(c1)/C 97 10562015 http://www.aAlfa Aesar
    8403 salicylaldoximc1ccc(c(c1)/C 57 10229769 http://www.aAlfa Aesar
    8404 salicylamide c1ccc(c(c1)C( 140 4963 http://www.aAlfa Aesar
    8405 salicylanilide c1ccc(cc1)NC 137 6610 http://www.aAlfa Aesar
    8406 salicylic acid c1ccc(c(c1)C( 159 331 http://www.aAlfa Aesar
    8407 salicylideneanc1ccc(cc1)N= 50 10483270 http://www.aAlfa Aesar
    8408 salicylsalicylic c1ccc(c(c1)C 135 4977 http://www.aAlfa Aesar
    8409 sarcosine anhCN1CC(=O)N( 145 71100 http://www.aAlfa Aesar
    8410 sebacic acid C(CCCCC(=O)O 133 5004 http://www.aAlfa Aesar
    8411 sebaconitrile C(CCCCC#N)C 6 67214 http://www.aAlfa Aesar
    8412 sebacoyl chlorC(CCCCC(=O)C -5 59462 http://www.aAlfa Aesar
    8413 sec-butyl acetCCC(C)OC(=O) -99 7472 http://www.aAlfa Aesar
    8414 sec-butylbenzCCC(C)c1ccccc -75 8356 http://www.aAlfa Aesar
    8415 sesamol c1cc2c(cc1O) 63 61586 http://www.aAlfa Aesar
    8416 shikimic acid C1[C@H]([C@ 186 8412 http://www.aAlfa Aesar
    8417 solketal CC1(OCC(O1) -27 7247 http://www.aAlfa Aesar
    8418 sorbic acid C/C=C/C=C/C( 134 558605 http://www.aAlfa Aesar
    8419 sorbitan monoCCCCCCCCCCC 55 16736467 http://www.aAlfa Aesar
    8420 spermidine C(CCNCCCN)C 24 1071 http://www.aAlfa Aesar
    8421 spermine C(CCNCCCN)C 29 1072 http://www.aAlfa Aesar
    8422 squalane CC(C)CCCC(C) -38 7798 http://www.aAlfa Aesar
    8423 squalene CC(=CCC/C(=C -75 553635 http://www.aAlfa Aesar
    8424 stearic acid CCCCCCCCCCC 71 5091 http://www.aAlfa Aesar
    8425 stearic acid h CCCCCCCCCCC 115 18925 http://www.aAlfa Aesar
    8426 styrene C=Cc1ccccc1 -31 7220 http://www.aAlfa Aesar
    8427 suberic acid C(CCCC(=O)O) 143 10025 http://www.aAlfa Aesar
    8428 succinamic acC(CC(=O)O)C( 155 12005 http://www.aAlfa Aesar
    8429 succinic acid C(CC(=O)O)C( 187 1078 http://www.aAlfa Aesar
    8430 succinic anhydC1CC(=O)OC1 120 7634 http://www.aAlfa Aesar
    8431 succinimide C1CC(=O)NC1 124 10955 http://www.aAlfa Aesar
    8432 succinonitrile C(CC#N)C#N 54 21106481 http://www.aAlfa Aesar
    8433 succinyl chlor C(CC(=O)Cl)C( 17 13867055 http://www.aAlfa Aesar
    8434 sucrose C([C@@H]1[C 188 5768 http://www.aAlfa Aesar
    8435 sulfacetamideCC(=O)NS(=O) 183 5129 http://www.aAlfa Aesar
    8436 sulfadiazine c1cnc(nc1)NS( 255 5026 http://www.aAlfa Aesar
    8437 sulfamerazineCc1ccnc(n1)NS 236 5134 http://www.aAlfa Aesar
    8438 sulfamethazinCc1cc(nc(n1)N 200 5136 http://www.aAlfa Aesar
    8439 sulfamide NS(=O)(=O)N 92 74243 http://www.aAlfa Aesar
    8440 sulfanilamide c1cc(ccc1N)S( 166 5142 http://www.aAlfa Aesar
    8441 sulfanilic acid c1cc(ccc1N)S( 365 8166 http://www.aAlfa Aesar
    8442 sulfathiazole c1cc(ccc1N)S( 202 5148 http://www.aAlfa Aesar
    8443 sulfolane C1CCS(=O)(=O 27 29080 http://www.aAlfa Aesar
    8444 syringaldehydCOc1cc(cc(c1 112 8333 http://www.aAlfa Aesar
    8445 syringic acid COc1cc(cc(c1 207 10289 http://www.aAlfa Aesar
    8446 terephthalald c1cc(ccc1C=O 116 11673 http://www.aAlfa Aesar
    8447 terephthalic c1cc(ccc1C(= 173 5384434 http://www.aAlfa Aesar
    8448 terephthalonitc1cc(ccc1C#N 226 11672 http://www.aAlfa Aesar
    8449 terephthaloyl c1cc(ccc1C(=O 81 7207 http://www.aAlfa Aesar
    8450 tert-butyl 2,2 CC(C)(C)OC(=N) 21 10646966 http://www.aAlfa Aesar
    8451 tert-butyl ace CC(=O)OC(C)( -62 10446 http://www.aAlfa Aesar
    8452 tert-butyl ace CC(=O)CC(=O) -38 14782 http://www.aAlfa Aesar
    8453 tert-butyl acryCC(C)(C)OC(= -69 14708 http://www.aAlfa Aesar
    8454 tert-butyl alc CC(C)(C)O 25 6146 http://www.aAlfa Aesar
    8455 tert-butyl br CC(C)(C)Br -20 10053 http://www.aAlfa Aesar
    8456 tert-butyl ca CC(C)(C)OC(= 108 70313 http://www.aAlfa Aesar
    8457 tert-butyl car CC(C)(C)OC(= 39 63279 http://www.aAlfa Aesar
    8458 tert-butyl chl CC(C)(C)Cl -26 10054 http://www.aAlfa Aesar
    8459 tert-butyl eth CCOC(C)(C)C -94 11996 http://www.aAlfa Aesar
    8460 tert-butyl iso CC(C)(C)N=C= 10 11057 http://www.aAlfa Aesar
    8461 tert-butyl metCC(C)(C)OC -109 14672 http://www.aAlfa Aesar
    8462 tert-butyl N-a CC(C)(C)OC(= 37 3282523 http://www. Alfa Aesar
    8463 tert-butyl pe CC(C)(C)OOC( 7 11472 http://www.aAlfa Aesar
    8464 tert-butylami CC(C)(C)N -67 6145 http://www.aAlfa Aesar
    8465 tert-butylben CC(C)(C)c1ccc -58 7088 http://www.aAlfa Aesar
    8466 tert-butylcyc CC(C)(C)C1CC -41 17481 http://www.aAlfa Aesar
    8467 tert-butyldic CC(C)(C)P(Cl)C 47 105171 http://www. Alfa Aesar
    8468 tert-butyldimeCC(C)(C)[Si](C) 88 26908 http://www.aAlfa Aesar
    8469 tert-butylsulf CC(C)(C)S(=O 143 2058790 http://www.aAlfa Aesar
    8470 tetrabenzyl p c1ccc(cc1)CO 61 489591 http://www.aAlfa Aesar
    8471 tetrabromocac1(c(c(c(c(c1B 191 55075 http://www.aAlfa Aesar
    8472 tetrabromohyc1(c(c(c(c(c1B 244 68349 http://www.aAlfa Aesar
    8473 tetrabromothc1(c(c(sc1Br)B 115 69970 http://www.aAlfa Aesar
    8474 tetrachloroet C(=C(Cl)Cl)(Cl) -22 13837281 http://www.aAlfa Aesar
    8475 tetrachlorophc12c(c(c(c(c1 256 8023 http://www.aAlfa Aesar
    8476 tetrachloroth c1(c(c(sc1Cl)Cl 28 20971 http://www.aAlfa Aesar
    8477 tetracyanoethC(#N)C(=C(C# 198 12114 http://www.aAlfa Aesar
    8478 tetradecanoic CCCCCCCCCCC 55 10539 http://www.aAlfa Aesar
    8479 tetradecanonitCCCCCCCCCCC 19 58227 http://www.aAlfa Aesar
    8480 tetraethoxysi CCO[Si](OCC) -85 6270 http://www.aAlfa Aesar
    8481 tetraethylene C(COCCOCCO -4 7908 http://www.aAlfa Aesar
    8482 tetraethylene COCCOCCOCC -30 13835433 http://www.aAlfa Aesar
    8483 tetraethylsila CC[Si](CC)(CC -82 11919 http://www.aAlfa Aesar
    8484 tetraethylthiuCCN(CC)C(=S) 71 3005 http://www.aAlfa Aesar
    8485 tetrafluoroisoC(#N)c1c(c(c( 77 528656 http://www.aAlfa Aesar
    8486 tetrafluorophtc1(c(c(c(c(c1 156 62748 http://www.aAlfa Aesar
    8487 tetrafluorosucC(=O)(C(C(C(= 115 61150 http://www.aAlfa Aesar
    8488 tetrahydro-4hC1CSCCC1=O 62 59560 http://www.aAlfa Aesar
    8489 tetrahydrofur C1CCOC1 -108 7737 http://www.aAlfa Aesar
    8490 tetrahydropyrC1CCOCC1 -49 8554 http://www.aAlfa Aesar
    8491 tetrahydrothi C1CCSC1 -96 1095 http://www.aAlfa Aesar
    8492 tetraisopropy O=P(OC(C)C)( 36 526496 http://www.aAlfa Aesar
    8493 tetrakis(dime CN(C)[Si](N(C 15 66803 http://www. Alfa Aesar
    8494 tetrakis(dimetC[SiH](C)O[Si] -60 3551140 http://www.aAlfa Aesar
    8495 tetrakis(trimeC[Si](C)(C)O[Si -60 18019 http://www.aAlfa Aesar
    8496 tetramethoxysCO[Si](OC)(O 5 12161 http://www.aAlfa Aesar
    8497 tetramethylcyCC1(C(=O)C(C 114 13028 http://www.aAlfa Aesar
    8498 tetramethyletCC(=C(C)C)C -75 10776 http://www.aAlfa Aesar
    8499 tetramethylsi C[Si](C)(C)C -100 6156 http://www.aAlfa Aesar
    8500 tetramethylthCN(C)C(=S)SSC 150 5256 http://www.aAlfa Aesar
    8501 tetramethylurCN(C)C(=O)N( -1 11930 http://www.aAlfa Aesar
    8502 tetraphenylcyc1ccc(cc1)C2= 218 61382 http://www.aAlfa Aesar
    8503 tetraphenyletc1ccc(cc1)C(= 224 62645 http://www.aAlfa Aesar
    8504 tetraphenylm c1ccc(cc1)C(c 283 11917 http://www.aAlfa Aesar
    8505 tetraphenylphc1ccc(cc1)N=P 130 67888 http://www.aAlfa Aesar
    8506 tetraphenylsi c1ccc(cc1)[Si] 237 59493 http://www.aAlfa Aesar
    8507 tetraphenylthc1ccc(cc1)c2c 182 67239 http://www.aAlfa Aesar
    8508 tetratetracon CCCCCCCCCCC 88 21965 http://www.aAlfa Aesar
    8509 tetrathiafulvaC1=CSC(=C2SC 118 89848 http://www.aAlfa Aesar
    8510 theobromine Cn1cnc2c1c(= 348 5236 http://www.aAlfa Aesar
    8511 theophylline-7Cn1c2c(c(=O) 270 62754 http://www.aAlfa Aesar
    8512 thianthrene-1B(c1cccc2c1Sc 147 2016134 http://www.aAlfa Aesar
    8513 thiazole c1cscn1 -33 8899 http://www.aAlfa Aesar
    8514 thieno[3,2-b] c1csc2c1scc2 56 119840 http://www. Alfa Aesar
    8515 thioacetamid CC(=S)N 112 2006126 http://www.aAlfa Aesar
    8516 thioacetic aci CC(=O)S -17 10052 http://www.aAlfa Aesar
    8517 thiobenzamidc1ccc(cc1)C(= 116 595481 http://www.aAlfa Aesar
    8518 thiobenzoic acc1ccc(cc1)C(= 17 7136 http://www.aAlfa Aesar
    8519 thiodiglycolic C(C(=O)O)(O) 129 396724 http://www.aAlfa Aesar
    8520 thiodiglycolic C(C(=O)O)(O) 98 19984617 http://www.aAlfa Aesar
    8521 thionyl bromi O=S(Br)Br -52 61483 http://www.aAlfa Aesar
    8522 thionyl chlori O=S(Cl)Cl -105 22797 http://www.aAlfa Aesar
    8523 thiophene c1ccsc1 -38 7739 http://www.aAlfa Aesar
    8524 thiophene-2,5-c1cc(sc1C(=O 358 19099 http://www.aAlfa Aesar
    8525 thiophene-2-bB(c1cccs1)(O) 130 2015722 http://www.aAlfa Aesar
    8526 thiophene-2- c1cc(sc1)C=N 134 87801 http://www.aAlfa Aesar
    8527 thiophene-2- c1cc(sc1)C(=O 181 20732 http://www.aAlfa Aesar
    8528 thiophene-2-ca
    c1cc(sc1)C(=O 128 10250 http://www.aAlfa Aesar
    8529 thiophene-2-cc1cc(sc1)C(=O 60 2913332 http://www.aAlfa Aesar
    8530 thiophene-2-cc1cc(sc1)C(= 139 65882 http://www.aAlfa Aesar
    8531 thiophene-2-su
    c1cc(sc1)S(=O 30 77127 http://www.aAlfa Aesar
    8532 thiophene-2-su
    c1cc(sc1)S(=O 84 512817 http://www.aAlfa Aesar
    8533 thiophene-2-tc1cc(sc1)C(=S 108 644299 http://www.aAlfa Aesar
    8534 thiophene-3-ac1cscc1CC(=O 86 411753 http://www.aAlfa Aesar
    8535 thiophene-3-bB(c1ccsc1)(O) 167 505666 http://www.aAlfa Aesar
    8536 thiophene-3- c1cscc1C=NO 122 2062095 http://www.aAlfa Aesar
    8537 thiophene-3-ca
    c1cscc1C(=O) 139 6652 http://www.aAlfa Aesar
    8538 thiophenol c1ccc(cc1)S -15 7681 http://www.aAlfa Aesar
    8539 thiosalicylic a c1ccc(c(c1)C( 167 73716 http://www.aAlfa Aesar
    8540 thiourea C(=S)(N)N 177 2005981 http://www.aAlfa Aesar
    8541 thioxanthen-9c1ccc2c(c1)c( 212 9873 http://www.aAlfa Aesar
    8542 thymidine Cc1cn(c(=O) 188 5585 http://www.aAlfa Aesar
    8543 thymine Cc1c[nH]c(=O 317 1103 http://www.aAlfa Aesar
    8544 thymol Cc1ccc(c(c1)O 51 21105998 http://www.aAlfa Aesar
    8545 thymolphthaleCc1cc(c(cc1C2 252 29054 http://www.aAlfa Aesar
    8546 tiglic acid C/C=C(C)/C(= 64 111629 http://www.aAlfa Aesar
    8547 tolbutamide CCCCNC(=O)NS 129 5304 http://www.aAlfa Aesar
    8548 toluene Cc1ccccc1 -93 1108 http://www.aAlfa Aesar
    8549 toluene-2,4-d Cc1ccc(cc1N 21 13835351 http://www.aAlfa Aesar
    8550 toluene-2,6-d Cc1c(cccc1N 13 6773 http://www.aAlfa Aesar
    8551 trans,trans-2, C/C=C/C=C/C 31 556559 http://www.aAlfa Aesar
    8552 trans-1,2-cycl C1CC[C@@H]( 221 67853 http://www.aAlfa Aesar
    8553 trans-1,2-cyc C1CC[C@@H]( 104 5413674 http://www.aAlfa Aesar
    8554 trans-2,3,4-t COc1ccc(c(c1 174 642995 http://www.aAlfa Aesar
    8555 trans-2,3-dib C(/C(=C(/CO)B 113 556543 http://www.aAlfa Aesar
    8556 trans-2,4-dichc1cc(c(cc1Cl) 234 599520 http://www.aAlfa Aesar
    8557 trans-2,4-difl c1cc(c(cc1F)F 217 4524557 http://www.aAlfa Aesar
    8558 trans-2,5-dim C[C@@H]1CN[ 117 191400 http://www.aAlfa Aesar
    8559 trans-2-bromoc1ccc(c(c1)/C 218 599795 http://www.aAlfa Aesar
    8560 trans-2-fluor C1CC[C@@H]( 21 8139677 http://www. Alfa Aesar
    8561 trans-2-hexenCCC/C=C/C -99 555073 http://www.aAlfa Aesar
    8562 trans-2-hexeno
    CCC/C=C/C(= 33 4445834 http://www.aAlfa Aesar
    8563 trans-2-methoCOc1ccccc1/C 185 641429 http://www.aAlfa Aesar
    8564 trans-2-nitrocc1ccc(c(c1)/C 247 643069 http://www.aAlfa Aesar
    8565 trans-2-octen CCCCC/C=C/C -88 4516601 http://www.aAlfa Aesar
    8566 trans-2-penteCC/C=C/C -136 4483639 http://www.aAlfa Aesar
    8567 trans-2-pentenCC/C=C/C(=O) 9 553682 http://www.aAlfa Aesar
    8568 trans-3-(trifl c1cc(cc(c1)C(F 30 4525020 http://www. Alfa Aesar
    8569 trans-3-bromoc1cc(cc(c1)Br 180 678734 http://www.aAlfa Aesar
    8570 trans-3-ethox CCOc1cccc(c1 133 4648121 http://www.aAlfa Aesar
    8571 trans-3-fluoroc1cc(cc(c1)F) 167 1267611 http://www.aAlfa Aesar
    8572 trans-3-hexenCC/C=C/CC -113 553629 http://www.aAlfa Aesar
    8573 trans-3-hexeno
    CC/C=C/CC(= 11 4445835 http://www.aAlfa Aesar
    8574 trans-3-hydroc1cc(cc(c1)O) 194 553147 http://www.aAlfa Aesar
    8575 trans-4-(trifl c1cc(ccc1/C=C 232 599560 http://www.aAlfa Aesar
    8576 trans-4-aminoC1[C@@H](CC 112 18517939 http://www.aAlfa Aesar
    8577 trans-4-ethylcCC[C@H]1CC[ 50 18549678 http://www.aAlfa Aesar
    8578 trans-4-hydroCOc1cc(ccc1O 173 393368 http://www.aAlfa Aesar
    8579 trans-4-meth COc1ccc(cc1) 58 556586 http://www.aAlfa Aesar
    8580 trans-4-methoCOc1ccc(cc1) 173 609479 http://www.aAlfa Aesar
    8581 trans-4-methyC[C@H]1CC[C 110 10466930 http://www. Alfa Aesar
    8582 trans-4-n-penCCCCC[C@H]1 54 18534748 http://www.aAlfa Aesar
    8583 trans-4-tert-pCCC([C@H]1C 26 19971182 http://www.aAlfa Aesar
    8584 trans-anethol C/C=C/c1ccc( 22 553166 http://www.aAlfa Aesar
    8585 trans-chalcon c1ccc(cc1)/C= 56 553346 http://www.aAlfa Aesar
    8586 trans-cinnam c1ccc(cc1)/C -8 553117 http://www.aAlfa Aesar
    8587 trans-cinnamicc1ccc(cc1)/C= 135 392447 http://www.aAlfa Aesar
    8588 trans-cinnamon
    c1ccc(cc1)/C 19 1267328 http://www.aAlfa Aesar
    8589 trans-cinnamoc1ccc(cc1)/C= 36 4510481 http://www.aAlfa Aesar
    8590 trans-crotonicC/C=C/C(=O)O 72 552744 http://www.aAlfa Aesar
    8591 trans-stilbenec1ccc(cc1)/C= 124 553649 http://www.aAlfa Aesar
    8592 tri(1-naphthy c1ccc2c(c1)cc 267 238750 http://www.aAlfa Aesar
    8593 tri(2-furyl)ph c1cc(oc1)P(c2 62 454978 http://www.aAlfa Aesar
    8594 tri(4-morphol C1COCCN1P(= 190 70556 http://www.aAlfa Aesar
    8595 tri(m-tolyl)ph Cc1cccc(c1)P( 100 72591 http://www.aAlfa Aesar
    8596 tri(o-tolyl)ph Cc1ccccc1P(c2 125 72513 http://www.aAlfa Aesar
    8597 tri(p-tolyl)ph Cc1ccc(cc1)P( 145 13352 http://www.aAlfa Aesar
    8598 triacetoxy(ethCC[Si](OC(=O 8 78701 http://www.aAlfa Aesar
    8599 triacetoxy(metCC(=O)O[Si](C 43 70319 http://www.aAlfa Aesar
    8600 triacetoxy(vinCC(=O)O[Si]( 7 70177 http://www.aAlfa Aesar
    8601 triallylamine C=CCN(CC=C) -70 7335 http://www.aAlfa Aesar
    8602 tribenzylaminc1ccc(cc1)CN( 93 22739 http://www.aAlfa Aesar
    8603 tribenzylphos c1ccc(cc1)CP( 96 74097 http://www.aAlfa Aesar
    8604 tribromoaceticC(=O)(C(Br)(B 132 6175 http://www.aAlfa Aesar
    8605 tribromofluo C(F)(Br)(Br)Br -74 61026 http://www.aAlfa Aesar
    8606 tricarballylic aC(C(CC(=O)O) 160 14220 http://www.aAlfa Aesar
    8607 trichloroaceticC(=O)(C(Cl)(Cl 56 10772050 http://www.aAlfa Aesar
    8608 trichloroacetoC(#N)C(Cl)(Cl) -44 13861934 http://www.aAlfa Aesar
    8609 trichloroacetyC(=O)(C(Cl)(Cl) -146 6180 http://www.aAlfa Aesar
    8610 trichloroacryliC(=C(Cl)Cl)(C( 73 10289059 http://www.aAlfa Aesar
    8611 trichloroethyl C(=C(Cl)Cl)Cl -85 13837280 http://www.aAlfa Aesar
    8612 trichloromethC(=O)(OC(Cl)(C -57 21154424 http://www.aAlfa Aesar
    8613 trichlorosilan [SiH](Cl)(Cl)Cl -127 23196 http://www.aAlfa Aesar
    8614 tricyclohexyl C1CCC(CC1)P 77 68315 http://www.aAlfa Aesar
    8615 tricyclohexyl C1CCC(CC1)P( 156 24398 http://www.aAlfa Aesar
    8616 triethanolami C(CO)N(CCO) 20 13835630 http://www.aAlfa Aesar
    8617 triethoxysilan CCO[SiH](OCC -170 13230 http://www.aAlfa Aesar
    8618 triethyl 1,3,5 CCOC(=O)c1cc 134 197228 http://www.aAlfa Aesar
    8619 triethyl borat B(OCC)(OCC) -85 8659 http://www.aAlfa Aesar
    8620 triethyl citrat CCOC(=O)CC(C -55 13850879 http://www.aAlfa Aesar
    8621 triethyl methaCCOC(=O)C(C( 28 72680 http://www.aAlfa Aesar
    8622 triethyl ortho CCOC(OCC)OC -61 28955 http://www.aAlfa Aesar
    8623 triethyl phospCCOP(OCC)OC -112 28956 http://www.aAlfa Aesar
    8624 triethylamine CCN(CC)CC -115 8158 http://www.aAlfa Aesar
    8625 triethylene gl C(COCCOCCO) -7 13835895 http://www.aAlfa Aesar
    8626 triethylene gl CC(=O)OCCOC -50 7807 http://www.aAlfa Aesar
    8627 triethylene gl COCCOCCOCC -45 13835222 http://www.aAlfa Aesar
    8628 triethylenete C(CNCCNCCN) -35 21106175 http://www.aAlfa Aesar
    8629 triethylphosp CCP(=O)(CC)C 49 71393 http://www.aAlfa Aesar
    8630 triethylphosphCCP(=S)(CC)CC 95 266248 http://www.aAlfa Aesar
    8631 triethylsilane CC[SiH](CC)CC -157 11555 http://www.aAlfa Aesar
    8632 trifluoroaceticC(=O)(C(F)(F)F -15 10239201 http://www.aAlfa Aesar
    8633 trifluoroaceti C(=O)(C(F)(F)F -65 21106178 http://www.aAlfa Aesar
    8634 trifluorometh C(F)(F)(F)S(=O 118 71334 http://www.aAlfa Aesar
    8635 trifluoromethaC(F)(F)(F)S(= -40 56192 http://www.aAlfa Aesar
    8636 trifluorometh C(F)(F)(F)S(= -80 61068 http://www.aAlfa Aesar
    8637 triisopropyl b B(OC(C)C)(OC( -59 20236 http://www.aAlfa Aesar
    8638 trimellitic an c1cc2c(cc1C( 68 64159 http://www.aAlfa Aesar
    8639 trimesitylpho Cc1cc(c(c(c1)C 187 2015216 http://www.aAlfa Aesar
    8640 trimethyl 1,2, COC(=O)c1ccc 39 16243 http://www.aAlfa Aesar
    8641 trimethyl 1,3, COC(=O)c1cc( 146 68386 http://www.aAlfa Aesar
    8642 trimethyl bor B(OC)(OC)OC -34 8157 http://www.aAlfa Aesar
    8643 trimethyl ort COC(OC)OC -53 8655 http://www.aAlfa Aesar
    8644 trimethyl phoCOP(=O)(OC) -46 10101 http://www.aAlfa Aesar
    8645 trimethyl phoCOP(OC)OC -78 8159 http://www.aAlfa Aesar
    8646 trimethylacet CC(C)(C)C=O 6 11910 http://www.aAlfa Aesar
    8647 trimethylacetiCC(C)(C)C(=O) 33 6177 http://www.aAlfa Aesar
    8648 trimethylacetoCC(C)(C)C#N 17 11909 http://www.aAlfa Aesar
    8649 trimethylacetyCC(C)(C)C(=O) -57 56272 http://www.aAlfa Aesar
    8650 trimethylacetyCC(C)(C)C(=O 68 97904 http://www.aAlfa Aesar
    8651 trimethylene C1COC1 -97 9994 http://www.aAlfa Aesar
    8652 trimethylphosCP(=O)(C)C 141 62812 http://www.aAlfa Aesar
    8653 trimethylphosCP(=S)(C)C 156 109775 http://www.aAlfa Aesar
    8654 trimethylsilyl CC(=O)O[Si](C -32 68487 http://www.aAlfa Aesar
    8655 trimethylsilyl C[Si](C)(C)N=[ -95 70747 http://www.aAlfa Aesar
    8656 trimethylsilyl C[Si](C)(C)C#N 11 74110 http://www.aAlfa Aesar
    8657 trimethylsilyl C[Si](C)(C)N= -49 63862 http://www.aAlfa Aesar
    8658 trimethylsilyl C[Si](C)(C)N= -33 67839 http://www.aAlfa Aesar
    8659 tri-n-butyl cit CCCCOC(=O)C -20 6261 http://www.aAlfa Aesar
    8660 tri-n-butyl ph CCCCOP(=O)( -80 29090 http://www.aAlfa Aesar
    8661 tri-n-butyl ph CCCCOP(OCCC -80 7341 http://www.aAlfa Aesar
    8662 tri-n-butylbor B(CCCC)(CCCC -34 28957 http://www.aAlfa Aesar
    8663 tri-n-butylph CCCCP(CCCC) -65 13231 http://www.aAlfa Aesar
    8664 tri-n-butylphoCCCCP(=O)(CC 67 12586 http://www.aAlfa Aesar
    8665 tri-n-dodecyl CCCCCCCCCCC 15 7342 http://www.aAlfa Aesar
    8666 tri-n-octylami CCCCCCCCN(C -39 13591 http://www.aAlfa Aesar
    8667 tri-n-octylphoCCCCCCCCP(= 55 59020 http://www.aAlfa Aesar
    8668 tri-n-propyla CCCN(CCC)CC -93 7334 http://www.aAlfa Aesar
    8669 triphenyl pho c1ccc(cc1)OP( 50 7988 http://www.aAlfa Aesar
    8670 triphenyl pho c1ccc(cc1)OP( 23 7259 http://www.aAlfa Aesar
    8671 triphenylacrylc1ccc(cc1)C(= 166 21321 http://www.aAlfa Aesar
    8672 triphenylaminc1ccc(cc1)N(c 127 11282 http://www.aAlfa Aesar
    8673 triphenylbora B(c1ccccc1)(c 147 63579 http://www.aAlfa Aesar
    8674 triphenylene c1ccc2c(c1)c3 197 8816 http://www.aAlfa Aesar
    8675 triphenylmet c1ccc(cc1)C(c 93 10169 http://www.aAlfa Aesar
    8676 triphenylmethc1ccc(cc1)C(c 163 6215 http://www.aAlfa Aesar
    8677 triphenylmethc1ccc(cc1)C(c 135 120877 http://www.aAlfa Aesar
    8678 triphenylmethc1ccc(cc1)C(c 106 69703 http://www.aAlfa Aesar
    8679 triphenylphosc1ccc(cc1)P(c 80 11283 http://www.aAlfa Aesar
    8680 triphenylphosc1ccc(cc1)P(= 156 12549 http://www.aAlfa Aesar
    8681 triphenylphosc1ccc(cc1)P(= 161 18610 http://www.aAlfa Aesar
    8682 triphenylsilan c1ccc(cc1)[Si 43 63117 http://www.aAlfa Aesar
    8683 triphenylsilan c1ccc(cc1)[Si] 152 63119 http://www.aAlfa Aesar
    8684 triphosgene C(=O)(OC(Cl)(C 84 85216 http://www.aAlfa Aesar
    8685 tris(2,6-dime COc1cccc(c1P 146 2016345 http://www.aAlfa Aesar
    8686 tris(2-cyanoe C(CP(CCC#N) 98 70043 http://www.aAlfa Aesar
    8687 tris(2-methox COc1ccccc1P( 200 70829 http://www.aAlfa Aesar
    8688 tris(2-thienyl c1cc(sc1)P(c2 29 81602 http://www.aAlfa Aesar
    8689 tris(3-chloro c1cc(cc(c1)Cl) 65 108504 http://www.aAlfa Aesar
    8690 tris(3-fluoro c1cc(cc(c1)P(c 62 124361 http://www.aAlfa Aesar
    8691 tris(3-methox COc1cccc(c1)P 114 124864 http://www.aAlfa Aesar
    8692 tris(4-chloro c1cc(ccc1P(c2c 103 64037 http://www.aAlfa Aesar
    8693 tris(4-fluoro c1cc(ccc1F)P(c 80 123812 http://www.aAlfa Aesar
    8694 tris(4-methox COc1ccc(cc1)P 131 63260 http://www.aAlfa Aesar
    8695 tris(hydroxy C(C(CO)(CO)N 172 6257 http://www.aAlfa Aesar
    8696 tris(pentaflu B(c1c(c(c(c(c1 128 505917 http://www.aAlfa Aesar
    8697 tris(pentaflu c1(c(c(c(c(c1F 117 92214 http://www.aAlfa Aesar
    8698 tris(trimethylsB(O[Si](C)(C)C -35 70402 http://www.aAlfa Aesar
    8699 tris(trimethyl C[Si](C)(C)P([S 24 239909 http://www.aAlfa Aesar
    8700 tris[3,5-bis(t c1c(cc(cc1C(F) 100 2058298 http://www.aAlfa Aesar
    8701 tris[4-(triflu c1cc(ccc1C(F)( 74 122973 http://www.aAlfa Aesar
    8702 tri-tert-butyl CC(C)(C)P(C(C) 30 75504 http://www.aAlfa Aesar
    8703 tritylamine c1ccc(cc1)C(c 102 122216 http://www.aAlfa Aesar
    8704 tropine CN1[C@@H]2C 63 10180559 http://www.aAlfa Aesar
    8705 tropinone CN1[C@@H]2C 42 393722 http://www.aAlfa Aesar
    8706 tropolone c1ccc(c(=O)cc 53 10333 http://www.aAlfa Aesar
    8707 tryptamine c1ccc2c(c1)c( 114 1118 http://www.aAlfa Aesar
    8708 tryptophol c1ccc2c(c1)c( 58 10235 http://www.aAlfa Aesar
    8709 undecanal CCCCCCCCCCC -2 7894 http://www.aAlfa Aesar
    8710 undecanoic acCCCCCCCCCCC 28 7888 http://www.aAlfa Aesar
    8711 uracil c1c[nH]c(=O) 330 1141 http://www.aAlfa Aesar
    8712 urea C(=O)(N)N 134 1143 http://www.aAlfa Aesar
    8713 uridine c1cn(c(=O)[ 168 5807 http://www.aAlfa Aesar
    8714 ursodeoxycholC[C@H](CCC( 203 29131 http://www.aAlfa Aesar
    8715 valeraldehydeCCCCC=O -92 7772 http://www.aAlfa Aesar
    8716 valeramide CCCCC(=O)N 103 11795 http://www.aAlfa Aesar
    8717 valeric acid CCCCC(=O)O -34 7701 http://www.aAlfa Aesar
    8718 valeric acid h CCCCC(=O)NN 60 84145 http://www.aAlfa Aesar
    8719 valeronitrile CCCCC#N -96 7770 http://www.aAlfa Aesar
    8720 valerophenonCCCCC(=O)c1c -9 59482 http://www.aAlfa Aesar
    8721 valeryl chlori CCCCC(=O)Cl -110 55132 http://www.aAlfa Aesar
    8722 vanillic acid COc1cc(ccc1O 214 8155 http://www.aAlfa Aesar
    8723 vanillic acid h COc1cc(ccc1O 211 411714 http://www.aAlfa Aesar
    8724 vanillin COc1cc(ccc1O 82 13860434 http://www.aAlfa Aesar
    8725 veratraldehydCOc1ccc(cc1O 44 21106008 http://www.aAlfa Aesar
    8726 veratrole COc1ccccc1O 22 13861009 http://www.aAlfa Aesar
    8727 vinyl acetate CC(=O)OC=C -100 7616 http://www.aAlfa Aesar
    8728 vinyl propionaCCC(=O)OC=C -80 7464 http://www.aAlfa Aesar
    8729 vinylacetic aciC=CCC(=O)O -39 30349 http://www.aAlfa Aesar
    8730 vinylene carb C(=C/OC(=O)[ 21 19953927 http://www.aAlfa Aesar
    8731 vinyltrichlorosC=C[Si](Cl)(Cl) -95 6173 http://www.aAlfa Aesar
    8732 vinyltrimethylC[Si](C)(C)C=C -132 71433 http://www.aAlfa Aesar
    8733 vitamin d3 C[C@H](CCCC 85 4444353 http://www.aAlfa Aesar
    8734 vitamin e acetCc1c(c(c(c2c -28 77987 http://www.aAlfa Aesar
    8735 vitamin k1 CC1=C(C(=O)c -20 4447652 http://www.aAlfa Aesar
    8736 xanthene-9-c c1ccc2c(c1)C( 245 633522 http://www.aAlfa Aesar
    8737 xanthone c1ccc2c(c1)c( 176 6753 http://www.aAlfa Aesar
    8738 xanthydrol c1ccc2c(c1)C( 124 65693 http://www.aAlfa Aesar
    8739 xylitol C([C@H]([C@ 94 6646 http://www.aAlfa Aesar
    8740 acebutolol CCCC(=O)Nc1c 119 1901 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8741 acecarbromal CCC(Br)(CC)C 109 6244 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8742 aceclofenac OC(=O)COC(=O 149 64809 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8743 acedapsone CC(=O)Nc1ccc( 289 6232 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8744 acediasulfoneNc1ccc(cc1)S( 194 59823 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8745 aceglutamide CC(=O)NC(CCC 197 23836 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8746 acemetacin COc3ccc2n(C(= 150 1904 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8747 acetaminopheCC(=O)Nc1ccc 169 1906 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8748 acetaminosaloCC(=O)Nc2ccc 187 1907 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8749 acetorphan CC(=O)SCC(Cc 89 96913 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8750 acetylphenetuCCC(C(=O)NC( 100 1922 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8751 acetylsalicylic CC(=O)Oc1ccc 142 2157 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8752 acyclovir Nc2nc1n(COCC 255 1945 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8753 acifran CC1(OC(=CC1= 176 46712 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8754 acitretin COc1cc(C)c(C 228 4447573 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8755 adrafinil ONC(=O)CS(=O 159 2297976 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8756 ahistan CN(C)CC(=O)N 144 62079 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8757 albendazole CCCSc2ccc1[n 208 1998 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8758 albutoin CC(C)CC1NC(= 210 2297355 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8759 alclofenac OC(=O)Cc1ccc 92 28714 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8760 alibendol COc1cc(CC=C) 95 64927 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8761 alizapiride COc2cc1[nH] 139 39202 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8762 alpidem CCCN(CCC)C(=O 140 49570 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8763 amidephrine CNCC(O)c1ccc 159 14288 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8764 aminorex NC1=NCC(O1)c 136 15767 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8765 amisometradiCC(=C)Cn1c(N 175 10600 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8766 amphotalide Nc3ccc(OCCCC 113 64830 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8767 anileridine CCOC(=O)C2(C 83 8600 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8768 antazoline C3CN=C(CN(Cc 120 2115 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8769 arprinocid Nc2ncnc3n(Cc1 245 37936 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8770 atenolol CC(C)NCC(O)C 146 2162 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8771 atropine CN1C2CCC1CC( 114 3534 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8772 azacyclonol OC(C1CCNCC1) 160 14952 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8773 bamipine CN1CCC(CC1)N 114 65061 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8774 benactyzin CCN(CC)CCOC( 51 8966 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8775 benperidol Fc1ccc(cc1)C 170 15521 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8776 benzarone CCc2oc1ccccc 124 224468 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8777 benzoic acid OC(=O)c1cccc 122 238 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8778 benzydamine CN(C)CCCOc2n 160 12036 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8779 bezafibrate CC(C)(Oc2ccc( 186 35728 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8780 bufexamac CCCCOc1ccc(C 153 2372 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8781 bupivacaine CCCCN1CCCCC1 107 2380 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8782 buprenorphinCOC12CCC3(CC 209 2382 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8783 buramate OCCOC(=O)NC 40 19566 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8784 butalbital CC(C)CC1(CC= 138 2387 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8785 capobenicacidCOc1cc(cc(OC 121 28425 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8786 carbamazepinNC(=O)N2c1cc 190 2457 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8787 carbaryl CNC(=O)Oc1cc 142 5899 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8788 carbutamide CCCCNC(=O)NS 144 9189 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8789 carisoprodol CCCC(C)(COC( 92 2478 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8790 caroxazone NC(=O)CN2Cc 203 27057 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8791 celiprolol CCN(CC)C(=O) 110 2563 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8792 chlophedianolCN(C)CCC(O)(c 120 2693 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8793 chlorazanil Nc2ncnc(Nc1cc 233 9946 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8794 chloroquine CCN(CC)CCCC( 87 2618 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8795 cimetidine CNC(NCCSCc1 141 2654 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8796 ciprofloxacin OC(=O)c4cn(C 266 2662 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8797 clebopride COc1cc(N)c(C 194 2678 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8798 clometacin COc3ccc2c(C(= 242 30657 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8799 clonidine Clc1cccc(Cl) 130 2701 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8800 cloranolol CC(C)(C)NCC(O 82 59229 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8801 clotrimazole Clc1ccccc1C(c 147 2710 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8802 dapiprazole Cc1ccccc1N2 158 2298190 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8803 delavirdine CC(C)Nc1cccn 226 5423 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8804 detomidine Cc2cccc(Cc1c[ 114 50586 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8805 dextromoramiCC(CN1CCOCC1 180 9269 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8806 diaveridine COc2ccc(Cc1c 233 20162 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8807 dibenzepin CN(C)CCN2C(= 116 9048 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8808 difenpiramideO=C(Cc1ccc(cc 122 90781 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8809 diphemethoxiOCCN1CCCCC1C 106 59048 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8810 econazole Clc3ccc(COC(C 87 3086 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8811 erdosteine OC(=O)CSCC( 156 59073 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8812 erythromycin CCC3OC(=O)C( 135 3140 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8813 ethinylestradiCC34CCC1C(CC 141 3170 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8814 etisazol CCNc1nsc2ccc 78 65065 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8815 famotidine NC(N)=Nc1nc( 163 3208 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8816 febantel COCC(=O)Nc2c 129 4514715 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8817 felbamate NC(=O)OCC(CO 151 3214 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8818 felodipine CCOC(=O)C1=C 145 3216 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8819 fenpiprane C1CCN(CC1)CC 41 171191 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8820 florfenicol CS(=O)(=O)c1c 153 4372750 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8821 fluanisone COc1ccccc1N3 68 14410 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8822 flumequine CC1CCc2cc(F) 253 3257 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8823 flumetramideFC(F)(F)c1ccc 116 21983 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8824 flupirtine CCOC(=O)Nc2c 114 48119 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8825 flutoprazepa Fc1ccccc1C3= 118 3283 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8826 furonazide CC(=NNC(=O)c 199 4655810 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8827 gemfibrozil Cc1ccc(C)c(OC 61 3345 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8828 glisoxepid Cc1cc(no1)C( 189 30380 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8829 glyburide COc1ccc(Cl)c 169 3368 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8830 glymidine COCCOc2cnc(N 152 9190 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8831 griseofulvin COC1=CC(=O)C 219 3392 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8832 guanoxan NC(=N)NCC2C 164 15704 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8833 haloperidol OC2(CCN(CCCC( 148 3438 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8834 haloxazolam Fc1ccccc1C23 185 3442 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8835 hydrochlorothNS(=O)(=O)c2 267 3513 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8836 hydrocortisonCC13CCC(=O)C 223 3514 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8837 hydroflumethiNS(=O)(=O)c2 272 3521 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8838 ibafloxacin c1(c(c3c2c(c1 269 64324 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8839 ibuprofen CC(C)Cc1ccc(c 75 3544 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8840 ifenprodil CC(C(O)c1ccc 114 3561 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8841 indoramin O=C(NC1CCN(C 208 31014 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8842 irbesartan CCCCC2=NC1(C 180 3618 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8843 isoniazid NNC(=O)c1ccn 171 3635 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8844 isoxsuprine CC(COc1ccccc1 103 3651 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8845 ketobemidon CCC(=O)C1(CC 156 9697 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8846 ketoprofen CC(C(O)=O)c1c 94 3693 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8847 letosteine CCOC(=O)CSC 142 61958 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8848 letrozole N#Cc1ccc(cc1) 181 3765 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8849 lofexidine CC(Oc1c(Cl)c 126 28460 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8850 lorazepam OC3N=C(c1ccc 166 3821 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8851 lotrifen Clc1ccc(cc1)c 238 62098 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8852 medmain CCc1c(C)[nH]c 100 215737 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8853 melengestrolaCC(=O)OC3(C( 224 17024 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8854 mepiprazole Cc3cc(CCN1CC 106 64909 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8855 metaproterenCC(C)NCC(O)c1 100 3944 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8856 methallatal C1(=O)C(CC)( 160 2297301 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8857 metizoline Cc2sc1ccccc1 156 26683 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8858 metoclopramiCCN(CC)CCNC( 147 4024 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8859 metopimazineCS(=O)(=O)c4 170 24584 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8860 modafinil NC(=O)CS(=O)C 164 4088 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8861 molindone CCc2c(C)[nH] 180 22342 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8862 moperone Cc1ccc(cc1)C3 118 4100 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8863 morazone CC1C(OCCN1Cc 149 36216 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8864 moxaverine CCc3cc1cc(OC) 78 64045 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8865 moxestrol COC3CC1(C)C( 280 2621342 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8866 nadolol CC(C)(C)NCC( 124 4258 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8867 naproxen COc2ccc1cc(c 152 1262 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8868 novonal CCC(CC)(CC=C 75 62078 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8869 noxythiolin OCNC(=S)NC 88 4418329 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8870 omeprazole COc2ccc1[nH]c 156 4433 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8871 orotic acid OC(=O)c1cc(= 345 942 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8872 oxazepam OC3N=C(c1ccc 205 4455 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8873 oxibendazole CCCOc2ccc1[n 230 4461 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8874 pentifylline OC4CCN(CCCN2 82 4585 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8875 perphenazineOCCN4CCN(CCC 94 4586 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8876 phenallymal C=CCC1(C(=O) 156 7975 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8877 phencarbamidCCN(CC)CCSC( 48 5786 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8878 phenindamineCN1CCC3=C(C1 91 10817 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8879 phenocoll CCOc1ccc(NC( 101 60263 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8880 phenopyrazonO=C1NN(C(=O) 233 83912 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8881 pindolol CC(C)NCC(O)C 170 4662 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8882 piperidione CCC1(CC)C(= 102 6222 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8883 pipobroman BrCCC(=O)N1C 106 4676 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8884 piposulfan CS(=O)(=O)OC 175 16513 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8885 piprozolin CCOC(=O)C=C 86 4744588 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8886 piroxicam CN2C(=C(O)c1 198 10442653 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8887 pirozadil COc1cc(cc(OC 119 61962 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8888 praziquantel O=C1CN(CC2N 136 4722 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8889 prazosin COc2cc1nc(nc 285 4724 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8890 pridinol OC(CCN1CCCCC 120 4735 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8891 promethazineCC(CN2c1cccc 60 4758 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8892 propallylonal CC(C)C1(CC(B 177 10554 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8893 propoxypheneCCC(=O)OC(Cc1 75 14592 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8894 propranolol CC(C)NCC(O)C 162 4777 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8895 pyrazinamide NC(=O)c1cncc 189 1017 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8896 ranitidine CNC(NCCSCc1c 69 571454 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8897 salicylic acid OC(=O)c1cccc 157 331 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8898 seratrodast CC1=C(C)C(=O 128 2355 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8899 sertaconazoleClc4ccc(C(Cn1 146 59273 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8900 spiperone Fc1ccc(cc1)C 190 5075 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8901 succisulfone Nc1ccc(cc1)S 157 61645 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8902 sulfamerazineCc2ccnc(NS(=O 234 5134 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8903 sulpiride CCN1CCCC1CNC 178 5162 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8904 tamoxifen CCC(=C(c1cccc 96 2297519 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8905 taurolidine O=S1(=O)CCN 154 27486 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8906 theophylline Cn2c(=O)n(C) 270 2068 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8907 thialbarbital C=CCC2(C1CC 148 2297316 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8908 thozalinone CN(C)C1=NC(= 133 12082 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8909 tolrestat COc2ccc1c(ccc 164 48194 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8910 toremifene CN(C)CCOc1ccc 108 5020279 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8911 tropicamide CCN(Cc1ccncc 96 5391 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8912 tyramine NCCc1ccc(O)c 164 5408 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8913 urapidil COc1ccccc1N3 156 5437 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8914 valsartan CCCCC(=O)N(C 116 5448 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8915 velnacrine Nc2c1C(O)CCC 245 3528 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8916 vinylbital CCCC(C)C1(C= 90 65109 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8917 warfarin CC(=O)CC(c1c 161 10442445 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8918 xibenolol Cc1cccc(OCC( 57 129009 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8919 zafirlukast COc1cc(ccc1C 138 5515 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8920 zipeprol COC(CN1CCN(C 83 33868 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8921 zomepirac Cc1cc(CC(O)=O 178 5531 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8922 zopolrestat OC(=O)Cc3nn(C 197 1554 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8923 zoxazolamine Nc2nc1cc(Cl)c 184 5878 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8924 acefylline Cn2c(=O)n(C) 271 62754 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8925 acetohexamidCC(=O)c1ccc( 188 1912 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8926 amobarbital CCC1(CCC(C)C 156 2079 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8927 amphenidoneNc1cccc(c1)n 183 8320 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8928 amphetaminilCC(Cc1ccccc1 85 26613 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8929 apazone CCCC1C(=O)N3 228 24310 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8930 astemizole COc5ccc(CCN1 149 2160 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8931 bamethan CCCCNCC(O)c1 124 2204 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8932 benzetimide O=C3CCC(C1CC 156 20533 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8933 bucetin CCOc1ccc(NC( 160 13507 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8934 cetoxime NC(CN(Cc1ccc 107 7844837 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8935 dimecroticaci COc1ccc(C(C) 149 4938943 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8936 doxofylline Cn3c(=O)n(C) 144 46175 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8937 erythrocentauc1cc(C=O)c2C 140 165975 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8938 ethopropazin CCN(CC)C(C)C 53 3174 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8939 fadrozole N#Cc1ccc(cc1 117 53850 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8940 fentanyl CCC(=O)N(C1C 83 3228 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8941 fexofenadine CC(C)(C(O)=O) 142 3231 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8942 flurbiprofen CC(C(O)=O)c1c 110 3277 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8943 fosfosal OC(=O)c1cccc 168 3300 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8944 glibornuride Cc1ccc(cc1)S 192 31034 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8945 halazepam FC(F)(F)CN2C( 164 29343 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8946 heptabarbital CCC1(C(=O)N 174 10081 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8947 hycanthone CCN(CC)CCNc2 101 3508 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8948 hymecromoneCC1CCc2c(C)c( 194 64324 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8949 ipriflavone CC(C)Oc2ccc1c 115 3616 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8950 ipsapirone O=C3N(CCCCN1 137 51365 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8951 isbogrel OC(=O)CCCCC= 114 5020506 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8952 isosorbide OC1COC2C(O) 61 90294 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8953 ketoconazole CC(=O)N1CCN( 146 3691 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8954 lidoflazine Cc1cccc(C)c1N 159 3789 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8955 limaprost CCCCC(C)CC(O 97 10651127 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8956 lonidamine OC(=O)c2nn(Cc 207 36170 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8957 mafenide NCc1ccc(cc1) 151 3858 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8958 maprotiline CNCCCC13CCC( 92 3871 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8959 mebutamate CCC(C)C(C)(C 77 5919 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8960 mecloqualoneCc2nc1ccccc1c 126 9192 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8961 mephenytoin CCC1(NC(=O)N 136 3920 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8962 mephobarbitaCCC1(C(=O)NC 176 7972 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8963 meprobamateCCCC(C)(COC( 104 3924 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8964 methdilazine CN1CCC(C1)CN 87 14009 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8965 methetoin CCC1(NC(=O)N 210 3920 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8966 metolazone CC2Nc1cc(Cl) 252 4026 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8967 metralindole COc4ccc3n1CC 164 61964 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8968 moricizine CCOC(=O)Nc4c 156 31872 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8969 morphazinamiO=C(NCN1CCO 119 63555 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8970 nabumetone COc2ccc1cc(C 80 4256 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8971 nomifensine CN3CC(c1cccc 179 4371 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8972 ondansetron Cc1nccn1CC2C 231 4434 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8973 oxaprozin OC(=O)CCc2nc( 161 4453 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8974 oxazolam CC3CN2CC(=O) 186 4456 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8975 pazufloxacin CC1COc2c(c(F 269 409216 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8976 penbutolol CC(C)(C)NCC( 68 4562 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8977 perciyazine N1(c2c(ccc(c 116 4585 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8978 phenadoxoneCCC(=O)C(CC( 75 9686 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8979 phenazopyridNc2ccc(N=Nc1 139 4592 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8980 phenytoin O=C1NC(=O)C( 295 1710 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8981 plafibride CC(C)(Oc1ccc 100 62056 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8982 primidone CCC1(C(=O)NC 281 4740 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8983 probenecid CCCN(CCC)S(= 198 4742 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8984 proglumide CCCN(CCC)C(= 142 4753 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8985 propizepine CC(CN2C(=O)c 122 100443 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8986 pyrinoline OC(C1=CC(C=C 147 2314542 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8987 salacetamide CC(=O)NC(=O) 148 9834 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8988 simetride CCCc3ccc(OCC 128 64690 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8989 skf105657 O=CC(=CC1=CC 257 0 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8990 sulthiame NS(=O)(=O)c1 180 5163 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8991 sumatriptan CNS(=O)(=O)C 169 5165 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8992 terbutaline CC(C)(C)NCC(O 119 5210 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8993 testosterone CC34CCC1C(C 153 5215 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8994 thenaldine CN1CCC(CC1)N 95 25957 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8995 tirofiban CCCCS(=O)(=O 223 5286 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8996 tolazamide Cc1ccc(cc1)S 170 5302 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8997 tolindate CN(C(=S)Oc2c 94 31384 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8998 torsemide CC(C)NC(=O)N 163 38123 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    8999 trimipramine CC(CN(C)C)CN 45 5382 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    9000 tulobuterol CC(C)(C)NCC(O 89 5404 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    9001 ubenimex CC(C)CC(NC(= 233 3125 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    9002 ujothion OC(=O)CN1CSC 152 64543 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    9003 ursodiol CC13CCC(O)CC 203 29131 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    9004 valnoctamide CCC(C)C(CC)C 114 18974 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    9005 vamicamide CC(CC(C(N)=O) 156 2290855 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    9006 verazide COc2ccc(C=NN 189 7848692 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    9007 vigabatrin NC(CCC(O)=O) 209 5463 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    9008 vinconate CCN1CCc3c2C1 120 62125 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    9009 ximoprofen CC(C(O)=O)c1 178 5020557 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    9010 xylometazolinCc1cc(cc(C)c 131 5507 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    9011 yohimbine COC(=O)C4C(O 234 2763 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    9012 zidovudine Cc2cn(C1CC(N 106 5524 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    9013 zileuton CC(N(O)C(N)= 157 54531 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    9014 zolimidine CS(=O)(=O)c1c 242 13985 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    9015 zotepine CN(C)CCOC2=C 90 5534 http://dx.doi Bergstrom C. A. S.; Norinder U.; Luthman K.; Artursson P. Molecular D
    9016 picric acid; 4 O=[N+]([O-])c 160 24783416 http://dx.doi Karthikeyan M.
    x mixture - AL
    9017 (4E)-4-[(2-hy O=C1N(N=C(C) 154 23921465 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9018 7,8-dihydro-6 O=C1N=NC(=O 310 23873929 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9019 diethyl 3,5-di O=C(OC1=C2C 178 23873922 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9020 [2-[4-(3-acetoO=[N+]([O-]) 280 23873921 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9021 2-[4-(3-hydroxO=[N+]([O-]) 360 23873920 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9022 3-phenyl-2-(3 N1=C2C=CC=C 227 23873919 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9023 diethyl 2,6-di O=C(OCC)C1= 342 23873916 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9024 (2Z)-2-(1,3-Bes1c2ccccc2[n 159 23498517 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9025 [3-amino-3-(s s1cc([nH0]c1N 163 21896663 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9026 2-[N-(2,4-din O=[N+]([O-])c 259 21540471 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9027 ethyl 2,2-dib O=C(OCC)C(Cc 58 21522653 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9028 (3Z)-3-[[(6-c Clc1ccc2[nH0 147 21506073 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9029 2-[(E)-2-(1,3- s1c2ccccc2[n 170 21505808 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9030 4-hydroxy-8-mO=C1Nc2c(C)c 242 21217540 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9031 (E)-1-(4-MethO(C)c1ccc(N= 53 21169898 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9032 1,4-bis(brom BrCc1ccc(cc1) 142 21125563 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9033 1,4-PhenanthrO=C1C2=C(C(= 174 19974852 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9034 3,5-dimethyl- N1=NC(C)=CC 108 19745458 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9035 4-hydroxy-2-m[S+2]1([O-])( 198 19603632 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9036 (3E)-N-hydroxON=C1c2ccccc 260 18311760 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9037 3-(4-Hydroxy-ps1cc([nH0]c1C 186 17754733 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9038 (3E)-4-amino-O=C(C)C(=CN) 97 15191789 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9039 2,5-Dichloro- Clc1cc(C)c(Cl) 70 13868642 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9040 nitrophenol O=[N+]([O-])c 45 13837787 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9041 androstan-3-on
    ON=C1CCC2(C) 199 13703682 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9042 (8xi,9xi,10xi, [I-].O=C(C[n 240 12985792 http://dx.doi Karthikeyan M.
    x salt - AL
    9043 2-[(E)-{[3-Sul Sc1[nH0][nH0] 156 12223221 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9044 (2E)-7-{3-hyd O=C1CC(O)C(C 97 10651127 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9045 4-[(hydroxyimON=C(c1ccccc 78 10484597 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9046 4-imino-1-metN=C1N(N)C=Nc 185 10484595 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9047 3-imino-2-(1H-O=C1N(C(=N)c 254 10484563 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9048 1-(4-chlorophClc1ccc([nH0 178 10484545 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9049 4-amino-1-(2-OCC[nH0]1[nH 308 10484540 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9050 methyl (1E,2ES(C)C(N)=C(C# 177 10484456 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9051 ethyl (2E)-3- S=C(N)C(=C1O 128 10484455 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9052 (4aR,5E,20E,2O=C1OC(=O)N 254 10484445 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9053 9-(4-bromoben
    Brc1ccc(cc1) 230 10484437 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9054 ethyl 4-(4-br Brc1ccc(cc1) 192 10484434 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9055 4-(4-bromophe
    Brc1ccc(cc1) 254 10484433 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9056 (1R,4S,5S)-4-cClC1C2OC(CC2 72 10484402 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9057 N'-(4-hydroxyO=C(NN=Cc1cc 230 10484353 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9058 ethyl 5-imino-S1C2=NC=C(C( 198 10484309 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9059 N-[(E)-phenyl N(=Cc1ccccc1 103 10484306 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9060 3-[(aminosulf S(N)CC1=Cc2c 165 10484276 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9061 2-Imino-2H-chO1C(=N)C(C#N 200 10484275 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9062 4-hydroxy-8-mO=C1Nc2c(C)c 113 10484210 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9063 4-hydroxy-8-mO=C1Nc2c(C)c 171 10484209 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9064 4-hydroxy-3-{ O=C1N(C)c2cc 285 10484207 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9065 4-hydroxy-1-mO=C1N(C)c2cc 249 10484206 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9066 4-hydroxy-1-mO=C1N(C)c2cc 238 10484205 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9067 4-hydroxy-3-[ O=C1N(C)c2cc 254 10484203 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9068 4-hydroxy-3-[ O=C1N(C)c2cc 266 10484202 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9069 4-hydroxy-3-[ O=C1N(C)c2cc 250 10484201 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9070 4-hydroxy-1-mO=C1N(C)c2cc 196 10484200 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9071 4-hydroxy-3-[ O=C1N(C)c2cc 290 10484199 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9072 4-hydroxy-3-[ O=C1N(C)c2cc 240 10484198 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9073 4-hydroxy-1-mO=[N+]([O-]) 261 10484195 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9074 3-[(4Z)-4-(2, Clc1ccc(C=C2 280 10484193 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9075 3-[(4Z)-4-{(2Z ClC(=CC)C(=C 260 10484192 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9076 3-[(4Z)-4-(3- Clc1cccc(c1) 265 10484191 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9077 4-hydroxy-1-mO=C1N(C)c2cc 280 10484189 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9078 3-{(4Z)-4-[4- O=C1N(C)c2cc 262 10484188 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9079 3-[(4Z)-4-(1, O=C1N(C)c2cc 265 10484187 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9080 3-[(4Z)-4-ben O=C1N(C)c2cc 283 10484186 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9081 4-hydroxy-1-mO=C1N(C)c2cc 287 10484185 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9082 1-ethyl-4-hyd O=C1N(CC)c2c 295 10484182 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9083 4-hydroxy-1-me
    O=C1N(C)c2cc 294 10484180 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9084 4-hydroxy-1-me
    O=C1N(C)c2cc 230 10484178 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9085 3-{(4Z)-4-[2- Brc1cc([N+]( 192 10484177 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9086 4-hydroxy-1-me
    O=C1N(C)c2cc 302 10484176 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9087 4-hydroxy-1-me
    s1cc[nH0]c1N 301 10484175 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9088 3-{(4Z)-4-[2- O=C1N(C)c2cc 200 10484174 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9089 4-hydroxy-3-{ Ic1ccc(NN=C2 262 10484173 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9090 3-{(4Z)-4-[2- Brc1ccc(NN=C 260 10484172 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9091 3-{(4Z)-4-[2- Brc1cccc(NN= 240 10484171 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9092 3-{(4Z)-4-[2- Brc1ccccc1NN 270 10484170 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9093 3-{(4Z)-4-[2- Clc1ccc(Cl)c 284 10484169 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9094 3-{(4Z)-4-[2- Clc1ccc(NN=C 240 10484168 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9095 3-{(4Z)-4-[2- Clc1cccc(NN= 222 10484167 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9096 3-{(4Z)-4-[2- Clc1ccccc1NN 264 10484166 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9097 4-hydroxy-1-mO=[N+]([O-]) 300 10484165 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9098 4-hydroxy-1-mO=C1N(C)c2cc 218 10484164 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9099 4-hydroxy-1-mO=C1N(C)c2cc 213 10484163 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9100 4-hydroxy-3-[ O=C1N(C)c2cc 297 10484162 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9101 4-hydroxy-1-mO=C1N(C)c2cc 292 10484161 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9102 3-[4-(9H-fluo O=C1N(C)c2cc 295 10484160 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9103 4-hydroxy-1-mO=C1N(C)c2cc 279 10484156 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9104 4-hydroxy-1-mO=C1N(C)c2cc 292 10484155 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9105 4-hydroxy-1-ms1cc[nH0]c1N 248 10484153 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9106 3-[(4Z)-4-{[( O=C1N(C)c2cc 175 10484152 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9107 4-hydroxy-1-mO=C1N(C)c2cc 279 10484151 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9108 (5E,6E)-5-eth O=C1N(C)C(=C 238 10484150 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9109 4-hydroxy-1-mO=C1N(C)c2cc 281 10484149 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9110 4-hydroxy-1-mO=C1N(C)c2cc 235 10484148 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9111 3-[(4Z)-4-{[( Brc1ccc(NC=C 293 10484146 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9112 3-[(4Z)-4-{[( Clc1ccc(NC=C 290 10484145 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9113 4-hydroxy-3-[ O=C1N(C)c2cc 281 10484144 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9114 4-hydroxy-1-mO=C1N(C)c2cc 264 10484143 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9115 4-hydroxy-1-mO=C1N(C)c2cc 288 10484142 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9116 4-hydroxy-1-mO=C1N(C)c2cc 282 10484141 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9117 4-hydroxy-1-mO=C1N(C)c2cc 272 10484140 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9118 (methanolato)[Hg](OC)c1c(C 158 10484121 http://dx.doi Karthikeyan M.
    x metal - AL
    9119 methanethione
    S=C(N1CCCCC1 123 10484032 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9120 11,11'-PiperazClc1ccc2Nc3c 334 10484031 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9121 (2E)-{5-[(E)-( Brc1ccc(N=Nc 242 10484012 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9122 (2E)-[2-(4-flu s1c(N=Nc2ccc 215 10484011 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9123 (2Z)-[2-(2,5-d s1c(N=Nc2ccc 202 10484010 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9124 (2E)-{4-methyls1c(N=Nc2ccc 211 10484009 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9125 (2E)-[2-(4-mets1c(N=Nc2ccc 179 10484008 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9126 (2E)-[2-(4-chl Clc1ccc(NN=C( 226 10484007 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9127 (2E)-2-{5-[(E) Clc1ccc(N=Nc2 231 10484005 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9128 (2Z)-[2-(4-hyds1cc([nH0]c1 236 10483998 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9129 (2Z)-[2-(4-hyds1cc([nH0]c1C 253 10483997 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9130 2,5-diamino-7-S(C)C=1[nH0]2 294 10483990 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9131 [5-imino-4-(4 S1C(=N)N(N=C 75 10483976 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9132 2-(4-chloropheClc1ccc(cc1)c 156 10483974 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9133 3-(1,3-benzot s1c2ccccc2[n 186 10483967 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9134 [5-imino-4-(pys1cccc1C(=O) 131 10483965 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9135 {5-imino-4-[3-s1cccc1C(=O)C 185 10483962 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9136 [5-imino-4-(2,Clc1cc(Cl)c(N 209 10483961 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9137 [5-imino-4-(4 s1cccc1C(=O) 164 10483960 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9138 (5-imino-4-phs1cccc1C(=O) 134 10483959 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9139 ethyl 5-(1,3-b s1c2ccccc2[n 148 10483947 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9140 (2E)-2-(1,3-b s1c2ccccc2[n 161 10483941 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9141 (2E)-2-(1,3-b s1c2ccccc2[n 210 10483935 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9142 (2E)-2-(1,3-bes1c2ccccc2[n 189 10483931 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9143 1-[4-(2,3-dimeS1C(=N)N(N=C 171 10483879 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9144 1-[5-imino-4-(S1C(=N)N(N=C 186 10483878 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9145 1-[4-(4-fluoro S1C(=N)N(N=C 199 10483877 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9146 4-{(E)-[2,5-di S(C)C=1[nH0] 306 10483862 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9147 2,5-diamino-3-S(C)C=1[nH0] 229 10483861 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9148 4-[(E)-(4-buty Oc1ccc(N=Nc2 49 10483830 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9149 (5R,10Z)-6,7, OC1CCCCC=Cc 97 10483712 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9150 1-hydroxy-3,4O=C1c2ccccc2 79 10483711 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9151 2,3-Dichloro- ClC1=C(Cl)C(= 198 10483704 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9152 4,4,9,9-Tetra O(C)C1(OC)CC 202 10483652 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9153 3,8-CyclodecaO=C1CC=CCC( 184 10483651 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9154 ethyl 2,6-dih O=C(OCC)c1c( 219 10483572 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9155 4-(2-hydroxy- Cl.Oc1c(OC)cc 249 10483554 http://dx.doi Karthikeyan M.
    x salt - AL
    9156 4-benzyl-7-met
    Cl.Oc1c(OC)cc 208 10483528 http://dx.doi Karthikeyan M.
    x salt - AL
    9157 4-benzyl-7-meOc1cc2c(c[nH 193 10483527 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9158 (6alpha,7alphO=C1C2=C(C(= 202 10483427 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9159 1-(3,5-ditert ON=C(C)c1cc(c 201 10483386 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9160 2,2'-(E)-diaze Oc1c(N=Nc2cc( 247 10483328 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9161 N,N'-Diallyl-3 Oc1c(cc(cc1C( 202 10483327 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9162 3,5-di-tert-b Oc1c(cc(cc1C( 206 10483326 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9163 3,5-di-tert-b Oc1c(cc(cc1C( 281 10483325 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9164 3,5-Di-tert-b Oc1c(cc(cc1C( 131 10483324 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9165 3,5-di-tert-b Oc1c(cc(cc1C( 207 10483323 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9166 (cyclohexylam[I-].S(C)[C+]( 180 10483322 http://dx.doi Karthikeyan M.
    x salt - AL
    9167 3,5-Di-tert-b S=C(NC1CCCCC1 218 10483321 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9168 3,5-Di-tert-b S=C(NC1CCCCC1 228 10483321 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9169 3,5-Di-tert-b S=C(Nc1ccc(OC 129 10483320 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9170 3,5,N-Tri-ter S=C(NC(C)(C)C) 204 10483319 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9171 3,5-Di-tert-b S=C(Nc1ccccc1 258 10483318 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9172 3,5-Di-tert-b S=C(Nc1ccccc1 186 10483317 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9173 1-(1-bromo-2-BrC(=Cc1ccccc 175 10483310 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9174 1-(1-chloro-2 ClC(=Cc1ccccc 191 10483308 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9175 4-hydroxy-1-mS1c2ccccc2N= 224 10483159 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9176 (4E)-5,8,8-tri OC1=CC(=NNc2 182 10483069 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9177 3-bromo-4-hyd
    BrC1=C(O)C2C 188 10483068 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9178 4-hydroxy-1,8,O=C1C=C(O)C2 221 10483067 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9179 2-methyl-3-(3O=C(O)C(C)=C( 163 10483036 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9180 2,8-dinitrosonO=Nc1ccc2c(O 250 10482985 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9181 (4Z)-4-(hydro O=[N+]([O-]) 223 10482980 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9182 2-[(4,7,7-trim O=C1C(=CC(CC 118 10482917 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9183 (2Z)-2-[(3Z)- O=C(N)NN=C1C 206 10482893 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9184 N,N-dimethyl-N(Nc1ccccc1)= 128 10482887 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9185 4-[(3Z)-3-(hydON=C(C=Cc1cc 139 10482886 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9186 (E,Z)-(2-nitr O=[N+]([O-]) 176 10482803 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9187 N-{4-[(4-{[4- O=C(Nc1ccc(N= 328 10482748 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9188 N-{4-[(4-{[4- O=C(Nc1ccc(N= 317 10482747 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9189 4-({4-[(4-ami [O-][N+](=Nc1 247 10482746 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9190 1-methyl-2-(1[I-].O=C1c2cc 182 10482714 http://dx.doi Karthikeyan M.
    x salt - AL
    9191 1-(piperidin-1-Oc1c2ccccc2[ 185 10482713 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9192 (3Z)-N-hydroxy[O-][N+]=1c2 216 10482712 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9193 2-(pyridin-2-y O.OC1=C2C=C 166 10482710 http://dx.doi Karthikeyan M.
    x salt - AL
    9194 [(2E)-2-hydra NN=C(c1ccccc 218 10482709 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9195 [(2E)-2-hydra NN=C(c1ccccc 163 10482708 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9196 4,5-dibromo-1Brc1cccc2c1c( 171 10482707 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9197 2,2'-benzene-1O=C1c2ccc(C#N 360 10482703 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9198 3-nitro-4-[(Z) O=[N+]([O-]) 182 10482701 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9199 1-{2-[(Z)-2-(2 O=[N+]([O-])c 193 10482700 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9200 1-[(E)-1-chlor ClC(=Cc1cccc( 215 10482698 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9201 1-[(Z)-2-{3-[2 O=[N+]([O-])c 243 10482697 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9202 2,2'-benzene-1O=[N+]([O-])c 294 10482696 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9203 (2E,3E,2'E,3'Z ON=C(C)C=Cc1 280 10482625 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9204 N,N'-dihydroxON=C(Cc1cccc 193 10482610 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9205 dimethyl (2Z) O=C(OC)C=C(N 154 10482607 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9206 (1Z,3Z)-3-(hydO=[N+]([O-])c 164 10482598 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9207 4-hydroxy-3-{(O=C1N(c2cccc 267 10482477 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9208 N'-[(1E)-1-(4 O=C1N(c2cccc 289 10482475 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9209 N'-[(1E)-1-(4 O=C1N(c2cccc 218 10482473 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9210 3-{[(1E)-1-(4 O=C1N(c2cccc 243 10482470 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9211 4-hydroxy-3-[ O=C1N(c2cccc 219 10482468 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9212 4-{[(1E)-1-(4 O=C1N(c2cccc 237 10482467 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9213 2-hydroxy-4-{ O=C1N(c2cccc 177 10482466 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9214 2-imino-5-meth
    O=C1N(c2cccc 227 10482459 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9215 3-[(1E)-N-(2, O=C1N(c2cccc 218 10482458 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9216 4-hydroxy-1-ph
    O=C1N(c2cccc 220 10482457 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9217 4-hydroxy-3-[ O=C1N(c2cccc 232 10482455 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9218 7-methyl-5-phO=C1N(c2cccc 298 10482453 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9219 3-[(1E)-N-(3- O=C1N(c2cccc 200 10482451 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9220 4-hydroxy-3-[ O=C1N(c2cccc 140 10482446 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9221 4-hydroxy-3-[ O=C1N(c2cccc 179 10482444 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9222 4-hydroxy-1-pO=C1N(c2cccc 185 10482442 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9223 4-hydroxy-1-pO=C1N(c2cccc 222 10482440 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9224 4-hydroxy-3-[ O=C1N(c2cccc 269 10482438 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9225 4-hydroxy-3-[ O=C1N(c2cccc 252 10482435 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9226 4-hydroxy-3-[ O=C1N(c2cccc 202 10482434 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9227 3-[(1E)-N-ben O=C1N(c2cccc 164 10482432 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9228 3,5-dimethyl- O=C1N(c2cccc 273 10482429 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9229 3-[(1E)-N-(bu O=C1N(c2cccc 194 10482426 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9230 4-hydroxy-1-pO=C1N(c2cccc 191 10482425 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9231 5-methyl-7-phO=C1N(c2cccc 221 10482424 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9232 2-[3-(4-hydroxS1c2[nH0][nH 241 10482369 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9233 warfarin O=C1Oc2ccccc 161 10442445 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9234 (6beta)-6,12- O=C1C=2CC(O) 188 10387469 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9235 7-Acetylhorm O=C1C2=C(C(= 213 10356705 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9236 7alpha-12-HydO=C1C=2CCC3C 181 10356704 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9237 N-p-Tolyl-benO=C(Nc1ccc(C) 156 10274392 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9238 2-imino-2H-c S=C(N)C1=Cc2 254 10251674 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9239 p-HydroxybenON=Cc1ccc(O) 112 10229768 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9240 (6beta,7alphaO=C1C2=C(C(= 216 10219255 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9241 12-Hydroxy-abO=C1C=2C=CC3 167 10219252 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9242 7-Oxoroylean O=C1CC2C(C)( 198 10219251 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9243 PhenylessigsÃO=C(O)Cc1ccc 150 10181341 http://dx.doi Karthikeyan M.
    x clearly out of range JCB
    9244 3-Phenylprop O=C(O)CCc1cc 49 10181339 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9245 2,4,6-trinitro O=[N+]([O-])c 254 10153181 http://dx.doi Karthikeyan M.
    x mixture - AL
    9246 2,4,6-trinitro O=[N+]([O-])c 286 10153179 http://dx.doi Karthikeyan M.
    x mixture - AL
    9247 (1Z,5Z,7Z,11Z o1c2ccc1c1oc( 271 10122018 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9248 (3aR,7aS)-1,3 [S+2]1([O-])( 152 8187904 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9249 2-(3-Ethyl-4-oS1C(N(CC)C(= 86 8080006 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9250 (2E)-2-[(2Z)- O=C(N)NN=CC= 148 7963259 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9251 1-[(5Z)-5-[(2E S1C(=NN=Cc2c 179 7960752 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9252 (E)-N-hydroxyON=CC=1CCCC 163 7934350 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9253 (1E,2E)-bis[4 O(C)c1cc(ccc 216 7927675 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9254 (3Z)-3-[2-(4- O=[N+]([O-])c 174 7927621 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9255 benzaldehyde,O=[N+]([O-])c 166 7858651 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9256 (1E)-1-benzyl O=[N+]([O-])c 196 7855695 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9257 ethyl [4-cyan O(C=Nc1[nH0] 155 7855694 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9258 (2E)-2-[1-(py O=C(N)NN=C(C 218 7855693 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9259 diethyl (6R,12Clc1ccc2O[P+] 257 7855686 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9260 diethyl (6R,1 Brc1ccc2O[P+] 273 7855685 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9261 diethyl (6R,1 [P+]1([O-])( 218 7855684 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9262 ethyl (1Z,2Z) I.S(CC)C(=NNc 198 7855669 http://dx.doi Karthikeyan M.
    x salt - AL
    9263 4-nitrobenzyl Br.S(Cc1ccc([ 93 7855668 http://dx.doi Karthikeyan M.
    x salt - AL
    9264 methyl (1Z,2ZI.S(C)C(=NN) 120 7855667 http://dx.doi Karthikeyan M.
    x salt - AL
    9265 2,2'-(piperazi S=C1N(N=C(N1 187 7855664 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9266 (2E)-2-{1-[(5 O=C(N)NN=C(C 239 7855620 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9267 N'~1~,N'~2~-bO=C(NN=Cc1cc 302 7855618 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9268 (2Z)-[2-(2,4-d Clc1ccc(NN=C( 212 7855608 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9269 (2Z)-[2-(2-nit s1cc([nH0]c1C 211 7855606 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9270 (2Z)-[2-(2-chl Clc1ccccc1NN= 160 7855603 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9271 {(5E)-5-[(2E) S1C(=NN=Cc2o 114 7855602 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9272 (4-chloropheny
    Clc1ccc(cc1)C 151 7855601 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9273 {(5E)-5-[(2E) Clc1ccccc1C= 182 7855600 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9274 (2E)-2-(1,3-b s1c2ccccc2[n 213 7855589 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9275 ethyl (2Z)-2-[ FC(F)(F)C(=O) 139 7855588 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9276 (4Z)-2-phenyl-FC(F)(F)C1=NN 280 7855583 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9277 N-[(E)-(4-chlo Clc1ccc(cc1) 234 7855580 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9278 N-[(E)-(4-methFC(F)(F)C1N= 208 7855578 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9279 N-[(E)-(4-met FC(F)(F)C1N= 172 7855577 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9280 (3E)-1,1,1-tri FC(F)(F)C(=O) 206 7855576 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9281 (2E)-1-(2,4-di O=[N+]([O-]) 194 7855540 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9282 (2E)-1-(2,4-di O=[N+]([O-])c 199 7855539 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9283 (2E)-1-(2,4-di O=[N+]([O-])c 206 7855538 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9284 (2E)-1-(2,4-di O=[N+]([O-])c 171 7855537 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9285 (2E)-1-(2,4-di O=[N+]([O-])c 221 7855536 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9286 (2E)-1-(2,4-di O=[N+]([O-]) 153 7855535 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9287 (2E)-1-(2,4-di O=[N+]([O-]) 199 7855534 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9288 (2E)-1-(2,4-di O=[N+]([O-]) 190 7855533 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9289 (2E)-1-(2,4-di O=[N+]([O-]) 163 7855532 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9290 (2E)-1-(2,4-di O=[N+]([O-]) 262 7855532 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9291 (1E,3E)-3-[(b O=C(ON=C(C)C 232 7855524 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9292 benzaldehyde,O=[N+]([O-])c 123 7855518 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9293 (2E)-2-[4-(4- O=C(N)NN=C(C 146 7855503 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9294 (1E)-N-hydroxyON=C(C)C1CC2 96 7855502 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9295 (2E)-2-[1-(4,7 O=C(N)NN=C(C 236 7855501 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9296 (1E)-N-hydroxyON=C(CC)C1CC 93 7855500 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9297 (2E)-2-[1-(4,7 O=C(N)NN=C(C 222 7855499 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9298 (2E,4E)-N,N'-dON=C1CC(=NO 209 7855496 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9299 (2E)-N-hydroxyON=C1C=CC2C 146 7855495 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9300 3-{(E)-carboxyO=[N+]([O-])c 191 7855494 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9301 (2E)-1-(2,4-di O=[N+]([O-])c 233 7855492 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9302 (2E)-N-hydroxON=C1C=C(OC) 185 7855491 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9303 (3E)-3-(hydroxO=C1C(=NO)C( 109 7855490 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9304 (2E)-2-[(2Z)- O=C(N)NN=C( 245 7855487 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9305 (2E)-2-[(1E)- O=C(N)NN=CC 255 7855486 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9306 (2E)-2-[(1S,4 O=C(N)NN=C1 174 7855481 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9307 5-[(E)-(2-car O=C(N)NN=CC( 152 7855472 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9308 2-[(E)-(hydro O=C1C(C=NO)= 146 7855471 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9309 (2E)-2-{[2-me O=C1C(C=NNC( 222 7855470 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9310 (2E)-2-(4-met O=C(N)NN=C(C 112 7855468 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9311 4-[(3Z)-1-(hy ON=C(CC(NO)c 179 7855453 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9312 (1E)-1-{2-nit O=[N+]([O-]) 185 7855444 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9313 (2E)-1-(1,2-d O=C(c1ccc2CC 200 7855435 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9314 (1E)-1-(1,2-d ON=C(Cc1cccc 138 7855433 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9315 (1E)-N-hydroxON=C(Cc1cccc 129 7855431 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9316 (1E)-N-hydroxON=C(Cc1cccc 150 7855430 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9317 1-Amino-2-[(EO=C1c2ccccc2 210 7855424 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9318 3-methyl-2-{(1O=[N+]([O-])c 271 7855423 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9319 3-methyl-2-[( [nH0]1c(C)c([ 209 7855422 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9320 (2E)-2-[4-(2- O=C(N)NN=C(C 128 7855421 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9321 1,2,3,4-tetra Clc1c(Cl)c(Cl 235 7855404 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9322 ethyl (2Z)-[5- O=[N+]([O-])c 155 7855401 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9323 Cetoxime ON=C(N)CN(Cc 107 7844837 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9324 (2E)-2-(hydro O=C(O)C(=NO) 159 7843938 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9325 2,2'-(piperazi S=C1N(N=C(N1 156 7843307 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9326 N-[(E)-(4-chl Clc1ccc(cc1) 155 7843306 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9327 (2E)-2-[(5-br Brc1cccc2c(c 258 7843275 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9328 ethyl (2E)-2-[ O=[N+]([O-]) 74 7842731 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9329 4-ChlorbenzalClc1ccc(cc1)C 311 7841190 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9330 Naphthalene-ON=Cc1ccc2cc 169 7839216 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9331 (E)-N-hydroxyON=Cc1c[nH0] 180 7837424 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9332 3-[(E)-(dimet [nH0]1ccc(C)c 50 7837423 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9333 (2E)-2-(hydro O=C(O)C(=NO) 139 7837304 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9334 (2E)-2-[1-(4- O=C(N)NN=C(C 204 7836795 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9335 4-[5-Bromo-3-Brc1ccc2oc(CC 132 5680415 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9336 benzaldehyde,Clc1cccc(F)c 133 5657632 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9337 4-{[(1E)-(2-c Clc1ccccc1C= 250 5653468 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9338 4-{[(1E)-(4-m Sc1[nH0][nH0 262 5653467 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9339 (2E)-1-(2,4-d O=[N+]([O-])c 228 5653466 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9340 (2E)-1-(2,4-di O=[N+]([O-])c 228 5653465 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9341 2-(phenylethyON=CC=1CCCC 105 5653456 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9342 (1E)-1-(2-bromBrc1ccc(OC)c2 289 5653450 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9343 (2E)-2-phenyl N#CC(=CNc1cc 156 5653383 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9344 (2E)-3-[(4-hy Oc1ccc(NC=C( 150 5653382 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9345 5-bromonaphtBrc1cccc2c(c 134 5653310 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9346 (1E)-1-[(5-br Brc1cccc2c(c 105 5653214 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9347 4-{[(1E)-1-(4- Sc1[nH0][nH0] 202 5511291 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9348 4-{[(1E)-(2,6 Sc1[nH0][nH0] 178 5511290 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9349 (2E)-1-(2,4-di O=[N+]([O-])c 220 5501903 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9350 (1E)-1-bicycloO=[N+]([O-])c 203 5501881 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9351 (2E)-3-[2-(4-n O=[N+]([O-])c 138 5497662 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9352 diethyl (3Z)- O=C(OCC)CC=C 146 5413445 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9353 5-(1-chloro-2 ClC(=Cc1ccccc 161 5410774 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9354 (5E)-5-[(4-chl Clc1ccc(cc1) 122 5359780 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9355 1-[(E)-1-chlor ClC(=Cc1ccccc 146 5292175 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9356 (5Z,7E)-5,7-b O1C2C(=Cc3cc 215 5292172 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9357 4-nitrobenzal O=[N+]([O-]) 217 5281609 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9358 BenzaldehydeO=C(N)NN=Cc1 231 5258993 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9359 4-{[(1E)-1,3-b S=C1N(N=C(N1 183 5258468 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9360 4-{[(1E)-1,3-b S=C1N(N=C(N1 122 5258467 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9361 4-{[(1E)-(2,5 Sc1[nH0][nH0] 145 5258444 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9362 4-{[(E)-(4-Nit Sc1[nH0][nH0] 193 5258443 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9363 4-{[(E)-1,3-Be Sc1[nH0][nH0 221 5257962 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9364 4-{[(E)-(4-MetSc1[nH0][nH0] 188 5257885 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9365 4-{[(E)-PhenylSc1[nH0][nH0] 233 5257884 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9366 4-{[(E)-(4-Chl Clc1ccc(cc1)C 256 5257647 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9367 4-({(E)-[4-(Di Sc1[nH0][nH0] 200 5257606 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9368 2-{4-[(1E)-4- ClCCC(c1ccccc 108 5020279 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9369 (1Z)-1-{(2E)- O=[N+]([O-])c 276 5013699 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9370 4-(dimethylamBrC(=NNc1ccc( 188 5006450 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9371 (2Z)-[(2,5-dic Clc1ccc(Cl)c( 188 5006438 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9372 (2Z)-[(2,5-dic Clc1ccc(Cl)c( 134 5006437 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9373 N,N,N-trimethy
    [I-].[nH0]1c( 251 5006419 http://dx.doi Karthikeyan M.
    x salt - AL
    9374 2,4,6-trinitro O=[N+]([O-])c 168 5006418 http://dx.doi Karthikeyan M.
    x mixture - AL
    9375 N,N-dimethyl-4
    Cl.[nH0]1c(cc 240 5006415 http://dx.doi Karthikeyan M.
    x salt - AL
    9376 2,4,6-trinitro O=[N+]([O-])c 212 5006407 http://dx.doi Karthikeyan M.
    x mixture - AL
    9377 2,4,6-trinitro O=[N+]([O-])c 117 5006401 http://dx.doi Karthikeyan M.
    x mixture - AL
    9378 (1Z)-1-[(2E)- N(Nc1ccccc1) 181 5006400 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9379 2,4,6-trinitro O=[N+]([O-])c 135 5006399 http://dx.doi Karthikeyan M.
    x mixture - AL
    9380 2,4,6-trinitro O=[N+]([O-])c 167 5006398 http://dx.doi Karthikeyan M.
    x mixture - AL
    9381 Hepadial O=C(O)C=C(C) 149 4948828 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9382 (1E)-1,4-diph O=C(CCc1cccc 130 4917819 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9383 (5E)-5-(2-azi O=C1OC(=CCN= 56 4908875 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9384 (2E)-3-(2-oxo O=C(COC(C)=C 111 4908078 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9385 (2E)-2-(4,7,7 O=C1C(=CC(=O 152 4907890 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9386 (2E,2'E)-2,2'- O=C(O)C(=NNc 190 4907575 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9387 (1Z)-1,2-diph O=C(ON=C(Cc1 92 4907501 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9388 (1Z)-3-(hydro ON=C(CC(NO)c 141 4907416 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9389 (5E)-5-[(4-chl Clc1ccc(cc1) 89 4904315 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9390 5-methyl-2-(1O=C(N)NN=C(O 200 4903996 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9391 (2E)-1,8,8-tri ON=C1CCC2CC 164 4903886 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9392 (2E)-(4,7,7-tr O=C1C(=CC(=O 106 4903723 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9393 (4E)-4-(2-met O=C1OC(NC1=C 87 4903686 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9394 methyl (2Z)-2 O=C(OC)C(=Cc 28 4903661 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9395 (2E)-3-{[(2E) O=C(N)NN=C(C 157 4903643 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9396 (2E)-N-carbamO=C1C(=CC(=O 206 4902050 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9397 (3Z)-3-(4-met O=C(O)CC=C(c 137 4901881 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9398 (2E)-[(4-methos1cc([nH0]c1 151 4901747 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9399 (4Z)-4-[(4-br Brc1ccc(NN=C2 176 4899833 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9400 acetyl (1Z,2E O=C(N)NN=C(O 174 4899525 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9401 (1Z)-1-(1-met N(Nc1ccccc1)= 85 4899516 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9402 4-{(2Z)-2-[3- O=C1N(N=C(C 188 4898256 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9403 (1Z)-1,2-bis( ON=C(Cc1ccc(N 147 4898073 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9404 3,3,4,4-tetra O=C1OC(C)(C) 132 4895873 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9405 (2Z)-[(4-chlor Clc1ccc(NN=C( 169 4879663 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9406 (2E)-3-[hydro O=C(C=CN(O)c 148 4878950 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9407 1-[(Z)-1-chlo ClC(=Cc1ccccc 117 4878564 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9408 2-(3,4-dihydr O=C1C(OC2OC( 187 4877043 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9409 (5Z)-3-{[bis(2 ClCCN(CN1C(= 233 4876502 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9410 (2E)-{5-[(E)-( s1c(N=Nc2ccc( 212 4876112 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9411 5,5'-[(4,6-din O=[N+]([O-]) 215 4873852 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9412 1-nitro-2-[(E) O=[N+]([O-])c 139 4873704 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9413 (1Z)-1-(2,5-di O=[N+]([O-])c 198 4872164 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9414 1,5-dinitro-2, O=[N+]([O-])c 291 4871364 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9415 (2E)-[(2,5-di Clc1ccc(Cl)c( 246 4871229 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9416 (2Z)-1-(2,4-di O=[N+]([O-])c 183 4870759 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9417 (2Z)-[(4-brom Brc1ccc(NN=C( 197 4869417 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9418 (2E)-{4-methyls1c(N=Nc2ccc 212 4863931 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9419 (2E)-1-(2,4-di O=[N+]([O-])c 222 4862424 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9420 (5Z)-1,3-dime Clc1cc(Cl)c(N 244 4862401 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9421 (2E)-1,3-benz s1c2ccccc2[n 175 4861962 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9422 (2E)-2-(1,3-beClc1cc(Cl)c(N 237 4861679 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9423 (1Z)-1-(4,7,7 O=C(N)NN=C(C 218 4834634 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9424 (6Z)-6-(hydro O=C(O)CC(C)C 187 4833379 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9425 N-(4-{(E)-2-[ O=[N+]([O-])c 250 4833110 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9426 (2E,2'E)-1,1'- O=C(C=Cc1ccc 150 4832356 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9427 (3E)-3-benzyl O=C(C)C(=CNc1 103 4832291 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9428 1-[(E)-(4,7,7- O=C1C(=CNC(= 197 4832258 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9429 (2E,2'E)-1,1'- O=C(C=Cc1ccc 142 4832222 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9430 5-methyl-2-(1O=C(OC1CC(C) 135 4831777 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9431 (2E)-(1-methyO=[N+]([O-]) 239 4831152 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9432 (2E)-[(4-chlo Clc1ccc(NN=C 215 4827998 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9433 (2E,2'E)-1,1' O=C(C=Cc1ccc 135 4825191 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9434 N-phenylbenzBrC(=NNc1ccc 190 4824632 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9435 (2E)-1,3-benzoClc1cc(Cl)c(N 214 4822726 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9436 (3E)-6-phenyl O=C(N)NN=C(C 149 4821892 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9437 4-[(E)-2-(2-a Nc1ccccc1C=C 146 4812251 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9438 (2Z)-1-(2,4-di O=[N+]([O-])c 180 4804741 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9439 (2E)-2-(1,3-b Clc1cccc(Cl)c 176 4803635 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9440 (1E)-3,6-dime O=C(N)NN=C1C 227 4803333 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9441 (2E)-[(2-chlo Clc1ccccc1NN 194 4801947 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9442 (2E)-[(3-hydr Oc1cccc(NN=C 285 4800725 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9443 (1E)-1-(1-nap N(Nc1ccccc1)= 166 4799926 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9444 (5Z)-3-(morpho
    S=C1SC(=Cc2c 169 4799845 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9445 5-methyl-2-(1O=C(OC1CC(C) 46 4798559 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9446 (1E)-5-(4-met O=C(C=Cc1cccc 88 4798538 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9447 (2E)-(1-methylClc1cc(Cl)c(N 169 4797374 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9448 (3E)-2-benzyl-O=C1C(=CC(Cc 127 4796520 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9449 (2E)-[4-(4-chl Clc1ccc(cc1)c 177 4794988 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9450 1-(1,2-dichlor ClC(c1ccccc1) 181 4794977 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9451 5-[(Z)-1-chlo ClC(=Cc1ccccc 77 4794973 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9452 (2Z)-1-(2,4-di O=[N+]([O-])c 227 4794772 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9453 (2E)-1-phenyl O=C(N)NN=C(C 189 4793802 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9454 (2E)-4,4,4-tri s1cccc1C(=O)C 221 4793502 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9455 4-[(1E)-3-Oxo O=C(Oc1ccc(c 156 4792140 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9456 4-[(1E)-3-Oxo O=C(Oc1ccc(c 115 4792139 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9457 4-[(1E)-3-Oxo O=C(Oc1ccc(c 95 4792138 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9458 (3E)-1,8,8-tr O=C1C(=NNc2c 117 4791368 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9459 (2E)-3-[4-(ox O=C(C=Cc1ccc 92 4791363 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9460 (2E)-3-(2-fur O=C(C=Cc1occ 163 4791361 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9461 (2Z)-[(4-chlor Clc1ccc(NN=C( 173 4789457 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9462 (4Z)-4-[(2-me O=C1N(N=C(C 149 4789417 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9463 5-nitro-4,6-b O=[N+]([O-])c 175 4789065 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9464 (2E)-2-(1,3-bes1c2ccccc2[n 239 4786796 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9465 1,5-dimethyl- FC(F)(F)C1=N 186 4774280 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9466 (8Z)-6-phenyl ON=C1CC(Cc2c 227 4774279 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9467 2,4-bis[(E)-2 Nc1cc(N)c(C=C 161 4773175 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9468 (5Z)-5-[(2-hydS=C1SC(=Cc2c 166 4773078 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9469 (2E,2'E)-3,3'- ClC(=O)C=Cc1c 171 4772867 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9470 (4Z)-4-[(3-hy O=C1N(N=C(C 205 4772666 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9471 (4Z)-5-methylClc1cc(Cl)c( 176 4772461 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9472 Ethyl (2E)-3-( O=C(OCC)C=Cc 77 4771099 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9473 (1Z)-1-(4-bromBrc1ccc2CC(=N 310 4770546 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9474 (3-nitrophenyS1C(=NNc2cccc 185 4769344 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9475 5-methyl-2-(1O=C(OC1CC(C) 104 4768627 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9476 4-{(2E)-2-[cy O=C(O)c1ccc( 200 4768430 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9477 1,5-bis[(Z)-2- ClC(=Cc1cc(C= 145 4766874 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9478 4,4'-{benzene-ClC(=Cc1ccc(c 296 4766498 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9479 (4Z)-5-methyl-O=C1N(N=C(C 177 4766433 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9480 (2E)-(1-methyBrc1cc(Br)c(N 181 4766237 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9481 (2E)-[(3-chlo Clc1cccc(NN= 166 4766083 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9482 (4Z)-4-[(2,4- Clc1ccc(NN=C 123 4765735 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9483 (2E)-1-(4-nit O=[N+]([O-])c 266 4765529 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9484 4,4'-{benzene-ClC(=Cc1cccc( 268 4764325 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9485 (2Z)-2-phenyl-O(CCc1ccccc1) 118 4763890 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9486 (3E)-1,4-diph O=C(Cc1ccccc 137 4762936 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9487 4,4'-[benzene-O=[N+]([O-])c 350 4762537 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9488 N-{3-[(1E)-3- O=C(Nc1cccc( 104 4762519 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9489 (1E,1'E)-1,1'- N(Nc1ccccc1) 165 4762474 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9490 4-[(E)-2-phen Nc1ccc(C=Cc2c 116 4762376 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9491 (2E)-2-(1,3-b s1c2ccccc2[nH 191 4761945 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9492 3-{(2E)-2-[1, s1c2ccccc2[n 200 4761944 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9493 (2E)-1,3-benzos1c2ccccc2[n 196 4761943 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9494 (2E)-1,3-Benz Brc1ccc(NN=C 281 4761942 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9495 (3E)-1,1,1-tri FC(F)(F)C(=O) 140 4761510 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9496 ethyl (2Z)-4,4 FC(F)(F)C(=O) 184 4761508 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9497 (2Z)-3-methylO=C(N)NN=C(C 112 4761030 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9498 (5Z)-5-[(4-me S=C1SC(=Cc2c 133 4760304 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9499 N-{3-nitro-4- O=[N+]([O-])c 192 4760136 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9500 (1E)-1-[4-(di O=C(C=Cc1ccc 93 4759227 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9501 (2E)-4-methylO=C(N)NN=C(C 89 4758731 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9502 (2E)-1,3-benzoClc1ccc(NN=C 189 4757861 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9503 (3E)-1,7,7-tr O=C1C(=Cc2cc 97 4739980 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9504 1,2,2-trimethyO=C(O)C1(C)C 124 4737898 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9505 N-{4-[(1E)-3- O=C(Nc1ccc(c 179 4737823 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9506 (2E)-2-(1,3-b s1c2ccccc2[n 159 4737546 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9507 (2E)-3-[4-(be O=C(NCCc1ccc 164 4737545 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9508 (2Z)-[(4-chlor Clc1ccc(NN=C( 241 4737017 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9509 (2E)-3-(4-methO=C(O)C=Cc1c 137 4737016 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9510 (5Z)-3-{[(4-ni S=C1SC(=Cc2cc 189 4736766 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9511 1-(4-methylphO=[N+]([O-])c 267 4732397 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9512 2-Propen-1-onO=C(C=Cc1ccc 151 4731266 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9513 (1Z)-1-[2-cyc O=[N+]([O-])c 201 4730754 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9514 (1E)-nitroeth O=[N+]([O-]) 360 4728670 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9515 4,4'-[benzene-O=[N+]([O-])c 298 4727795 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9516 (2E)-[4-(4-chl Clc1ccc(cc1)c 219 4725927 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9517 (2Z)-[(4-bromoBrc1ccc(NN=C( 170 4725797 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9518 (2E,2'E)-3,3'- O=C(NN)C=Cc1 259 4724970 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9519 (2E)-3-(phenyO=C(C=CNc1cc 175 4724091 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9520 1,4-bis(3-oxo O=C(C)C=Cc1c 163 4720579 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9521 3-[(E)-2-(4-AmNc1ccc(cc1)C= 109 4720159 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9522 (2E)-2-(1,3-b Clc1ccc(Cl)c( 271 4719022 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9523 (4Z)-4-[(3-fl Fc1cccc(NN=C2 106 4718717 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9524 (1E)-1-(4,7,7- ON=C(CC)C1=C 107 4717283 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9525 (5Z)-3-{[bis(2 ClCCN(CN1C(=S 284 4716133 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9526 (1E)-1-(1-nap N(Nc1ccccc1)= 101 4715976 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9527 (2E)-4,4,4-tri s1cccc1C(=O)C 151 4715209 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9528 N-{2-[(E)-2-p O=C(Nc1ccccc 113 4713789 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9529 (2E)-3-[(4-me O=C(C=CNc1cc 139 4711983 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9530 (2E)-[(2,4-di Clc1ccc(NN=C( 161 4709358 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9531 (3E)-3-benzyl O=C(C)C(=CNc 132 4708478 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9532 (2E)-2-hydraz O=C(c1cccc2c 152 4705594 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9533 N-[(E)-2-(2-n O=[N+]([O-]) 150 4705569 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9534 (1Z)-1-[(2E)-3 O=[N+]([O-])c 201 4703248 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9535 4-[(E)-2-(2-fo O=[N+]([O-]) 210 4702621 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9536 (2E)-1,3-benzoBrc1cc(Br)c(N 180 4701533 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9537 (1Z)-1-(4,7,7 O=C(N)NN=C(C 197 4701318 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9538 (2E)-[(2-meth O(C)c1ccccc1 201 4701220 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9539 (1Z)-1-[2-(5-c Clc1cc(c([N+] 196 4699382 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9540 4-[(2E)-3-(1, O=C(Oc1ccc(c 169 4697179 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9541 4-{(2E)-3-[4- O=C(Oc1ccc(c 99 4697178 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9542 4-[(1E)-3-Oxo O=C(Oc1ccc(c 158 4697177 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9543 5-(4-Methoxy-S=C1SC(=Cc2c 223 4680497 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9544 (2Z)-2-(1-MethN#CC(=Cc1ccc 270 4673166 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9545 2-[2-(2-Nitro- O=[N+]([O-])c 102 4660831 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9546 2-(4-Dimethyl[nH0]1c(ccc2c 184 4657607 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9547 (2E)-3-(2,4-di Clc1ccc(C=C(C 211 4656358 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9548 a-MethylfurfurO=C(NN=C(C)c 199 4655810 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9549 (2E)-3-[4-(3- ClCCCOc1ccc( 74 4650234 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9550 (E)-2-Benzothia
    s1c2ccccc2[n 149 4650001 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9551 2-BenzothiazolClc1ccc(cc1)C 150 4649186 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9552 (2E)-3-(3-HydrOc1cccc(c1)C 241 4648828 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9553 (2E)-3-(2-Met O(C)c1ccccc1 227 4648824 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9554 (2E)-3-[4-(Di N#CC(=Cc1ccc 151 4648823 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9555 (2E)-3-(4-FluoFc1ccc(cc1)C 134 4648812 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9556 4-chloro-N-hyClc1ccc(cc1)C 278 4646105 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9557 2-[2-(1-methyO=C1C=C(NNc2 226 4645805 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9558 9-[(2E)-3-(2, O=C([nH0]1c[ 261 4645803 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9559 4-{5-[(E)-2-e O(C=Cc1[nH0]( 155 4645795 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9560 4-{[(E)-(4-Flu Sc1[nH0][nH0] 212 4645773 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9561 4-{[(E)-(4-Flu Sc1[nH0][nH0] 276 4645773 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9562 (4Z)-4-(1,3-beOC1NN(c2cccc 290 4645771 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9563 4-(dimethylamClC(=NO)c1ccc 165 4645770 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9564 (4E)-4-[(4-me O=C1NN(c2ccc 277 4645769 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9565 3-nitrobiphenyO=[N+]([O-])c 182 4645763 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9566 6,6'-dibromo-N
    Brc1[nH0][nH0 123 4645759 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9567 N,N,N',N'-tetr[nH0]1[nH0]c( 224 4645758 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9568 (2E)-3-(4H-imiO=C(NCCC=1N 241 4645757 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9569 ethyl (2E)-3- Clc1ccc(cc1) 176 4645755 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9570 (2E)-4-nitro- O=[N+]([O-]) 360 4645754 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9571 2-(7-hydroxyqO=C1c2ccccc2 267 4645752 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9572 2-(6-phenylquO=C1c2ccccc2 271 4645751 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9573 2-[6-(4-methyO=C1c2ccccc2 242 4645750 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9574 dimethyl 3,5- O=C1C(=C2Nc3 363 4645749 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9575 2,4-Dimethox O=C(C=Cc1ccc 70 4645744 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9576 (2,6-dichloropClc1cccc(Cl)c 190 4645704 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9577 (1E)-N'-methySC(=NNC)C(N 185 4645696 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9578 (1E)-2-hydraz SC(=NN)C(N) 150 4645695 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9579 N-benzyl-N-[( Br[Zn]Br.[O-] 251 4645675 http://dx.doi Karthikeyan M.
    x metal and mixture - AL
    9580 (4Z)-1-phenyl O=C1NN(c2ccc 276 4645669 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9581 (2E)-3-[5-(2- O=C(C=Cc1oc( 99 4645664 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9582 (2E)-1-(3,4-D O=C(C=Cc1oc( 145 4645662 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9583 Ethyl (2Z)-cy O=[N+]([O-]) 103 4645660 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9584 2-FurancarboxON=Cc1oc(cc1 128 4645659 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9585 4-[(2Z)-2-(1- O=C(O)c1ccc( 219 4645658 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9586 4-(2-Hydroxy-O=[N+]([O-]) 232 4645657 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9587 4-[2-(4,6-dio S=C1NC(=O)C( 340 4645656 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9588 5-[(2-methylpO=C1NC(=O)C( 265 4645655 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9589 (5Z)-2-amino-S1C(=N)NC(=O 265 4645654 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9590 (5Z)-2-amino-S1C(=N)NC(=O 210 4645653 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9591 (5Z)-2-amino-Brc1ccc(NN=C 284 4645652 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9592 (5Z)-2-amino-S1C(=N)NC(=O 274 4645651 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9593 (5Z)-2-amino-S1C(=N)NC(=O 208 4645650 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9594 (2E)-3-[5-(4-c Clc1ccc(cc1)c 171 4645649 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9595 (2E)-3-(5-bro Brc1oc(cc1)C= 69 4645648 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9596 (2E)-3-(5-bro Brc1oc(cc1)C 77 4645647 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9597 (3Z)-3-{[5-(4 Brc1ccc(cc1) 108 4645646 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9598 (3Z)-5-(2-methO=[N+]([O-])c 163 4645645 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9599 (3Z)-5-(2-methO=[N+]([O-])c 164 4645644 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9600 5-[(2-Nitroph S=C1NC(=O)C( 330 4645643 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9601 5-[(4-MethoxyO=C1NC(=O)C( 264 4645642 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9602 5-[(2-Nitroph O=[N+]([O-]) 290 4645641 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9603 5-[(3-Nitroph O=[N+]([O-]) 270 4645640 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9604 (2E)-1-(5-MethO=[N+]([O-])c 160 4645639 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9605 (2E)-1-(5-methO=[N+]([O-])c 179 4645638 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9606 (2E)-1-(5-met O=C(C=Cc1oc(c 143 4645637 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9607 (2E)-1-(5-methO=C(C=Cc1oc(c 123 4645636 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9608 (2E)-3-[5-(4-NO=[N+]([O-])c 158 4645635 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9609 (2E)-3-[5-(4- O=C(C=Cc1oc(c 101 4645634 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9610 (2E)-1-(2-FuryO=C(C=Cc1oc( 97 4645633 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9611 (2E)-1-(3,4-D O=[N+]([O-])c 120 4645632 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9612 (4E)-4-{[5-(4- O=[N+]([O-])c 208 4645631 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9613 (4Z)-4-Benzyl Clc1ccc(cc1) 182 4645560 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9614 5(4H)-oxazolon
    O=[N+]([O-])c 236 4645558 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9615 (2E)-6-methoxO=C1C(=Cc2cc 97 4645545 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9616 (8E)-3,3-dime O=C1OC=2C(=C 156 4645544 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9617 (3Z)-2-[(5alphO=C(O)C(C=CC 200 4645543 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9618 2-[(Z)-1-(4-c Clc1ccc(OC(=C 138 4645536 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9619 2-[(E)-2-(2-ni s1c2ccccc2[nH 131 4645535 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9620 2-[(Z)-1-(3-m s1c2ccccc2[nH 138 4645534 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9621 2-[(Z)-2-(4-m s1c2ccccc2[nH 151 4645533 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9622 2-[(Z)-2-(4-m s1c2ccccc2[nH 163 4645531 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9623 2-[(Z)-2-(4-ch Clc1ccc(cc1)C 156 4645530 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9624 2-[(E)-1,2-dip s1c2ccccc2[nH 109 4645529 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9625 N-{(5Z)-1-metO=C1C=C(Oc2c 245 4645528 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9626 N-{(5Z)-5-[(6 Brc1ccc2OC=C 260 4645527 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9627 (2Z)-2-[(4-oxoO=C1C(=COc2c 251 4645524 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9628 (5Z)-5-[(6-chl Clc1ccc2OC=C 232 4645523 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9629 (2E)-1,3-benzos1c2ccccc2[n 255 4645512 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9630 (2Z)-2-[4-(4-ms1cc([nH0]c1C 236 4645507 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9631 (2Z)-2-[4-(4-c Clc1ccc(cc1)c 134 4645506 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9632 (2Z)-2-(4-phens1cc([nH0]c1C 164 4645505 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9633 (2E)-[4-(4-mets1cc([nH0]c1 256 4645502 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9634 (2E)-[(1,5-dims1cc([nH0]c1 227 4645500 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9635 3-Furan-2-yl-2s1cc([nH0]c1C 116 4645499 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9636 (2E)-3-(2,6-di Clc1cccc(Cl)c 96 4645498 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9637 (2Z)-3-(2-chlo Clc1ccc(N=Nc2 199 4645493 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9638 1,3-dimethyl- Brc1cc(Br)c(N 166 4645492 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9639 1,3-dimethyl- O=C1N(C)C(=O 229 4645491 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9640 5-[(4-bromophBrc1ccc(NN=C 219 4645490 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9641 5-[(3-chlorop Clc1cccc(NN= 202 4645489 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9642 5-[(4-fluorop Fc1ccc(NN=C2 191 4645488 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9643 (2E)-[4-(4-chl Clc1ccc(cc1)c 196 4645486 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9644 (2E)-[4-(4-chl Clc1ccc(cc1)c 246 4645485 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9645 (2E)-[4-(4-chl Clc1ccc(cc1)c 158 4645484 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9646 (2E)-[4-(4-Chl Clc1ccc(cc1)c 209 4645483 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9647 (2E)-[4-(4-chl Clc1ccc(cc1)c 226 4645481 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9648 (2E)-[4-(4-Chl Clc1ccc(cc1)c 179 4645480 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9649 (2E)-[(2,5-dims1cc([nH0]c1C 156 4645479 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9650 (2E)-[(2,3-dims1cc([nH0]c1C 164 4645478 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9651 (2E)-[4-(4-me s1cc([nH0]c1C 152 4645477 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9652 (2E)-[(4-Methos1cc([nH0]c1C 146 4645473 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9653 (2E)-[4-(4-mets1cc([nH0]c1C 226 4645472 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9654 (2E)-[(3-methys1cc([nH0]c1C 133 4645470 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9655 (2E)-[(4-fluor s1cc([nH0]c1C 196 4645467 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9656 (2E)-[(3-nitro s1cc([nH0]c1C 216 4645464 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9657 (2E)-[(2-methys1cc([nH0]c1 144 4645463 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9658 2-(1H-Benzoimi
    Clc1ccc(C=C(C 250 4645454 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9659 (4E)-2-(hydro FC(F)(F)C1=N 143 4645451 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9660 (2E)-2-[4-(2-F s1cc([nH0]c1C 109 4645450 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9661 (2Z)-2-[4-(4-c Clc1ccc(cc1)c 171 4645442 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9662 (2Z)-2-[4-(4-B Brc1ccc(cc1)c 174 4645440 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9663 (2Z)-2-[4-(4-c Clc1ccc(cc1)c 184 4645438 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9664 (2E)-2-[4-(1-Ns1cccc1C=C(C# 206 4645437 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9665 (2E)-3-[4-(Dims1cc([nH0]c1C 129 4645436 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9666 (2E)-3-(2,4-di Clc1ccc(C=C(C 133 4645435 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9667 (2E)-3-(4-ChloClc1ccc(cc1)C 131 4645434 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9668 (2E)-3-oxo-3-ts1cccc1C(=O)C 174 4645429 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9669 4-{(2E)-2-[3,3 s1cccc1C(=O)C 220 4645427 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9670 (2E)-3-(4-fluo Brc1cc(Br)c(N 171 4645426 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9671 (2E)-3-furan-2Clc1cc(Cl)c(N 156 4645425 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9672 (2Z)-3-furan-2s1c(N=Nc2cccc 213 4645424 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9673 (2E)-3-[4-(dims1c(N=Nc2ccc( 149 4645423 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9674 (2Z)-3-(2,4-di Clc1ccc(C=C(C 139 4645422 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9675 ethyl (2E)-2-[ Clc1ccc(Cl)c( 147 4645415 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9676 (3Z)-3-[(2,5-d Clc1ccc(Cl)c( 84 4645413 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9677 (4E)-4-[(3-me FC(F)(F)C1=N 161 4645412 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9678 (2E)-2-(1,3-b s1c2ccccc2[nH 211 4645410 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9679 (2E)-2-(1,3-beClc1ccc(C=C(c 264 4645409 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9680 (2E)-2-(1,3-b s1c2ccccc2[n 169 4645407 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9681 (2E)-2-(1,3-b s1c2ccccc2[nH 149 4645406 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9682 (2E)-2-(1,3-b s1c2ccccc2[nH 179 4645405 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9683 2-BenzothiazolClc1ccccc1C= 139 4645403 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9684 (2E)-2-(1,3-Bes1c2ccccc2[n 106 4645402 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9685 (3Z)-1,1,1-tri FC(F)(F)c1ccc 86 4645396 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9686 (3Z)-3-[(4-chl Clc1ccc(NN=C( 125 4645393 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9687 ethyl (2E)-2-[ Clc1ccc(NN=C( 76 4645391 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9688 (4E)-2-phenyl-FC(F)(F)C1=N 177 4645389 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9689 4-[2-(5-phenylFC(F)(F)C1=N 272 4645388 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9690 2-{(2E)-2-[5-o FC(F)(F)C1=N 139 4645387 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9691 1H-pyrazole-4,FC(F)(F)c1ccc 160 4645386 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9692 (4Z)-4-[(4-ch Clc1ccc(NN=C2 180 4645385 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9693 (4Z)-4-[(4-fl Fc1ccc(NN=C2C 186 4645384 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9694 2-{2-[3-oxo-5-FC(F)(F)C1=N 274 4645383 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9695 4-[2-(3-nitropFC(F)(F)C1=N 254 4645382 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9696 4-[2-(4-methyFC(F)(F)C1=N 231 4645381 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9697 4-[2-(4-chloroClc1ccc(NN=C 215 4645380 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9698 4-(2-phenylhyFC(F)(F)C1=N 186 4645379 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9699 (4E)-4-[(3-ni FC(F)(F)C1=NN 151 4645377 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9700 (4E)-2-phenyl-FC(F)(F)C1=N 161 4645374 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9701 ethyl 7-amino-Clc1ccc(cc1)C 198 4645373 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9702 7-amino-5-fura
    FC(F)(F)c1[nH 260 4645372 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9703 7-amino-5-[4-(FC(F)(F)c1[nH 164 4645371 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9704 7-amino-5-(2,6Clc1cccc(Cl)c 324 4645370 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9705 7-amino-5-(4-m
    FC(F)(F)c1[nH 212 4645369 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9706 7-amino-5-(2,4Clc1ccc(c(Cl) 306 4645368 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9707 7-amino-5-(2-m
    FC(F)(F)c1[n 246 4645367 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9708 (2Z)-[(2,5-di N#CC(=NNc1cc 260 4645365 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9709 (E)-3-(2,6-Dic Clc1cccc(Cl)c 186 4645361 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9710 (2E)-2-(1H-BenN#CC(=Cc1ccc 211 4645359 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9711 (2E)-2-(1,3-b s1c2ccccc2[n 174 4645356 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9712 (2E)-2-(1H-BenN#CC(=Cc1c[ 229 4645345 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9713 (4E)-4-[(2,3- FC(F)(F)C1=N 136 4645325 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9714 4-[2-(2,5-dim FC(F)(F)C1=N 189 4645324 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9715 4-[2-(2,5-dich Clc1ccc(Cl)c( 214 4645323 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9716 4-[2-(3-methyFC(F)(F)C1=N 155 4645322 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9717 4-[2-(3-fluor Fc1cccc(NN=C 219 4645321 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9718 4-[2-(4-bromoBrc1ccc(NN=C 212 4645316 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9719 ethyl (2E)-3- O=C(OCC)C=Cc 115 4645312 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9720 ethyl (2E)-3- O=C(OCC)C=Cc 141 4645305 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9721 (2E)-1-phenyl O=C(C=Cc1oc(c 80 4645283 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9722 (2E)-1-(2-FuryO=C(C=Cc1oc(c 111 4645282 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9723 (2E)-3-[5-(4-B Brc1ccc(cc1)c 165 4645281 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9724 (2E,6E)-4-metO=[N+]([O-])c 193 4645250 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9725 2(1H)-quinazoS=C1NC=2C(=C 184 4645249 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9726 (3E)-4-(4-met O=C(C)C=C(C) 53 4645236 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9727 Xenipentone O=C(C)C=C(C)c 133 4645232 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9728 (1E)-1-bicycloO=C(C)C=C1Cc 79 4645231 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9729 (2E)-2-bicycloO=C(C=C1Cc2c 50 4645230 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9730 (2E)-2-bicycloO=C(C=C1Cc2c 55 4645230 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9731 3-[(E)-2-phen O=C1C=C(C=Cc 66 4645227 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9732 (1Z)-1-[(2E,4EO=[N+]([O-])c 115 4645214 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9733 (1Z)-1-[(2E,4EO=[N+]([O-])c 121 4645214 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9734 (1Z)-1-[(2E,4EO=[N+]([O-])c 190 4645214 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9735 (1Z)-1-[(2E,4EO=[N+]([O-])c 233 4645214 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9736 (1Z)-1-[(2E)-1 O=[N+]([O-])c 198 4645211 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9737 (1Z)-1-[(2E)-1 O=[N+]([O-])c 211 4645211 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9738 2-[(E)-1-carboO=[N+]([O-])c 223 4645209 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9739 methyl 2-[(E) O=[N+]([O-])c 121 4645208 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9740 (1E,3Z)-4-(aceO=C(OC(=CC=C 126 4645206 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9741 (2Z)-N-phenylO=C(Nc1ccccc 75 4645205 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9742 (2Z)-N-phenylO=C(Nc1ccccc 100 4645205 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9743 (1Z)-1-cyclob O=[N+]([O-])c 275 4645197 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9744 [(2E)-4-bromo[Br-].BrCC=CC 180 4645195 http://dx.doi Karthikeyan M.
    x salt - AL
    9745 (1E)-buta-1,3 [Br-].[P+](C= 174 4645193 http://dx.doi Karthikeyan M.
    x salt - AL
    9746 3-[(E)-2-(4-n O=[N+]([O-]) 181 4645189 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9747 (3Z)-5-phenyl O=C1OC=CC(Cc 120 4645188 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9748 3-[(E)-2-phen O=C1OC(C=Cc2 84 4645187 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9749 (3Z,8Z)-N,N,N O=[N+]([O-])c 230 4645186 http://dx.doi Karthikeyan M.
    x salt - AL
    9750 2,4,6-trinitro O=[N+]([O-])c 221 4645185 http://dx.doi Karthikeyan M.
    x mixture - AL
    9751 N,N'-(3E,8E)- O=CNC1CC=CC 234 4645181 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9752 7-(benzyloxy) O=[N+]([O-])c 152 4645102 http://dx.doi Karthikeyan M.
    x salt - AL
    9753 7-hydroxy-6-mO=[N+]([O-])c 174 4645101 http://dx.doi Karthikeyan M.
    x salt - AL
    9754 2-methyl-5-azO=[N+]([O-])c 143 4645100 http://dx.doi Karthikeyan M.
    x salt - AL
    9755 ethyl (4E)-2- O=C(OCC)C(C( 208 4645086 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9756 (9Z)-5,8:11,1 c1ccc2c3ccc(c 230 4645074 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9757 (2E)-N-(4-bro Brc1ccc(NC(= 211 4645033 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9758 (2E)-2-[(diam S=C(Nc1ccccc 207 4645032 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9759 N~5~-(4-metho
    O(C)c1ccc(Nc2 293 4645031 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9760 N~5~-(4-iodopIc1ccc(Nc2[nH 389 4645030 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9761 N~5~-(4-chlorClc1ccc(Nc2[n 297 4645029 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9762 N~5~-(4-bromo
    Brc1ccc(Nc2[n 203 4645028 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9763 N~5~-(2,4-dic Clc1ccc(Nc2[n 223 4645027 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9764 (2E)-1,3-bis(4 Fc1ccc(cc1)C( 51 4645004 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9765 2-nitro-1-(4, O=[N+]([O-])C 169 4645003 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9766 4-[3-(5-MethyON=C(C)CCc1o 105 4644993 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9767 4-[3-(5-MethyO=[N+]([O-])c 161 4644992 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9768 (3E)-4-[6,7-di O=C(C)C=Cc1[ 170 4644990 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9769 (3E)-4-[6,7-di O=C(C)C=Cc1[ 210 4644990 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9770 1-(1,2-dibromBrC(c1ccccc1) 212 4644981 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9771 (2E)-3-(4-met O=C(O)C=C(C)c 135 4644827 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9772 N-hydroxy-N-[ON(C=Cc1cccc 120 4644826 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9773 (3E)-3-{[4-(d O=C1C(=Cc2cc 153 4644824 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9774 (3E)-1,8,8-tri O=[N+]([O-]) 141 4644823 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9775 4,4',7,7,7',7' O=C1C(CC=Cc2 152 4644820 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9776 4,4',7,7,7',7' O=C1C(CC=Cc2 188 4644820 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9777 (2Z)-6-methylO=C(N)NN=C(C 136 4644819 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9778 N,N'-[(E)-eth O=C(Nc1ccc(cc 253 4644815 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9779 N,N'-[(E)-eth O=C(Nc1ccc(cc 352 4644815 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9780 4,4'-(Z)-ethenN(=Cc1ccccc1) 104 4644803 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9781 N,N'-[(E)-etheO=C(Nc1ccc(c 172 4644802 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9782 N,N'-[(E)-etheO=C(Nc1ccc(c 322 4644802 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9783 (2E,4E)-2-metO=C(OC(=O)C( 113 4644795 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9784 (2E)-2-benzyl O=C(OC(=O)C( 108 4644793 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9785 5-methyl-2-(1O=C(OC1CC(C) 65 4644791 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9786 (1E)-5-methylO=C(N)NN=C1C 217 4644788 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9787 (1Z)-3-methylO=C(N)NN=C1C 220 4644787 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9788 2-[(2E)-3-phe O=C(N)NN=C(O 198 4644784 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9789 (1Z)-2-methylO=C(N)NN=C1c 201 4644783 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9790 N,N-dimethyl-4
    O=NN1C(C=Cc2 196 4644779 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9791 N,N-dimethyl-4
    Cl.Cl.N1C(C=C 85 4644775 http://dx.doi Karthikeyan M.
    x salt - AL
    9792 N,N-dimethyl-4
    N1C(C=Cc2cccc 125 4644774 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9793 (1E)-1-hydrox O=C(C=CO)CCc 150 4644772 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9794 (1E)-3-oxo-5- O=C(C=COC(=O 100 4644771 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9795 (1E)-1-[1-(1H N(Nc1ccccc1) 225 4644770 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9796 (2E)-N',3-Dip O=C(NNc1cccc 187 4644766 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9797 (2E)-N'-phenyO=C(NNc1cccc 190 4644765 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9798 2-phenyl-5-[(1Oc1[nH0]c([n 188 4644764 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9799 5-bromonaphtBrc1cccc2cc( 178 4644758 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9800 N-(4-{4-[(E)- O=C1N(N=C(c2 317 4644757 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9801 (4'E)-4,4'-(E) O=[N+]([O-])c 284 4644756 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9802 5-(4-Nitro-ph O=[N+]([O-]) 240 4644755 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9803 (4'E)-4,4'-(E) O=C1N(N=C(C1 259 4644754 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9804 diethyl (4'E)- O=C1N(N=C(C1 180 4644753 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9805 4-((1,5-Dihyd O=C1N(N=C(C) 181 4644751 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9806 (3Z)-3-(2-nitr O=[N+]([O-]) 82 4644750 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9807 N-{3-nitro-4-[ O=[N+]([O-])c 236 4644743 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9808 3-nitro-4-[(E) O=[N+]([O-])c 198 4644742 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9809 3-nitro-4-[(E) O=[N+]([O-])c 202 4644742 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9810 N-(2-{(E)-2-[ O=C(Nc1ccc(c 180 4644741 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9811 N-(2-{(E)-2-[ O=C(Nc1ccc(c 241 4644741 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9812 (2E)-3-(2-nitr O=[N+]([O-])c 84 4644739 http://dx.doi Karthikeyan M.
    x mixture - AL
    9813 (2E)-3-[2-(ac O=C(Nc1ccc(c 240 4644738 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9814 (2E)-3-(2-ami O=C(O)C(=Cc1 186 4644737 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9815 (2E)-3-(2-nitr O=[N+]([O-])c 184 4644734 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9816 diethyl 2,2-bi O=C1C(=CC(C= 105 4644715 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9817 ethyl 2,2-bis[ O=C1C(=CC(C= 148 4644714 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9818 ethyl 4-methylO=C1C(=CC(C= 156 4644713 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9819 ethyl 2,2-bis[ O=C1C(=CC(C= 175 4644712 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9820 ethyl 2,2-bis[ O=C1C(=CC(C= 161 4644711 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9821 ethyl (3Z)-2-mO=C1C(=CC(C) 118 4644710 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9822 (3Z)-3-(3-hydrO=C(O)CC=C1C 52 4644701 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9823 (3Z,3'Z)-3,3'- O=C1C(=CCC=C 266 4644700 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9824 2-[(E)-2-(2-n O=[N+]([O-])c 215 4644684 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9825 N-acetyl-N-{3,O=[N+]([O-])c 175 4644676 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9826 N,N',N''-{2,4- O=C(Nc1cc(NC 330 4644673 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9827 N,N'-{5-nitro- O=[N+]([O-])c 276 4644672 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9828 N-{3,5-dinitroO=[N+]([O-])c 171 4644671 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9829 1-amino-2-{[( ClC=CSc1ccc2 180 4644666 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9830 dimethyl (2E,2O=C(Nc1cc(cc 168 4644661 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9831 (2E,2'E)-3,3'- O=C(N(c1cc(c 313 4644660 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9832 diethyl (2E,2' O=C(OCC)C=Cc 178 4644659 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9833 dimethyl (2E, O=C(OC)C=Cc1 159 4644658 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9834 bis(3-methylbu
    O=[N+]([O-]) 94 4644656 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9835 dimethyl (2E,2O=[N+]([O-]) 166 4644654 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9836 N-{5-nitro-2, O=[N+]([O-])c 227 4644651 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9837 4,6-bis[(E)-2 Nc1cc(N)c(cc 201 4644650 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9838 2,2'-[(4,6-din O=[N+]([O-])c 254 4644648 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9839 4,4'-[(4,6-din O=[N+]([O-]) 215 4644647 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9840 2-[(E)-2-{2,4- O=[N+]([O-])c 250 4644645 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9841 2-[(E)-2-{2,4- O=[N+]([O-])c 193 4644644 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9842 N-{2-[(E)-2-{2 O=[N+]([O-])c 265 4644642 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9843 4-[(E)-2-(2-a Nc1cc(N)c(cc 151 4644641 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9844 N,N'-{(4,6-din O=[N+]([O-])c 270 4644640 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9845 2-[(E)-2-(5-meO=[N+]([O-])c 175 4644639 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9846 5-nitro-2,4-bi O=[N+]([O-])c 111 4644638 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9847 2,4,6-trinitro O=[N+]([O-])c 133 4644637 http://dx.doi Karthikeyan M.
    x mixture - AL
    9848 N-(2,4-bis[(E) O=[N+]([O-])c 241 4644634 http://dx.doi Karthikeyan M.
    x mixture - AL
    9849 N,N'-{4,6-bis O=C(Nc1cc(NC 224 4644633 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9850 N,N'-{4,6-bis[ O=[N+]([O-])c 232 4644632 http://dx.doi Karthikeyan M.
    x mixture - AL
    9851 N-{5-amino-2,O=C(Nc1cc(N) 218 4644631 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9852 2-phenyl-5-[( Nc1cc2NC(Cc2 163 4644629 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9853 (4E,4'E)-4,4'- O=[N+]([O-]) 266 4644626 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9854 1,3-bis[(E)-2- O=[N+]([O-])C 204 4644625 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9855 1,3-bis[(Z)-2 BrC([N+](=O)[ 153 4644624 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9856 (4Z,4'Z)-4,4'- O=C1N(N=C(C) 220 4644623 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9857 (4Z,4'Z)-4,4'- O=C1OC(=NC1= 247 4644622 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9858 (5Z,5'Z)-5,5'- S=C1SC(=Cc2c 316 4644621 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9859 methyl [(E)-2 O=[N+]([O-]) 147 4644618 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9860 (1Z,1'Z)-2,2'- N(Nc1cccc(NN= 164 4644614 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9861 2-[(E)-2-furan o1cccc1C=Cc1 272 4644603 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9862 diethyl (2E,2' O=[N+]([O-]) 116 4644595 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9863 2,4,6-trinitro ClC(=Cc1ccccc 128 4644591 http://dx.doi Karthikeyan M.
    x mixture - AL
    9864 2-[(E)-1-chlor ClC(=Cc1ccccc 61 4644590 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9865 2-[(E)-2-(2,4 O=[N+]([O-])c 186 4644575 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9866 2-[(E)-2-PhenyOc1ccccc1C=C 147 4644571 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9867 2-[(E)-2-pheny[Cl-].[N+]c1c 198 4644568 http://dx.doi Karthikeyan M.
    x salt - AL
    9868 N-{2-[(E)-2-p O=C(Nc1ccccc 98 4644567 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9869 N-{2-[(E)-2-p O=C(Nc1ccccc 168 4644567 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9870 1-(2-AminopheNc1ccccc1C=C 106 4644566 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9871 2,4,6-trinitro O=[N+]([O-])c 157 4644565 http://dx.doi Karthikeyan M.
    x mixture - AL
    9872 2-[(E)-2-phen O=C(Oc1ccccc 56 4644564 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9873 (2E)-2,3-dibr BrC(c1cccc(c1 214 4644563 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9874 (2E)-3-[3-bro Brc1cc(C#CC( 161 4644560 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9875 (2E)-3-[3-bro Brc1cc(C#CC( 67 4644559 http://dx.doi Karthikeyan M.
    x salt - AL
    9876 (2E)-3-[7-(car O=C1Nc2cc(CC 234 4644558 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9877 dimethyl (2E,2O=C(OC)C=Cc1 132 4644556 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9878 diethyl (2E,2' O=C(OCC)C=Cc 54 4644555 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9879 dimethyl (2E,2O=[N+]([O-]) 200 4644552 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9880 tetraethyl 2,2 O=C(OCC)C(C= 101 4644550 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9881 (2Z)-2-(2-nitr O=[N+]([O-])c 192 4644548 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9882 (2E)-3-(5-bro Brc1cccc2c(c 270 4644533 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9883 (2E)-3-naphthO=C(O)C(=Cc1 161 4644531 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9884 (2E)-3-(5-bro Brc1ccc([N+]( 142 4644530 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9885 1-acetyl-5-[(Z ClC(=Cc1ccccc 58 4644528 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9886 (2Z,2'Z)-1,1' O=C(C=[N+]([O 133 4644525 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9887 1-nitro-2-[(E) O=[N+]([O-])c 107 4644519 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9888 ethyl (2Z)-2- O=[N+]([O-])c 95 4644518 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9889 N-{2-phenyl-1O=C(Nc1cc2N( 250 4644516 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9890 2,4,6-trinitro Clc1ccccc1C=N 173 4644514 http://dx.doi Karthikeyan M.
    x mixture - AL
    9891 2,4,6-trinitro O=[N+]([O-])c 145 4644512 http://dx.doi Karthikeyan M.
    x mixture - AL
    9892 1,1-diethyl-2 [I-].N(=Cc1cc 252 4644510 http://dx.doi Karthikeyan M.
    x salt - AL
    9893 6-amino-1,1-di[I-].O=[N+]([ 218 4644508 http://dx.doi Karthikeyan M.
    x mixture - AL
    9894 5-[(E)-2-(2,4 O=[N+]([O-])c 191 4644507 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9895 5-[(E)-2-(2,4- O=[N+]([O-])c 179 4644505 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9896 2,4-dinitro-1- O=[N+]([O-])c 240 4644504 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9897 N-{2-[(E)-2-( O=[N+]([O-])c 252 4644503 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9898 1,5-dinitro-2, O=[N+]([O-])c 193 4644490 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9899 6-nitro-2-phenO=[N+]([O-])c 233 4644488 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9900 3-nitro-8-phenO=[N+]([O-]) 198 4644466 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9901 (3alpha,8xi,9xO=C(OC1CCC2( 162 4644369 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9902 3-(4-butoxyphe
    S1c2[nH0][nH 80 4644366 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9903 3-(phenoxymeth
    S1c2[nH0][nH 142 4644365 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9904 3-(4-nitrophenS1c2[nH0][nH0 113 4644364 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9905 3-(3-nitrophenS1c2[nH0][nH0 191 4644361 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9906 3-(3-nitrophenS1c2[nH0][nH0 223 4644359 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9907 3-(2-methoxyph
    S1c2[nH0][nH 125 4644358 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9908 3-(4-methoxyph
    S1c2[nH0][nH 81 4644357 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9909 6-[(1E)-prop-1S1c2[nH0][nH 121 4644356 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9910 (2E)-2-(carba S=C(N)NN=C(C 234 4644355 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9911 (2E)-N-(4-bro Brc1ccc(NC(= 229 4644354 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9912 (2E)-2-(carba S=C(N)NN=C(C 212 4644353 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9913 (2E)-2-(carb O=C(N)NN=C(C 227 4644352 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9914 (2E)-N-(4-br Brc1ccc(NC(= 244 4644351 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9915 (2E)-2-(carb O=C(N)NN=C(C 237 4644350 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9916 2-[4-(benzylo O=C1C(O)=C(O 208 4644347 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9917 (2Z)-(3,4-dim O=CC=C1OC(= 61 4644344 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9918 10-[(Z)-(3,4- O=C1OC(=CC2 119 4644343 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9919 5-[(4-Chlorop Clc1ccc(NN=C 300 4633488 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9920 5-[(3-Nitroph S=C1NC(=O)C( 330 4628554 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9921 5-[(4-BromophBrc1ccc(NN=C 295 4628349 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9922 Ethyl (2Z)-[( Clc1ccc(NN=C 162 4607279 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9923 (2Z)-2-{[(4-m O=C(NC(=Cc1c 230 4606384 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9924 (4-chlorophenClc1ccc(cc1)C 133 4590614 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9925 (1Z,1'Z)-1,1'- O=C(C=C1Nc2c 221 4582184 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9926 4'-hydroxy-3, O=C(C=Cc1ccc 210 4579039 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9927 benzene, 1,1'-c1ccc(cc1)C=C 155 4575868 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9928 5-(PhenylhydrS=C1NC(=O)C( 290 4553928 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9929 Ethyl (2Z)-cy O=[N+]([O-]) 156 4553190 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9930 5-[(2-methylpS=C1NC(=O)C( 242 4546692 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9931 5-[(4-MethylpS=C1NC(=O)C( 305 4544638 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9932 5-[(4-BromophBrc1ccc(NN=C 268 4541431 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9933 5-[(4-MethoxyS=C1NC(=O)C( 246 4540573 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9934 Ethanone, 1-( ON=C(C)c1ccc 80 4540519 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9935 3-(2-FluorophFc1ccccc1C=C 315 4534702 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9936 1,1'-{benzene-ClC(=Cc1ccc(c 245 4534654 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9937 2-Methyl-4-(1O=C1OC(=NC1= 244 4534339 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9938 1,1'-[benzene-O=[N+]([O-])c 294 4534191 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9939 (1E)-5-Isopro ON=C1CC(CC= 72 4528712 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9940 Benzothiazole,s1c2ccccc2[nH 210 4526988 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9941 4,4'-Dinitrost O=[N+]([O-])c 183 4526816 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9942 5-[(4-Chlorop Clc1ccc(NN=C 353 4526734 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9943 2-Propen-1-one
    O=[N+]([O-])c 161 4526395 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9944 trans-4'-ChlorClc1ccc(cc1)C 163 4526374 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9945 4-dimethylamO=C(C=Cc1ccc( 114 4526350 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9946 2-[2-(5-methyO=C1NN=C(C) 239 4526251 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9947 Chalcone, 4'-cClc1ccc(cc1)C 96 4526147 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9948 o-(2,4-Dinitro O=[N+]([O-])c 186 4526095 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9949 2-Propen-1-one
    ON=C(C=Cc1cc 116 4525657 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9950 benzaldehyde,Brc1ccc(cc1) 118 4525030 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9951 Benzaldehyde,O=[N+]([O-])c 130 4523938 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9952 Naphthalene, O
    1 =[N+]([O-])c 228 4523506 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9953 p-TolualdoximON=Cc1ccc(C) 126 4522484 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9954 4-(4-ChlorophClc1ccc(NN=C 216 4522005 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9955 [(1E,5E)-6-Ph c1ccc(cc1)C= 82 4521395 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9956 DL-N-AcetamiO=C(NC(=Cc1c 192 4521363 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9957 2-Propen-1-onClc1ccc(cc1)C 122 4519739 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9958 (2E)-3-(3-Ami O=C(C=Cc1ccc 159 4518751 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9959 Febantel S(c1ccccc1)c 129 4514715 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9960 (4Z)-5-methylFC(F)(F)c1cc 171 4513787 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9961 [(E)-1,2-Dibr BrC(c1ccccc1) 228 4513459 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9962 3-Buten-2-one,
    O=[N+]([O-])c 194 4512128 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9963 4-Chlorobenz Clc1ccc(cc1) 101 4512101 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9964 2-Propen-1-onO=C(C=Cc1ccc 188 4511547 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9965 2-quinolin-2( O=C1c2ccccc2 241 4511298 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9966 2-benzyl-3-pheO=C(O)C(=Cc1 158 4511153 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9967 ethyl (2Z)-4, FC(F)(F)C(=O 81 4510990 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9968 Ethyl 2-CyanoO=C(OCC)C(C# 49 4510598 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9969 Ethyl (2E)-cy O=C(OCC)C(=N 280 4510422 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9970 [(1E)-1-MethyCC(c1ccccc1)= 65 4510396 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9971 Isatin Thiose S=C(N)NN=C1 233 4510345 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9972 m-NitrobenzaO=[N+]([O-])c 120 4510308 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9973 2-Benzothiazols1cccc1C=C(C 148 4501076 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9974 4-[5-Methyl-3ON=C(C)CCc1o 104 4498890 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9975 4-[5,7-DibromBrc1cc2c(oc(C 158 4498849 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9976 (2E)-4-[5-chl Clc1ccc2oc(CC 115 4498801 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9977 (2E)-3-[5-(4- Clc1ccc(cc1)c 127 4498407 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9978 (2E)-1-(2-fury O=C(C=Cc1oc( 100 4498385 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9979 (2E)-3-(2-ChloClc1ccccc1C=C 102 4495596 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9980 trans-4,4'-Di O=C(C=C(C)c1c 87 4494794 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9981 (2E)-3-[5-(4-C Clc1ccc(cc1)c 148 4494362 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9982 (2E)-1-(2-FuryO=[N+]([O-])c 169 4492594 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9983 (2E)-3-[5-(4- Brc1ccc(cc1)c 129 4492575 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9984 (2E)-1-(2-FuryO=[N+]([O-])c 187 4492534 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9985 (2E)-2-(1H-BenOc1cccc(c1)C 300 4492507 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9986 4-[(2Z)-2-(3- O=C1N(N=C(C) 314 4490693 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9987 (2E)-3-[5-(3-NO=[N+]([O-])c 147 4489706 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9988 (2Z)-2-[4-(4-c Clc1ccc(cc1)c 254 4489642 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9989 2-[4-(4-Methox
    s1cccc1C=C(C# 141 4489407 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9990 (2Z)-3-(4-meths1cc([nH0]c1C 79 4489079 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9991 (2E)-3-(2,4-Di Clc1ccc(C=C(C 143 4489034 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9992 (2E)-3-(2-ChloClc1ccccc1C=C 223 4489007 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9993 (2E)-(phenylhys1cc([nH0]c1 176 4488624 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9994 (5E)-5-(furan- S=C1SC(=Cc2o 121 4488383 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9995 5-(phenylhydrO=C1NC(=O)C( 310 4488366 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9996 (E)-2-(2-Nitro O=[N+]([O-])c 214 4463215 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9997 trans-4-BromoBrc1ccc(cc1)C 168 4454470 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9998 (2E)-3-(4-ChloClc1ccc(cc1)C 104 4448846 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    9999 4,4'-Stilbene Nc1ccc(cc1)C= 121 4447690 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10000 Acitretin O=C(O)C=C(C) 228 4447573 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10001 ISBOGREL O=C(O)CCCCC= 114 4447509 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10002 1-(HydroxymetS=C(NC)NCO 88 4418329 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10003 7-methoxy-15-O=C1C(=C)C2C 160 4413875 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10004 11,14-dihydroO=C1C(=C)C2C 288 4413874 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10005 14-hydroxy-7-O=C1C(=C)C2C 183 4413873 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10006 15,20-dioxo-18
    O=C1OCC2(C)C 235 4413872 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10007 5a,11a-dihydrO=C1c2ccccc2 238 4392359 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10008 2,2,6,6,9a-pe O=C1C(=C)C23 259 4389657 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10009 3-bromo-2-ethBrC1CC=C(OC 142 4387779 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10010 1,11,14-trihy O=C1C(=C)C2C 261 4375629 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10011 14-hydroxy-7,O=C1CC2C(=C) 250 4357665 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10012 5,8-dihydroxyO=C1CC2(C)C( 187 4354169 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10013 20-methoxy-15
    O=C1C(=C)C2C 71 4345731 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10014 7,14-dihydroxO=C1C(C)C2CC 246 4335527 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10015 1,2,3,4,5,6,7 OC1CC=2CCCC 121 4325383 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10016 5,5,8,8,11a,1 O=C1CC2C(C)C 197 4322698 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10017 cycloheptane-O=C(OC1CCCCC 174 4313659 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10018 5,14-dimethylOC1CCC2(C)C 167 4310549 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10019 10,13-dimethyO=C(OC1CCC2 196 4309472 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10020 11,12,14,16-t O=C1c2c(O)c( 239 4309334 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10021 3-ethynyl-3-h O=C1CCC2C3CC 238 4305439 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10022 1-O-[16-(hexoO=C(OC1OC(CO 198 4305321 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10023 15-oxo-18,20-O=C1C(C)C2CC 104 4299465 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10024 1-(17-hydroxyO=C(C)C1CCC2 152 4298369 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10025 7,13,14-trihy O=C1C(C)C2(O 234 4291064 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10026 1,5-cyclochol O=C1CCC23CCC 164 4290854 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10027 methyl 1,3-di O=C1OC(=O)C 117 4290287 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10028 tert-butyl(2- [S+]([O-])(OC( 136 4290149 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10029 14-hydroxy-3,O=C1CCC2(O)C 176 4284981 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10030 3-ethynyl-3-h O=C1CCC2C3C 308 4284063 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10031 3-(benzyloxy) OC1CCC2C3CC 225 4283369 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10032 14,18-dihydroO=C1C(C)C2CC 200 4282289 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10033 1-methyl-2,3, O=C(O)C1NC(C 287 4279866 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10034 15,20-dioxokaO=CC12C3C(OC 212 4274836 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10035 10-methylgon-O=C1CCC2(C) 138 4267938 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10036 1,4,5,6,7,8-h O1CC2C=3CCC 173 4210900 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10037 1,8-dimethyl-3O1C(c2ccccc2 171 4210899 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10038 3-(nitromethyO=[N+]([O-]) 129 4209064 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10039 3-(2-{[tert-bu [Si](OC(C)CC 132 4192921 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10040 6-hydroxycholO=C1C=C2C(O) 155 4175280 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10041 5-(2-carboxy- O=C(O)CCC(C) 266 4166405 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10042 7-chloro-2-meClc1cc2NC(N(C 252 3900605 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10043 1,7,11,14-tet O=C1C(C)C2CC 282 3880442 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10044 17-[1-(acetyloO=C(OC1CCC2( 118 3872210 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10045 10-hydroxy-4,O=C1C=CC2(O 202 3871837 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10046 (17-oxoandrost
    O=C1CCC2C3C 177 3870642 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10047 14-hydroxy-15O=CC1(C)CCCC 209 3870445 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10048 3-(4-methylphO(c1ccc(C)cc 148 3858383 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10049 3-acetylandrosO=C(OC1(CCC2 165 3853942 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10050 10,13-dimethyO=C1CCC2C3C 240 3847168 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10051 N~1~-(4-methy
    O=[N+]([O-])c 160 3844428 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10052 5,5a,6a,7,12, O=C1C2Cc3ccc 226 3834835 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10053 5,5a,6a,7,12, O=C1C2Cc3ccc 393 3834835 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10054 17-(chloroethClC#CC1(C)CC 110 3831031 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10055 ethyl 3,7,12-t O=C1CCC2(C)C 223 3794804 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10056 3-hydroxy-5,5O=C1C(=C)C2( 246 3754345 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10057 3-oxocholest-4O=C1C=C2C(OC 102 3752634 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10058 17-hydroxypr O=C1CCC2(C)C 221 3749137 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10059 3-(2-{[tert-bu [Si](OC(C)CC 188 3730526 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10060 N,3-dioxo-2-pO=C1c2ccccc2 169 3727838 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10061 14-hydroxy-15O=C1C(=C)C2C 238 3727830 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10062 21-chloropregClC#CC1(O)CC 176 3648558 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10063 9H-fluoren-9- O=C(OCC1c2cc 155 3645504 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10064 3,5-di(acetyl O=C(OCC1OC(C 129 3639207 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10065 17-propoxyand
    OC1C=C2CCC3 125 3633906 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10066 1-(4'-nitrobip O=[N+]([O-])c 165 3632549 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10067 5-methyl-7,17O=C1CC2(C)CC 155 3632548 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10068 methyl 3,12-bO=C(OC1CCC2( 84 3630490 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10069 4a,5,6,7,7a,1 O=C1C=CC(=O 338 3623760 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10070 17-ethynyl-10OC1(C#C)CCC 198 3612510 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10071 2-hydroxy-4a,O=C1OC2=C(CC 233 3610255 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10072 3,4,4a,5,6,10 O=C1OC2c3cc 139 3600263 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10073 17-hydroxy-10O=C(OC1CCC2( 121 3595517 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10074 7,14,20-trihy O=C1C(C)C2CC 120 3579314 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10075 N-{2-[(4-methO=[N+]([O-])c 176 3578244 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10076 15-oxokaur-16O=C1C(=C)C2C 226 3577379 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10077 3-ethyl-17-ox O=C1CCC2C3C 126 3575935 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10078 cycloheptane-O=C(OC1CCCCC 170 3575934 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10079 pregn-4-en-20OC1C=C2CCC3C 204 3541304 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10080 2-methyl-5-niO=[N+]([O-]) 194 3536493 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10081 2,2'-benzene-1O=[N+]([O-]) 266 3533295 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10082 [17-(acetyloxyO=C(OC1CCC2 152 3521158 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10083 methyl 2-(17- O=C(OC)C(C)( 150 3513641 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10084 15,20-dioxo-7,O=C1C(=C)C2C 230 3513328 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10085 methyl 3-[bis S(C)C(SC)C1=C 165 3503942 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10086 3-acetyl-3-hy O=C1CCC2C3CC 212 3492797 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10087 10,17-dimethyO=C(OC1CCC2( 136 3492575 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10088 10-hydroxy-3-O=C1C=CC2(O 178 3483943 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10089 17-hydroxy-10O=C1C=C2CCC3 186 3479471 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10090 10,13-dimethyO=C1CCC2(C) 44 3477412 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10091 10,13-dimethyO=C1CCC2(C) 78 3477412 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10092 methyl 7-oxocO=C1CC2CCCCC 93 3470831 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10093 15-oxo-18,20-O=C1C(=C)C2C 224 3469160 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10094 androst-2-en-O=C(OC1CCC2 94 3462437 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10095 3-hydroxyandrO=C(OC1CCC2 96 3448734 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10096 10',13'-dimethO=C(OC1CCC2( 208 3447519 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10097 15-oxo-7,20-eO=C1C(C)C2CC 265 3447392 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10098 5,5,8,8,11a-p O=C1C(=C)C2( 221 3446562 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10099 17-hydroxy-21O=COC1CCC2(C 205 3424017 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10100 1-(hydroxymetO=C(O)C1NC(C 260 3420927 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10101 14-hydroxyanO=C1CCC2(C) 113 3261231 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10102 14-hydroxyanO=C1CCC2(C) 140 3261231 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10103 15-oxo-7,20-eO=C1C(=C)C2C 230 3259747 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10104 3-ethyl-10,13 OC1(CCC2(C)C 127 3258183 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10105 androst-8-eneO=C1CCC2(C) 148 3256147 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10106 6,11,12,14,16O=C1C(O)=C2C( 237 3255129 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10107 3-(1-methyletO=C1N(c2cccc 169 3247026 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10108 androst-14-enO=C1CCC2(C)C 116 3243537 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10109 21-chloropregClC#CC1(O)C 163 3242083 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10110 13-hydroxy-15O=C1C(=C)C2( 278 3235680 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10111 17-(benzyloxyO=C1C=C2CCC3 199 3233625 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10112 cyclohepta-3, O=C(OC1C=CC= 135 3221860 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10113 14-hydroxy-7-O=C1OCC23CCC 105 3221858 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10114 17-(benzyloxyO(Cc1ccccc1) 160 3220916 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10115 1,7,11,14,20- O=C1C(C)C2CC 278 3218809 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10116 17-methylandrO=C1CCC2(C)C 141 3216901 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10117 methyl 6-bro BrC1C(=O)C2C 124 3213225 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10118 17-propoxyand
    O=C1C=C2CCC 118 3209533 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10119 3-(2-{[tert-bu [Si](C)(C)(C) 190 3209409 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10120 14-hydroxy-7-O=C1C(C)C2CC 165 3203553 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10121 3-(4-methoxypO=C(OC1CCC2C 179 3202975 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10122 4-hydroxy-4b,O=C1CC2(C)C( 93 3199736 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10123 21-phenylpregOC1CCC2(C)C( 122 3199635 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10124 5,5'-dinitrobi O=[N+]([O-])c 186 3198506 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10125 14-methylandrOC1CCC2(C)C( 183 3192167 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10126 methyl 3,6,7, O=C(OC)CCC(C 162 3191891 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10127 5,8-dihydroxyO=C1CC2(C)C( 171 3191845 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10128 androst-5-eneOC1CCC2(C)C 202 3190162 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10129 androst-14-enO=C1CCC2(C)C 151 3188846 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10130 16-(1-hydroxyOC1CCC2(C)C3 221 3182764 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10131 ethyl 2-[17-( O=C(OCC)C(C) 138 3179435 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10132 3-(benzyloxy) O(Cc1ccccc1) 148 3179336 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10133 6-({[5-methyl-O=C(O)c1[nH0 120 3179334 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10134 7,11,14,18,20O=C1C(C)C2CC 266 3171790 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10135 17-hydroxypreO=C(OC1CCC2( 165 3168835 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10136 1,4,5,5a,6a,7 O=C1C2CC=3C 227 3168749 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10137 1,4,5,5a,6a,7 O=C1C2CC=3C 301 3168749 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10138 14-hydroxyandO=C1C=C2CCC3 258 3165276 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10139 androstan-16-O=C(OC1CC2C 108 3164898 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10140 3-(2-naphthalFC(F)(F)C=1N 171 3161332 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10141 3,3-dimethox O(C)C1(OC)CC 80 3159865 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10142 5-hydroxycholO=C1CCC2(C)C 223 3156911 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10143 4a,9,9a,10-te O=C1C=CC(=O) 128 3146549 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10144 4a,9,9a,10-te O=C1C=CC(=O) 225 3146549 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10145 methyl 7,12-dO=C1CC2CCCCC 140 3142477 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10146 ethyl 2-[17-( O=C(OCC)C(C) 147 3137613 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10147 7-oxocholan-2O=C1CC2CCCCC 145 3130401 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10148 3-bromo-2-ethBrC1C(OC(=CC 131 3129398 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10149 9-phenyl-1,4, O1C(c2ccccc2 168 3127799 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10150 5-hydroxy-3-oO=C1CCC2(C)C 161 3127045 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10151 7,14,20-trihy O=C1C(C)C2CC 220 3122377 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10152 cyclohepta-4, O=C(OC1C=CC= 181 3120875 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10153 7-methoxy-15-O=C1C(=C)C2C 214 3120792 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10154 methyl 7-(aceBrC1C(OC(=O) 159 3118049 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10155 4-(7-hydroxy- O=C1CC2C(C3C 219 3107840 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10156 3,3-dimethoxyOC12CCCC2(C 147 3107615 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10157 20-hydroxy-15O=C1C(=C)C2C 226 3107436 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10158 17-(1-hydroxyOC1CCC2(C)C3 206 3103035 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10159 ethyl 3,12-bi BrC1C(O)C2C3 166 3102300 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10160 5-methylpregnOC1CCC2(C)C3 219 3099395 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10161 5-methylpregnOC1CCC2(C)C3 255 3099395 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10162 17-eth-1-ynyl OC1CCC2(C)C( 257 3094050 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10163 10,13-dimethyOC1CCC2C3CC 212 3087524 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10164 methyl 1-bromBrCC1(OC(COC 149 3084691 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10165 2-cyanotetrahy
    O=C(OC1COC(C 134 3042856 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10166 2-amino-3-metOC(c1ccccc1)( 92 3035210 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10167 Nalpha-[(benzO=C(OCc1cccc 163 3028121 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10168 3,5-di(acetyloO=C(OCC1OC(O 98 3024888 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10169 3-(acetyloxy)-O=C(OCC1OC( 114 3022745 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10170 2,3-di(acetyloO=C(OCC(OC(= 188 2980393 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10171 5-nitro-2-furoO=[N+]([O-])c 171 2944832 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10172 4-methylpheny
    O=C(OCC1OC(O 126 2942015 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10173 1,11-dihydroxO=C1C(C)C2CC 217 2922446 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10174 1,11-dihydroxO=C1C(C)C2CC 237 2922446 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10175 ethyl 3,12-bi BrC1C(=O)C2C 125 2914532 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10176 14,17-dihydroO=C1C=C2CCC3 236 2909444 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10177 12-hydroxychoO=C(O)CCC(C 187 2909228 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10178 3-[(4-chlorop Clc1ccc(OCOC 145 2885785 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10179 14-hydroxyandO=C1C=C2CCC 180 2873617 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10180 3-ethyl-5-metOC1CCC2C3CCC 169 2852810 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10181 3,4-di(acetyloO=C(OCC1OC(O 132 2839354 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10182 androst-14-enOC1CCC2(C)C( 130 2837205 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10183 3-ethynyl-3-h O=C(OC1CCC2 196 2830490 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10184 1a-[(acetylox O=C(OCC1OC(O 135 2829348 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10185 ethyl 3,12-bis O=C(OC1CCC2( 84 2829164 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10186 2-Hydrazino-3O=[N+]([O-]) 165 2815692 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10187 2,4,6-trimeth S(Cc1c(C)c(C 209 2795870 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10188 6-chloro-5-hy ClC1CC2C3CCC 214 2787197 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10189 10',13'-dimethOC1CCC2(C)C 101 2777589 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10190 12-hydroxy-3-O=C1CCC2(C)C 108 2772107 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10191 2-(17-hydroxyO=C(O)C(C)(C 259 2768820 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10192 3-acetylandroO=C1CC2CC(CC 237 2761215 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10193 24-hydroxy-7,O=C1CC2CC(CC 208 2761145 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10194 5-methyl-2-(2O=C1OC2(CCC1 136 2759979 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10195 4-(10,13-dimeO=C1CC2CC3(O 222 2759439 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10196 2,3-di(acetyloO=C(OCC(OC(= 109 2753712 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10197 14-hydroxyandO=C1CCC2(C)C 199 2741685 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10198 14-hydroxyandO=C1CCC2(C)C 226 2741685 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10199 methyl 6,7-di O=C(OC)CCC(C 105 2737117 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10200 15-oxokaur-16O=C1C(=C)C2( 280 2732531 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10201 17-hydroxy-21O=C(OC1CCC2( 148 2727488 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10202 10,13,17-trimOC1(C)CCC2C 193 2724541 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10203 androst-15-enO=C1CCC2(C)C 173 2705341 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10204 methyl 3,12-bO=C(OC1CCC2( 176 2694181 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10205 6-(2-aminopheO=[N+]([O-])C 148 2682925 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10206 10,10a-dihydrO=C1c2ccccc 152 2659614 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10207 3-acetylandroO=C1CCC2C3C 153 2643688 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10208 17-ethynyl-11Oc1ccc2c(c1) 280 2621342 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10209 2-(17-hydroxyO=C(O)C(C)(C 264 2607639 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10210 3-(1-methyletO=C(OC1CCC2C 108 2603690 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10211 1-O-(9,15-dih O=C(OC1OC(CO 219 2594557 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10212 5,14-dimethylO=C1CCC2(C)C 185 2589924 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10213 1,2,3,4,5,8-h OC1CC=2CC=C 121 2585763 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10214 4,4-dimethylpOC1(C#C)CCC2 157 2583009 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10215 8,14-epoxyandO=C1CCC2(C) 172 2582051 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10216 15-oxokaur-16O=C1C(=C)C2C 237 2564999 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10217 [3-(hexopyranO=C1CC2C=C( 128 2546938 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10218 24,24-diphenylOC1CCC2(C)C( 220 2540762 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10219 5-cyanotetrahO=C(OC1OC(C# 111 2537505 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10220 6-bromo-24-hy
    BrC1C(=O)C2C 230 2520164 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10221 ethyl 3,12-di O=C1CC2CC(O) 161 2508647 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10222 ethyl 3,12-di O=C1CC2CC(O) 161 2508647 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10223 2-Hydroxymeth
    OCC1OC(Nc2c 151 2351405 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10224 REV-EYES [nH0]1[nH0]c 158 2298190 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10225 2-[(Diphenylm[S+]([O-])(CC 159 2297976 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10226 3-Allyl-5-sec- S=C1NC(CC(C) 210 2297355 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10227 Intranarcon S=C1NC(=O)C( 148 2297316 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10228 Ethyl-b-methylS=C1NC(=O)C( 160 2297301 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10229 2,5-di(2-thiens1cccc1C1=Nc2 159 2097162 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10230 5-(2,4-dichlo Clc1ccc(C=C2C 156 2083073 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10231 3,3,3-trifluo FC(F)(F)C(C(= 194 2081234 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10232 DIETHYL 2,2'- S1C(SC1=C(C# 161 2080784 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10233 ethyl 2-cyano S(C)C(N(C)C) 92 2080776 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10234 dimethyl 3,3- O=C(OC)CC(CC( 199 2080360 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10235 N-phenyl-N'-[5s1c([nH0][nH0 150 2079630 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10236 2,3-diphenylbO=C(O)C(c1ccc 129 2073061 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10237 benzyl 1,3,6- O=C1N(C)C(C) 86 2072970 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10238 ethyl 6-methyO=[N+]([O-]) 228 2072966 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10239 benzyl 1,6-di O=C1NC(c2ccc 150 2072962 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10240 N-(4-chloro-2 Clc1ccc(NC(=O 98 2068038 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10241 ethyl 4-(4-hy O=C1NC(C)=C( 190 2067096 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10242 5-pyrimidinecaS=C1NC(c2ccc 147 2064255 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10243 1-naphthalen-O=C(c1ccccc1) 87 2063730 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10244 4-Amino-5-(triSc1[nH0][nH0] 141 2060960 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10245 3-chloroandroClC1CCC2(C)C 157 2060920 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10246 methyl cyano(O=[N+]([O-]) 88 2059455 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10247 3-[Bis(methyl S(C)C(SC)=C(C 61 2058842 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10248 1H-pyrazole-3OCc1[nH0][nH0 41 2056684 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10249 (4-ethoxy-4-o[Br-].[P+](CC 160 2054055 http://dx.doi Karthikeyan M.
    x salt - AL
    10250 3,3-dimethyl- O=C(N)C1Nc2c 169 2036677 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10251 10-chloro-2,4 Clc1ccc2oc3CC 93 2036675 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10252 5-methylestr- O=C1CCC2C=3 149 2036674 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10253 4,6-dimethyl- [nH0]1c2[nH0] 66 2036671 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10254 2-[(4-phenylb O=C1C=C(NCCC 137 2036670 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10255 3,5,7-trinitro O=[N+]([O-])c 235 2036668 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10256 2-({2-[(1-met O=C1C=C(NCCN 257 2036666 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10257 4-[(Z)-(5-cya [O-][N+](=Nc1 265 2036664 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10258 5-amino-1-(4-Clc1ccc([nH0] 80 2036659 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10259 1,2-bis(4-fluo Fc1ccc(cc1)C( 153 2036658 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10260 isoxazolo[5,4-Brc1[nH0]oc2 135 2036652 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10261 1-phenyl-1H-pNc1[nH0][nH0] 210 2036648 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10262 2-[(2,2-dieth O=C1C=CC(=O 70 2036646 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10263 N-[2-(4-aminoO=[N+]([O-])c 281 2036644 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10264 2-(3,5-dinitro O=[N+]([O-])c 130 2036643 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10265 bis(4-fluorop Fc1ccc(cc1)C( 140 2036636 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10266 1-methyl-4-pen
    O=C1N(c2[nH0 211 2036634 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10267 2-[(2-pyridin O=C1C=C(NCCc 129 2036633 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10268 2-[(4-nitrobe O=[N+]([O-]) 235 2036631 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10269 1,6-dimethyl- [nH0]1c2[nH0] 184 2036629 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10270 1-[5-(2-NitropO=[N+]([O-])c 79 2036627 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10271 2-(1H-indazol-O=C1N(C(=O)c 240 2036626 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10272 2-[(1-methyl- O=[N+]([O-])c 299 2036623 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10273 benzamide, 3,5
    O=[N+]([O-])c 201 2036622 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10274 isoxazolo[4,5 Oc1[nH0]oc2[ 323 2036620 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10275 2-[(3-phenylp O=C1C=C(NCCC 116 2036614 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10276 1-(4-methylbeNc1[nH0]c[nH0 222 2036613 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10277 4-amino-1-pheO=C(N)c1[nH0] 295 2036610 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10278 3-amino-1-metO=C1C=2C(=N 224 2036607 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10279 2-[(pyridin-4 O=C1C=C(NCc2 166 2036603 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10280 1-cyclohexyl- O=C1N=CN=C2 252 2036598 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10281 5-amino-3-broBrc1[nH0][nH 254 2036597 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10282 benzamide, 3,5
    O=[N+]([O-])c 166 2036592 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10283 benzamide, N-Clc1ccc(cc1)C 201 2036591 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10284 1-methyl-3-niO=[N+]([O-]) 223 2036589 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10285 3-amino-1-metO=C1C=CN=C2 218 2036588 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10286 1-phenyl-1,2- O=C1C=CN=C2 167 2036587 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10287 ethyl 1-methyO=C1C=2CNN( 139 2036584 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10288 N-(1-acetyl-1HO=C(Nc1[nH0] 218 2036582 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10289 N-(2-aminoethO=C(NCCN)CC[ 196 2036578 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10290 1-(3-{[(3,5-d [Br-].O=[N+]( 195 2036574 http://dx.doi Karthikeyan M.
    x salt - AL
    10291 2,4,6-Trinitro O=[N+]([O-])c 156 2036571 http://dx.doi Karthikeyan M.
    x mixture - AL
    10292 2-chloro-4,4'- Clc1cc([N+](= 145 2036570 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10293 N-oxo-N-pyrazo
    O=[N+]([O-]) 205 2036568 http://dx.doi Karthikeyan M.
    x salt - AL
    10294 3-methoxy-4-nO=[N+]([O-])c 127 2036567 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10295 (4-oxo-4,7-dihO=C1N(C=NC2 76 2036559 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10296 4-ethoxyphenyO=C(Oc1ccc(O 104 2036552 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10297 7-chloro-2,3- ClC1=CC=CC=2 98 2036551 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10298 2,3-diphenyl- N1c2ccccc2C(c 173 2036550 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10299 5-methyl-2,3-N1c2ccc(C)cc2 155 2036549 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10300 1,1'-(hydrazin[nH0]1[nH0](c 170 2036547 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10301 N-(3-Fluoro-4 Fc1cc(NC(=O)C 176 2036543 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10302 2,4,6-trinitro O=[N+]([O-])c 146 2036542 http://dx.doi Karthikeyan M.
    x mixture - AL
    10303 2-{[(5-methyl O=C1C=C(NCc2 135 2036536 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10304 2-[(2,5-dimet O=C1C=C(NCc2 164 2036535 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10305 N-(4-methoxyb
    O=[N+]([O-])c 151 2036534 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10306 N-(2,4-dimethO=[N+]([O-])c 180 2036533 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10307 N-(2-bromoeth
    BrCCNC(=O)c1c 140 2036531 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10308 1-(2-methoxypO=C1N=CN=C2 271 2036529 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10309 N-(3-bromopro
    BrCCCNC(=O)c1 195 2036528 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10310 N-(3-Bromo-4-Brc1cc(NC(=O) 145 2036525 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10311 2-(1H-pyrazoloO=C1N(C(=O)c 254 2036524 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10312 N-[4-(dimethyO=[N+]([O-])c 145 2036523 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10313 3,5-dinitro-N O=[N+]([O-])c 251 2036522 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10314 3,5-dinitro-N O=[N+]([O-])c 123 2036521 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10315 2-[(3,3-dimet O=C1C=C(NCCC 114 2036520 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10316 4-nitro-1-(4-nO=[N+]([O-])c 231 2036519 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10317 ethyl (4-methO=[N+]([O-])c 65 2036515 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10318 ethyl (4-chlo Clc1cc([N+](= 167 2036514 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10319 ethyl (2,3-di O=[N+]([O-])c 103 2036513 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10320 Ethyl (4-meth O=[N+]([O-]) 65 2036512 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10321 1-Methyl-5-niO=[N+]([O-]) 269 2036510 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10322 1-(3-aminoproCl.NCCC[nH0] 297 2036508 http://dx.doi Karthikeyan M.
    x salt - AL
    10323 1-(2,4-dinitro O=[N+]([O-])c 261 2036506 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10324 2-{[(pyridin- O=C1C=C(NCNc 135 2036503 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10325 2-[(4-methoxyO=C1C=C(NCc2 164 2036502 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10326 2-{[2-(phenyl O=C1C=C(NCCN 141 2036501 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10327 2-{[4-(dimeth O=C1C=C(NCc2 166 2036499 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10328 2-[(pyridin-3 O=C1C=C(NCc2 209 2036498 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10329 2-[(3,4-dichl Clc1ccc(cc1C 217 2036497 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10330 2-[(4-chlorob Clc1ccc(cc1) 230 2036496 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10331 2-[(3-chlorob Clc1cccc(c1) 191 2036495 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10332 2-(benzylaminClC1=C(Cl)C(= 231 2036494 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10333 4-chloro-3,6-dClC=1C(=O)C( 179 2036493 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10334 4-chloro-3,6-dClC=1C(=O)C( 266 2036492 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10335 4-(benzylamino
    ClC=1C(=O)C( 233 2036491 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10336 1,2-ethanediaNCCNc1[nH0]c 297 2036484 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10337 2-(1H-pyrazol-O=C1N(c2c[nH 260 2036482 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10338 2-(1H-BenzimiO=C1N(c2[nH0 274 2036481 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10339 1-(4-methoxypOC(c1ccccc1)C 129 2036477 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10340 4,4-dimethyl- O=C1OOC(=O) 45 2036467 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10341 pentacyclo[6. NC12c3ccccc3 220 2036463 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10342 4-(2-ethenylp N=1NC=C(C=1) 114 2036460 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10343 1,2-bis(tert-b S(C1(C#N)CC1( 104 2036427 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10344 2-phenylhexahO=C1N2N(C(= 144 2036420 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10345 2-phenyl-4a,5,O=C1N2N(C(=O 146 2036419 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10346 4-phenyl-1-(3aO=C1NN(C(=O) 155 2036415 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10347 4-[2-({[4-(4-t O=C(O)CCCOc1 147 2036412 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10348 methyl 4-(1-mO=C(OC)c1ccc 61 2036403 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10349 3-(7-methylspO=C1OC(=O)C( 98 2036400 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10350 2,2,8,8-tetra CC(C)(C)C=C= 135 2036367 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10351 (3beta,4alpha,OC1CCC2(C)C3 123 2036358 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10352 (3beta,4alphaOC1CCC2(C)C( 162 2036357 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10353 [1-(4-nitroph O=[N+]([O-])c 333 2036355 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10354 3-hydroxy-3-( O=C1CCCC1C1 187 2036353 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10355 2-oxo-3'-thioxS=C1NC2(c3c 222 2036350 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10356 3-{[(3-sulfany S=C1Oc2cccc 188 2036348 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10357 5-chloro-3-ox ClC=1NN(c2cc 167 2036343 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10358 [1-(4-chlorop Clc1ccc(cc1) 100 2036342 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10359 2-(1-acetyl-2 S1C2=C(N(c3c 254 2036340 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10360 diethyl 5-aminS1c2sc(cc2C( 133 2036339 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10361 2'-oxo-3-thioxS=C1NC2(c3c 311 2036338 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10362 2,2'-(piperazi S=C1N(N=C(N1 333 2036337 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10363 3-[(1,3-benzotS=C1Sc2ccccc 211 2036336 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10364 ethyl 4-[2-({[ O=C(OCC)CCCO 112 2036331 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10365 1-methylpropyl
    ClC1N2Oc3ccc 97 2036330 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10366 1-methylethylClC1N2Oc3ccc 98 2036329 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10367 ethyl 7,8,9-tr ClC1N2Oc3ccc 105 2036328 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10368 4-(methoxymet
    O=[N+]([O-])c 123 2036319 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10369 ethyl 5-hydro O=C(OCC)C(C) 132 2036318 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10370 N,N'-(3,3'-dimO=CNc1ccc(cc 268 2036309 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10371 4-(4-tert-but O=C1c2ccc(OC 166 2036255 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10372 5'-methoxy-1',O=C1CCC2(CC1 120 2036253 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10373 3,3'-(5-methoO=C1c2ccc(OC 151 2036252 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10374 5-tert-butyl- Clc1[nH0]c(c[ 146 2036250 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10375 5-tert-butyl- O=C(Nc1c(C)cc 85 2036249 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10376 6-chloro-N-(2 Clc1[nH0]c(c[ 122 2036248 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10377 N-[3,5-bis(tri Clc1[nH0]c(c[ 99 2036247 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10378 N-[3,5-bis(tri FC(F)(F)c1cc( 136 2036246 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10379 N-[3,5-bis(tr Clc1[nH0]c(c[ 133 2036245 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10380 N-(3-bromophe
    Brc1cccc(NC(= 105 2036244 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10381 N-(3-bromophe
    Brc1cccc(NC(= 114 2036243 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10382 N-(3-bromophe
    Brc1cccc(NC(= 100 2036242 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10383 5-tert-butyl- Clc1[nH0]c(c[ 119 2036241 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10384 5-tert-butyl- O=C(Nc1ccccc1 78 2036240 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10385 6-chloro-N-(2 Clc1[nH0]c(c 72 2036239 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10386 5-tert-butyl- Clc1[nH0]c(c[ 99 2036238 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10387 5-tert-butyl- O=C(Nc1cccc(C 95 2036237 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10388 6-chloro-N-(3 Clc1[nH0]c(c[ 84 2036236 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10389 5-tert-butyl- Clc1[nH0]c(c[ 115 2036235 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10390 5-tert-butyl- O=C(Nc1ccccc1 81 2036234 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10391 6-chloro-N-(2 Clc1[nH0]c(c[ 98 2036233 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10392 6,7,8,9-tetra Clc1c(Cl)c(Cl 159 2036231 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10393 4,5,6,7-tetrac Clc1c2OC(Oc2c 188 2036230 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10394 4,5,6,7-tetra Clc1c2OC(Oc2c 160 2036229 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10395 4,5,6,7-tetrac Clc1c2OC(Oc2c 153 2036228 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10396 4,5,6,7-tetra Clc1c2OC(Oc2c 115 2036227 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10397 N-[2-(1H-imidO=C(NCCC=1N 176 2036226 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10398 3-(4H-imidazoO=C(NCCC=1N 164 2036225 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10399 N-{5-[(tricyc O=C(O)CCC(NC 200 2036224 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10400 diethyl N-[(1 [P+]([O-])(O 81 2036223 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10401 4-(1,3-dioxo-1[P+]([O-])(O 114 2036222 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10402 diphenyl (1-{ [P+]([O-])(O 144 2036221 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10403 diphenyl [1-({ [P+]([O-])(O 107 2036220 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10404 N-{[2-(1,3-dioO=C1N(CCOCC( 194 2036219 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10405 {2-[(tricyclo[ O=C(O)COCCN 122 2036218 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10406 diphenyl [1-( [P+]([O-])(O 150 2036217 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10407 [2-(1,3-dioxo-O=C1N(CCOCC( 128 2036216 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10408 2-[2-(2-hydro O=C1N(CCOCCO 64 2036215 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10409 ethyl 5-aminoS(C)c1[nH0][n 95 2036203 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10410 ethyl 5-aminoS(C)c1[nH0][n 120 2036202 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10411 ethyl 5-aminoS(C)c1[nH0][ 205 2036201 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10412 ethyl 5-amino-S(C)c1[nH0][n 158 2036200 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10413 ethyl 5-amino-S(C)c1[nH0][n 153 2036199 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10414 ethyl 5-aminoS(C)c1[nH0][n 160 2036198 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10415 ethyl 5-amino-S(C)c1[nH0][n 181 2036196 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10416 {2,6-bis[bis(mS(C)C(SC)=C1 156 2036193 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10417 3,3-bis(benzy S(Cc1ccccc1)C 104 2036192 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10418 {2,6-bis[bis(e S(CC)C(SCC)= 101 2036191 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10419 methyl 3,3-bi S(Cc1ccccc1) 104 2036190 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10420 ethyl cyano(1,S1CCSC1=C(C 106 2036189 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10421 methyl 4-(4-teO=C(OC)c1ccc2 117 2036188 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10422 3,3-bis(benzylS(Cc1ccccc1) 123 2036187 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10423 ethyl 3,3-bis( S(Cc1ccccc1) 82 2036186 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10424 N-benzyl-2-cyS(C)C(SC)=C( 81 2036185 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10425 ethyl 5-aminoS(C)c1[nH0][ 155 2036182 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10426 ethyl 5-aminoS=C(N)[nH0]1 149 2036181 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10427 2-(4a-methyl-O=C1c2ccccc 203 2036180 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10428 (13E,14aR,18aO=C1Nc2cccc 224 2036178 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10429 (1S,5R)-2,2,4, ClC1(Cl)C(=O) 90 2036175 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10430 Ethyl-1-benzyO=C(OCC)c1[nH 37 2036166 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10431 ethyl 1',5,5'- O=C(OCC)c1[nH 72 2036165 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10432 ethyl 5,5'-dimO=C(OCC)c1[n 121 2036164 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10433 N-benzyl-1-(3 [nH0]1[nH0](C 71 2036162 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10434 (5-methyl-1-pOCc1[nH0][nH0 45 2036159 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10435 1H-pyrazole-3-O=C(OC)c1[nH0 93 2036157 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10436 diethyl 1,1'- O=C(OCC)c1[n 130 2036156 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10437 2-{bis[(3,5-d OCCN(C[nH0]1 83 2036155 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10438 4-(4-tert-butyOc1ccc2CC3(CC 131 2036153 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10439 N,N-dimethyl-N=1N(c2ccccc2 186 2036152 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10440 5-(4-methoxypO=C(N)N1N=C( 174 2036151 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10441 1-acetyl-5-(2 Clc1ccccc1C1 173 2036150 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10442 5-(4-methylphN=1N(c2ccccc2 168 2036149 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10443 2-amino-4-(4-Brc1ccc(cc1) 282 2036146 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10444 7-(4-bromophe
    Brc1ccc(cc1) 230 2036145 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10445 7-(4-bromophe
    Brc1ccc(cc1) 196 2036144 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10446 ethyl 4-(4-br Brc1ccc(cc1) 158 2036143 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10447 ethyl 4-(4-br Brc1ccc(cc1) 140 2036142 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10448 4-(4-tert-butyO=C1c2ccc(OC 116 2036079 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10449 4-(4-tert-butyO=C1c2ccc(OC 167 2036079 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10450 S-(2-aminopheS(c1ccccc1N)C 105 2036061 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10451 benzamide, N-Brc1ccc(cc1)c 115 2036060 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10452 4-(4-tert-butyO(C)c1ccc2CC3 75 2036059 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10453 4-(4-tert-butyO(C)c1ccc2CC3 85 2036059 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10454 ethyl 2-(prop O=C(OCC)NNC 95 2036038 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10455 ethyl 2-(cycl O=C(OCC)NNC 116 2036037 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10456 ethyl 2-(cycl O=C(OCC)NNC 145 2036037 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10457 ethyl 2-[(3,4 Clc1ccc(NC(= 207 2036036 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10458 ethyl 2-[(4-c Clc1ccc(NC(= 194 2036035 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10459 (1R,2S,5R,6S)-OC1C2CCC1C1 122 2035975 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10460 (1R,2R,5S,6S) O=C1C2CCC1C 97 2035974 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10461 4-(4-tert-butyOC1c2ccc(OC) 104 2035948 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10462 N-[2-(2-chlor Clc1ccccc1C1 250 2035765 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10463 5-[2-(2-methylSc1oc([nH0][ 209 2035762 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10464 1-{2-[5-(benzyS(Cc1ccccc1)c 130 2035759 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10465 1-{2-[5-(ethyl S(CC)c1[nH0][ 110 2035758 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10466 (2-{bis[(diph P(CN(CP(c1ccc 147 2035756 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10467 (3E)-3-(2-oxo O=C1Nc2cccc 267 2035590 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10468 diethyl 3,4-b s1c2sc(c(NC( 287 2035589 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10469 diethyl 3,4-b s1c2sc(c(N=C 267 2035587 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10470 7-phenyl-2-(trS=C1N=C(N=C2 222 2035586 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10471 2-acetylchromO=C1N(N=C2O 170 2035585 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10472 ethyl {[5-thio Sc1[nH0][nH0 232 2035583 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10473 6-methyl-6-(4-S1c2[nH0][nH0 255 2035581 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10474 2-(4-methoxyph
    [S-][P+]1(Sc2 211 2035580 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10475 phenyl[3-(trif S1c2[nH0][nH0 157 2035577 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10476 1-[3-(trifluor S1c2[nH0][nH0 200 2035576 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10477 (4Z)-1-phenyl-S1C=C(SC1=C1 289 2035573 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10478 dimethyl (4,9 S1C2=C(N(c3c 239 2035570 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10479 (3,5-dioxo-1-pO=C1NN(c2ccc 289 2035569 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10480 1-[5-(trifluor s1c([nH0][nH 221 2035567 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10481 1,3-dihydrospN1c2ccccc2N 190 2035565 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10482 3H-spiro[1,3- O1c2ccccc2N 244 2035564 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10483 3H-spiro[1,3- O1c2ccccc2N 221 2035563 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10484 [1,3]dithiolo[ S1c2[nH0]c3c 221 2035562 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10485 3'-amino-2-oxo
    O=C1Nc2cccc 231 2035559 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10486 3-oxo-1,4-diphS=C1N=C2N(NC 142 2035558 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10487 3-(trifluoromeS=C1Sc2[nH0][ 160 2035556 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10488 diethyl 3,4-bi s1c2sc(c(N=C 198 2035555 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10489 N-benzyl-2-(2 [nH0]1c2ccccc 160 2035553 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10490 3-[(4-chlorop Clc1ccc(OCC( 143 2035529 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10491 methyl 2-(ethO=C1Oc2ccccc 210 2035526 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10492 ethyl 2-(methO=C1Oc2ccccc 233 2035525 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10493 ethyl 2-aminoO=C1Oc2ccccc 192 2035524 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10494 2-amino-5-oxoO=C1Oc2ccccc 289 2035523 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10495 methyl 2-methO=C1Oc2ccccc 215 2035522 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10496 ethyl 1-benzy O=C1Oc2ccccc 212 2035521 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10497 ethyl 1-methyO=C1Oc2ccccc 203 2035520 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10498 4-(pentylami O=C1Oc2cccc 163 2035519 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10499 4-Butylamino O=C1Oc2cccc 118 2035518 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10500 4-amino-3-(moO=C1Oc2cccc 192 2035517 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10501 4-amino-3-(azO=C1Oc2cccc 153 2035516 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10502 4-amino-3-(piO=C1Oc2cccc 190 2035515 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10503 4-amino-3-(pyO=C1Oc2cccc 197 2035514 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10504 4-amino-3-[(dO=C1Oc2ccccc 133 2035513 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10505 4-(methylami O=C1Oc2ccccc 198 2035512 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10506 4-(methylami O=CC=1C(=O) 216 2035511 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10507 ethyl 3,4-dia s1c2sc(c(N)c 262 2035510 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10508 diphenyl 3,4- s1c2sc(c(N)c2 165 2035509 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10509 diethyl 3,4-d s1c2sc(c(N)c 201 2035508 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10510 5-amino-1,3-dO=C(N)c1c(N)[ 200 2035507 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10511 4-(1H-pyrrol-1Sc1[nH0][nH0] 165 2035506 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10512 5-amino-1,3-dN#Cc1c(N)[nH0 161 2035505 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10513 triethyl (2E)- O=[N+]([O-]) 110 2035502 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10514 3-[(aminosulf S(N)CC1=Cc2c 256 2035501 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10515 ethyl 2-thiox S=C1Oc2cccc 91 2035499 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10516 4,4-Dibromo-1BrC1(Br)C(=O 119 2035498 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10517 2-Amino-4-phe
    O1C(N)=C(C#N 261 2035497 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10518 4-[(E)-(4-methO=C1NN(c2ccc 247 2035496 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10519 1-(4,5-DimethO=[N+]([O-])c 152 2035472 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10520 (4,5-DimethoxO=[N+]([O-])c 110 2035471 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10521 (4,5-dimethoxO=[N+]([O-])c 121 2035470 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10522 (4,5-dimethoxO=[N+]([O-])c 147 2035469 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10523 (3-bromopheny
    Brc1cccc(c1)C 119 2035468 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10524 (4-ChlorophenClc1ccc(cc1)C 142 2035467 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10525 biphenyl-4-yl O=[N+]([O-])c 145 2035466 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10526 (2,4-dichloro Clc1ccc(c(Cl) 128 2035465 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10527 3-Bromo-3',4 Brc1cccc(c1)C 97 2035464 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10528 methanone, (2Clc1ccccc1C(= 126 2035463 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10529 (3,4-dimetho O=C(c1cccc(C) 93 2035462 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10530 (3,4-dimetho O=C(c1ccc(OC) 79 2035461 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10531 5,5-Dimethyl-O=[N+]([O-]) 186 2035459 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10532 3-[(4-BromophBrc1ccc(NN=C 132 2035458 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10533 2-[(2-Nitro-phO=[N+]([O-]) 196 2035455 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10534 3-[(3-Nitroph O=[N+]([O-])c 184 2035453 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10535 5-{[5-(4-Chlo Clc1ccc(cc1) 109 2035451 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10536 2,2-dimethyl- O=C1OC(OC(=O 106 2035450 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10537 5,5-dimethyl- O=[N+]([O-]) 140 2035449 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10538 2-[(4-hydroxy O=C1CC(C)(C) 206 2035448 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10539 5-[(4-HydroxyO=C1OC(OC(=O 238 2035438 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10540 5-[(4-methoxyO=C1OC(OC(=O 128 2035437 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10541 2,2-dimethyl- O=[N+]([O-]) 192 2035436 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10542 5-{[5-(2-meth S=C1NC(=O)C( 235 2035419 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10543 5-{[5-(2-MethO=C1NC(=O)C( 220 2035418 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10544 N,N',N'',N'''- O=C(Nc1ccc(c( 279 2035344 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10545 4-hydrazino-1O=C1N(C)c2cc 216 2035339 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10546 N-acetyl-3-(1,O=C(NC(Cc1cc 92 2035321 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10547 acetyl(2,3,5, [Hg](c1c(C)c( 158 2035308 http://dx.doi Karthikeyan M.
    x metal - AL
    10548 benzo[5,6]phe[nH0]1cccc2cc 270 2035287 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10549 3-(3-methoxypO=C(O)CCC(c1 137 2035286 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10550 ethyl 8-methoO=C1OC2=C(C= 142 2035279 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10551 3-(4-methoxypO=C(O)CCC(c1 121 2035275 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10552 trinaphthalenP(c1ccc2ccccc 228 2035264 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10553 hexane-1,6-diP(CCCCCCP(c1c 127 2035262 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10554 (diphenylphosP(c1ccccc1)(c 157 2035261 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10555 8-methoxy-3,3O=C1OC=2c3cc 129 2035178 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10556 3,3-dimethyl- O=C1NC(c2ccc 150 2035173 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10557 1-[2-nitro-4- FC(F)(F)c1ccc 91 2035168 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10558 3-(6-hydroxy- O=C(O)C(C)(C 163 2035164 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10559 4-ethyl-8-metO=C1OC=2c3cc 143 2035162 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10560 2-methyl-2-(2O=C(CC)C1CCC 115 2035161 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10561 3,3-dimethyl- O=C1OC=2CCCC 95 2035159 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10562 methyl 1-(hydO=C(OC)c1[nH 89 2035044 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10563 1-phenylazep O=C1N(CCCCC1 57 2035026 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10564 4H-Pyrano[3,2O=C1N(Cc2ccc 276 2034999 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10565 methyl 2-aminO=[N+]([O-]) 216 2034994 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10566 methyl 2-aminO=C1N(CCc2cc 212 2034978 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10567 4H-Pyrano[3,2O=C1N(CCc2cc 264 2034975 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10568 ethyl 1-(hydr O=C(OCC)c1[n 71 2034956 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10569 N,N'-[(4-etho O=C(NC(NC(=O 211 2034951 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10570 N,N'-({2-[(2- Clc1ccccc1CO 242 2034950 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10571 Piperidin-1-yl S=C(N1CCCCC1 93 2034948 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10572 4-[(2Z)-2-[(ph s1cccc1C(=O) 220 2034926 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10573 5-(2-chlorophClc1ccccc1N1 180 2034925 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10574 7-(4-chlorophClc1ccc(cc1) 139 2034923 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10575 5,7-dimethyl-3Nc1[nH0][nH0 229 2034916 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10576 3-(2-naphthalFC(F)(F)C=1N 151 2034910 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10577 5,7-dimethyl-3Nc1[nH0][nH0 246 2034909 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10578 3-[(4-chlorophClc1ccc(cc1) 173 2034902 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10579 5-(4-hydroxypO=C1N(C(=O)C 99 2034901 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10580 {4-methyl-5-[(s1c([nH0]c(C) 234 2034897 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10581 {5-[(E)-(4-mets1c([nH0]c(C 159 2034896 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10582 5-(4-chlorophClc1ccc(N2C( 121 2034862 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10583 7-(4-chlorophClc1ccc(cc1)c 171 2034856 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10584 3-methyl-7-(4o1[nH0]c2c(c( 206 2034855 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10585 3,4-dimethyl- o1[nH0]c2c(c( 180 2034854 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10586 3-[(4-bromophBrc1ccc(cc1)C 151 2034853 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10587 3-[(4-methylpO=[N+]([O-])c 176 2034852 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10588 4-{3-[(4-chlor Clc1ccc(cc1)C 286 2034851 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10589 5-(4-bromophe
    Brc1ccc(N2C(= 256 2034850 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10590 5-(2,5-dichlo Clc1ccc(Cl)c( 241 2034849 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10591 5-(4-fluoroph Fc1ccc(N2C(= 212 2034848 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10592 4-(3-{[3-(ethoO=C1N(C(=O)C 282 2034845 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10593 ethyl 4-{[5-(2 Clc1ccc(Cl)c 226 2034844 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10594 ethyl 4-{[5-( O=C1N(C(=O)C 221 2034843 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10595 ethyl 4-{[5-(4 Fc1ccc(N2C(= 211 2034842 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10596 3-[(E)-(2,5-di Clc1ccc(Cl)c( 280 2034836 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10597 5-(4-hydroxypO=[N+]([O-]) 213 2034833 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10598 5-(4-chlorophClc1ccc(N2C( 152 2034832 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10599 4-{3-[(4-methyO=C1N(C(=O)C 201 2034831 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10600 5-(2,5-dichlo Clc1ccc(Cl)c 191 2034830 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10601 5-(4-methoxypO=C1N(C(=O)C 126 2034829 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10602 5-(4-fluoroph Fc1ccc(N2C(= 156 2034828 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10603 5-(4-chlorophClc1ccc(N2C( 137 2034827 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10604 3-[(4-chlorop Clc1ccc(cc1)C 126 2034824 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10605 2-(4-Methoxyph
    s1cccc1C1=Nc2 201 2034808 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10606 4-{(E)-[2-amins1cccc1C1=Nc2 184 2034806 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10607 3-[(E)-(3-nitr s1cccc1C1=Nc2 246 2034805 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10608 3-[(E)-(4-fluo s1cccc1C1=Nc2 221 2034804 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10609 3-(4-bromophe
    Brc1ccc(cc1) 171 2034803 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10610 3-(4-methylphe
    S1C=C(N2C1=N 186 2034802 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10611 2-(naphthalen-S1C2=NC(=O)c 241 2034801 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10612 2-[(4-methylphS1C2=NC(=O)c 211 2034799 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10613 6,6-dimethyl- s1cccc1C(=O) 131 2034793 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10614 N-[(2Z)-3-(4- s1cccc1C(=O) 236 2034790 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10615 N-[(2Z)-3-(2-ns1cccc1C(=O) 239 2034789 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10616 1-amino-4-metO=C1N(N)C(=C 189 2034784 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10617 3-(2-pyridin-3FC(F)(F)C=1N 157 2034780 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10618 3-[2-(4-chlor Clc1ccc(NNC= 151 2034779 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10619 5-naphthalen-s1cccc1C(=O) 80 2034778 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10620 5-(3-nitrophens1cccc1C(=O) 164 2034777 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10621 5-(2,5-dichlo Clc1ccc(Cl)c 221 2034776 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10622 4-[4,6-dioxo-3s1cccc1C(=O) 209 2034775 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10623 5-(4-methylphs1cccc1C(=O) 160 2034774 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10624 5-phenyl-3-(t s1cccc1C(=O) 174 2034773 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10625 (2E)-2-(1,3-bes1c2ccccc2[n 156 2034770 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10626 ethyl 6-aminos1c2ccccc2[n 215 2034768 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10627 ethyl 6-aminoClc1ccc(cc1) 189 2034767 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10628 2,6-diamino-5S1C(N)=C(C#N) 211 2034766 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10629 3H-Pyrido[2,1-Clc1ccc(cc1) 209 2034765 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10630 2-cyano-3-(4- S1c2ccccc2N2 199 2034764 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10631 5,7-dimethyl-3Clc1cc(Cl)c(N 296 2034763 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10632 5-(2,5-dichlor Clc1ccc(Cl)c( 216 2034762 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10633 5-(4-fluoroph Fc1ccc(N2C(= 173 2034761 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10634 5-(4-methoxypO=C1N(C(=O)C 166 2034760 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10635 5-phenyl-3-(p O=C1N(C(=O)C 161 2034759 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10636 5-methyl-3-[(EClc1cc(Cl)c(N 229 2034758 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10637 3-[(E)-(2,4-di FC(F)(F)C=1[n 220 2034754 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10638 3-[(E)-(2-chlo Clc1ccccc1N= 239 2034753 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10639 5-methyl-3-[(EFC(F)(F)C=1[n 236 2034752 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10640 3-[(E)-(4-met FC(F)(F)C=1[n 159 2034751 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10641 3-[(E)-(4-chlo Clc1ccc(N=Nc2 251 2034750 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10642 5-methyl-3-[(EFC(F)(F)C=1[n 202 2034749 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10643 benz[a]acridi O=C1CC(C)(C) 328 2034736 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10644 benz[a]acridinClc1ccc(c(Cl) 349 2034735 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10645 12-(4-hydroxyO=C1CC(C)(C) 314 2034734 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10646 benz[a]acridi O=C1CC(C)(C) 289 2034733 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10647 benz[a]acridinFc1ccc(cc1)C 204 2034732 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10648 7-[4-(dimethyO=C1CC(C)(C) 272 2034731 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10649 7-(2,4-dichlo Clc1ccc(c(Cl) 222 2034730 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10650 7-(4-hydroxypO=C1CC(C)(C) 313 2034729 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10651 7-(4-fluoroph Fc1ccc(cc1)C 279 2034728 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10652 4-[(2,4-dichl Clc1ccc(c(Cl) 249 2034721 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10653 4-{[4-(dimeth FC(F)(F)C1=NN 171 2034720 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10654 4-[(2-chlorop Clc1ccccc1C(O 251 2034719 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10655 4-[hydroxy(4- FC(F)(F)C1=NN 211 2034718 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10656 4-[hydroxy(4- FC(F)(F)C1=NN 257 2034717 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10657 4-[(4-chlorop Clc1ccc(cc1)C 168 2034716 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10658 4-[hydroxy(phFC(F)(F)C1=NN 259 2034715 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10659 diethyl 2,6-di FC(F)(F)C1(O) 91 2034714 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10660 diethyl 2,6-di FC(F)(F)C1(O) 109 2034713 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10661 6-amino-1-phen
    Clc1cc(Cl)c(c 207 2034712 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10662 6-amino-4-(2,4Clc1ccc(c(Cl) 210 2034711 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10663 6-amino-4-(4-FC(F)(F)c1[nH 218 2034710 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10664 6-amino-4-(4-FC(F)(F)c1[nH 211 2034709 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10665 6-amino-4-(4-FC(F)(F)c1[nH 205 2034708 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10666 6-amino-4-(4-cClc1ccc(cc1)C 221 2034707 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10667 6-amino-4-(4-fFc1ccc(cc1)C1 202 2034706 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10668 6-amino-1,4-diFC(F)(F)c1[nH 191 2034705 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10669 pyrano[2,3-c]pClc1ccccc1C1c 181 2034704 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10670 6-amino-4-(4-FC(F)(F)c1[nH 197 2034703 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10671 6-amino-4-(4-FC(F)(F)c1[nH 204 2034702 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10672 pyrano[2,3-c]pFC(F)(F)c1[nH 185 2034701 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10673 6-amino-4-(4-cClc1ccc(cc1)C 21 2034700 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10674 3-[(2,4-dichlo Clc1ccc(N=Nc2 211 2034699 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10675 5-(4-chloropheClc1ccc(N2C( 171 2034698 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10676 3-(furan-2-ylc O=[N+]([O-]) 209 2034697 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10677 3-(furan-2-yl O=C1N(C(=O)C 137 2034696 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10678 5-(4-bromophe
    Brc1ccc(N2C( 176 2034695 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10679 3-(furan-2-yl O=C1N(C(=O)C 129 2034694 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10680 3-[(E)-(2,5-di Clc1ccc(Cl)c( 216 2034692 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10681 6-amino-4-(2-cClc1ccccc1C1c 166 2034690 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10682 9,9-Dimethyl-O=C1CC(C)(C) 315 2034687 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10683 4-[(2,6-dichl Clc1cccc(Cl)c 196 2034686 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10684 6-chloro-5-met
    ClC=1C(=O)N2 215 2034684 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10685 5-methyl-7-phe
    FC(F)(F)c1[nH 89 2034683 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10686 3-(furan-2-yl O=C1N(C(=O)C 204 2034680 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10687 3-[(E)-(4-met O(C)c1ccc(N= 202 2034676 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10688 5,7-dimethyl-3O=[N+]([O-]) 264 2034675 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10689 5,7-dimethyl- Nc1[nH0][nH0 256 2034674 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10690 5-(2,5-dichlo Clc1ccc(Cl)c 185 2034673 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10691 1,6-diamino-4O=C1N(N)C(N) 329 2034661 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10692 1,6-diamino-4O=C1N(N)C(N) 324 2034660 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10693 ethyl 5-methylO=C1N(C(=O)C 200 2034656 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10694 ethyl 4-{[5-( Brc1ccc(N2C( 239 2034655 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10695 3-(naphthalenO=[N+]([O-]) 176 2034653 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10696 5-(4-bromophe
    Brc1ccc(N2C( 186 2034652 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10697 5-(4-fluoroph Fc1ccc(N2C(= 194 2034651 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10698 3-(naphthalenO=[N+]([O-]) 191 2034650 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10699 3-nitroso-2-t s1cccc1c1[nH 239 2034648 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10700 2-(4-nitrophenO=Nc1[nH0]2C 191 2034647 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10701 2-naphthalen-O=Nc1[nH0]2C 250 2034646 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10702 N-[(2Z)-5-acetS1C(=NC(=O)C 185 2034604 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10703 N-[(2Z)-5-acetS1C(=NC(=O)C 158 2034603 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10704 N-[(2Z)-5-acetS1C(=NC(=O)c 204 2034602 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10705 N-[(2Z)-5-acetS1C(=NC(=O)c2 196 2034601 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10706 2-[(4-methoxyS1C2=NC(=O)c 180 2034593 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10707 2-(furan-2-ylc S1C2=NC(=O)c 326 2034592 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10708 2-(thiophen-2-s1cccc1C(=O) 237 2034591 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10709 2-acetyl-5H-[1S1C2=NC(=O)c 199 2034590 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10710 5-(2,5-dichlo Clc1ccc(Cl)c 147 2034576 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10711 4-{3-[(4-methoO=C1N(C(=O)C 199 2034575 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10712 5-(4-bromophe
    Brc1ccc(N2C( 124 2034574 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10713 5-(4-fluoroph Fc1ccc(N2C(= 141 2034573 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10714 4-{3-[(4-chlor Clc1ccc(cc1) 144 2034572 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10715 5-(4-bromophe
    Brc1ccc(N2C( 184 2034571 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10716 3-[(4-chlorop Clc1ccc(cc1) 151 2034570 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10717 5-(4-hydroxypO=C1N(C(=O)C 120 2034569 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10718 5-(3-nitrophe O=[N+]([O-]) 173 2034568 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10719 5-methyl-3-[(EBrc1cc(Br)c(N 99 2034567 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10720 5-methyl-3-[(EClc1cc(Cl)c(N 190 2034566 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10721 5-methyl-3-[(EFC(F)(F)C=1[n 246 2034565 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10722 5-methyl-3-[(EFC(F)(F)C=1[n 237 2034564 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10723 5-methyl-3-[( FC(F)(F)C=1[n 209 2034563 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10724 5-methyl-7-(trFC(F)(F)C=1[n 171 2034562 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10725 diethyl 2,6-di FC(F)(F)C1(O) 93 2034558 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10726 diethyl 2,6-di FC(F)(F)C1(O) 234 2034557 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10727 6-amino-4-(2,4Clc1ccc(c(Cl) 199 2034556 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10728 1,6-dinitro-9HO=[N+]([O-])c 286 2034488 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10729 4-[(E)-(4-buty O=C(Oc1ccc(N 64 2034472 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10730 4-[(E)-(4-but O=C(Oc1ccc(N 86 2034469 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10731 (E)-1-(4-butyl O(CCCCC)c1cc 42 2034459 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10732 (E)-1-(4-buty O(CCC)c1ccc( 67 2034457 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10733 N-(4-decylpheO=C(Nc1ccc(c 114 2034453 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10734 4-methoxyphen
    O=C(Oc1ccc(O 175 2034452 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10735 4-methoxyphen
    O=C(Oc1ccc(O 133 2034451 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10736 4-methoxy-N-[O=C(Nc1ccc(O 153 2034449 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10737 4-ethyl-N-[4- O=C(Nc1ccc(O 143 2034448 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10738 4-methoxy-N-O=C(Nc1ccc(c 132 2034447 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10739 4-methyl-N-[4O=C(Nc1ccc(O 141 2034446 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10740 4-methyl-N-(4O=C(Nc1ccc(c 113 2034445 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10741 4-ethyl-N-(4- O=C(Nc1ccc(c 109 2034444 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10742 4-ethyl-N-(4- O=C(Nc1ccc(c 102 2034443 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10743 4-methyl-N-(4O=C(Nc1ccc(c 129 2034442 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10744 N-(4-butylpheO=C(Nc1ccc(c 117 2034441 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10745 4-methoxyphen
    O=C(Oc1ccc(O 143 2034440 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10746 1,2-dibenzylt c1ccc(cc1)Cc1 178 2034436 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10747 10-phenyl-1,2c1ccc(cc1)c1 136 2034435 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10748 10-methyl-1,2Cc1ccc2c(c1) 93 2034434 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10749 bis(4-chlorophClc1ccc(OC(=O) 244 2034433 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10750 bis(4-chlorop Clc1ccc(OC(=O 149 2034432 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10751 bis(3,5-dichl Clc1cc(Cl)cc( 230 2034430 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10752 bis(2,4-dichl Clc1ccc(OC(=O 217 2034429 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10753 1-bromo-2,4-dBrc1ccc(C)c([ 70 2034420 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10754 1-(3'-nitrobip O=[N+]([O-])c 108 2034409 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10755 3'-nitrobiphenO=[N+]([O-])c 314 2034402 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10756 methyl 3'-nit O=[N+]([O-])c 143 2034401 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10757 benzoic acid, 4S(Sc1ccc(cc1[ 308 2034400 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10758 4,6-dihydro-1 S1CC2=NN=CC 133 2034396 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10759 1,1'-bi(cycloh O=C(O)C1(CC 79 2034371 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10760 5-methyl-2-(2O=C(Oc1cc(C)c 149 2034366 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10761 5-methyl-2-(2O=C(Oc1cc(C)c 102 2034365 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10762 6-[2-(1-benzy Brc1cc([N+](= 208 2034284 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10763 6-[2-(1-benzylO=[N+]([O-])c 245 2034283 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10764 1'-Benzyl-3',3 O=[N+]([O-])c 159 2034282 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10765 6-[2-(1-dodecyO=[N+]([O-])c 138 2034281 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10766 1'-dodecyl-3', O=[N+]([O-]) 109 2034280 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10767 spiro[2H-1-benO=[N+]([O-]) 81 2034278 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10768 8-[5-(4-ethox [Cl+3]([O-])( 264 2034274 http://dx.doi Karthikeyan M.
    x salt - AL
    10769 10,10-dimethy[Cl+3]([O-])([ 347 2034272 http://dx.doi Karthikeyan M.
    x salt - AL
    10770 8-[5-(4-bromoBrc1ccc(cc1)c1 329 2034270 http://dx.doi Karthikeyan M.
    x salt - AL
    10771 8-[5-(4-chlor Clc1ccc(cc1)c1 342 2034268 http://dx.doi Karthikeyan M.
    x salt - AL
    10772 8-furan-2-yl- [Cl+3]([O-])([ 292 2034266 http://dx.doi Karthikeyan M.
    x salt - AL
    10773 bis(2,4-dimet OC(c1cc(OC)c 109 2034265 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10774 5-butyl-4-chl Clc1[nH0]c(N) 162 2034251 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10775 2-(4-nitrophe O=[N+]([O-]) 127 2034241 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10776 3-ethyl-6-phen[nH0]1[nH0]c( 189 2034239 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10777 6-(1-methylethS1CC(=N[nH0] 157 2034238 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10778 3,6-dimethyl[1S1c2[nH0][nH 93 2034237 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10779 2-methyl-1H-iOC1c2ccccc2C 87 2034207 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10780 1-(8-chlorobicClC1c2ccccc2C 228 2034204 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10781 diethyl 5-met O=C(OCC)C=1 99 2034194 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10782 3-(4-methoxypO(C)c1ccc(cc 70 2034192 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10783 diethyl 3-met O=C(OCC)[nH0 81 2034187 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10784 4,5-dimethyl- N=1NC(C)=C(C 104 2034185 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10785 dimethyl 3,5- O=C(OC)[nH0] 90 2034184 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10786 dimethyl 3-meO=C(OC)[nH0] 111 2034182 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10787 2,4,6-trinitro O=[N+]([O-])c 122 2034180 http://dx.doi Karthikeyan M.
    x mixture - AL
    10788 methyl 3,5-di O=C(OC)[nH0] 52 2034179 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10789 2-(chloromethy
    ClCc1c2CCc2c 73 2034177 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10790 2,4-bis(chloroClCc1c2CCc2c( 92 2034176 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10791 2,4-bis(1-met O=C1C(CC1=C( 87 2034174 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10792 hexamethyl 1,O=C(OC)C1Cc2 262 2034173 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10793 1,2,3,4-tetra BrCc1c(C)c(C) 205 2034171 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10794 2-methyl-3-(2,FC(F)(F)Cc1cc 75 2034169 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10795 1,2,3,4-tetra BrCc1c2ccccc2 197 2034168 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10796 1,2,5,6-tetra c1cc2c3CCc3c 163 2034167 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10797 2-(chloromethClCc1cc2ccccc 65 2034165 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10798 8-chlorobicyclClC1c2ccccc2 67 2034164 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10799 methyl 3-methO=C(OC)[nH0] 33 2034161 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10800 4-tert-butyl-3 N=1NC(C)=C(C 104 2034160 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10801 (3-methylnaphFC(F)(F)C(=O) 92 2034159 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10802 1,5-bis(chlor ClCc1c(C)ccc2 228 2034157 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10803 (4,5-dimethoxOC(C#N)c1cc( 80 2034156 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10804 3,5-Dimethyl-1O=C(OC)C=1C 83 2034153 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10805 1H-pyrazole-3-O=C(OC)C1=N 82 2034152 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10806 1H-pyrazole-3-O=C(OC)C1=N 107 2034152 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10807 3-methyl-2-phCC=1c2ccccc2 75 2034148 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10808 methyl 1-methO=C(OC)C1=Cc 32 2034143 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10809 5-(2-methylphN1=NC(C=C1c1 108 2034141 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10810 1-methyl-2-phCC1c2ccccc2C 58 2034137 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10811 methyl 3-phenO=C(OC)C1CC( 91 2034136 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10812 1H-indene-2-cN#CC1=Cc2ccc 40 2034134 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10813 2-methyl-1H-iN#CC=1c2ccc 70 2034133 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10814 3-methyl-1H-iN#CC=1Cc2cc 63 2034132 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10815 Methyl 3-oxo-O=C1CC(c2ccc 45 2034131 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10816 methyl 3-methO=C(OC)C=1Cc 66 2034130 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10817 1-phenyl-1H-iN#CC1(C=Cc2c 77 2034129 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10818 3-phenyl-1H-iN#CC1(C#N)C= 135 2034128 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10819 dimethyl 3-meO=C(OC)C1(C= 114 2034126 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10820 3-methyl-1H-iO=C(O)C1C=C( 139 2034123 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10821 3-methyl-1H-iOC1C=C(C)c2c 69 2034122 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10822 3-methoxy-1- O(C)C1=CC(c2c 68 2034120 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10823 3-methyl-2-phO=C1c2ccccc2 85 2034118 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10824 2-(7-hydroxybiO=C(CC1(O)Cc 83 2034114 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10825 1-phenyl-1H-iO=C(OC1=CC(c 56 2034113 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10826 3-chloro-1-phClC1=CC(c2ccc 81 2034112 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10827 3-hydroxy-5,5O=C1OC(C=C1O 127 2034111 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10828 3-methyl-1-phOC1(C=C(C)c2c 76 2034110 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10829 1-oxo-3-phenyO=C1OC(C#N)( 141 2034109 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10830 N-phenylbicycO=C(Nc1ccccc 161 2034108 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10831 5-chloro-5,6- ClC1Cc2cc3OC 55 2034107 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10832 N-bicyclo[4.2.O=C(NC1Cc2cc 157 2034106 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10833 N-bicyclo[4.2.O=C(NC1Cc2cc 123 2034104 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10834 4-methoxybicyc
    O=C(O)C1Cc2c 93 2034103 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10835 5,6-dihydrocyO1COc2cc3CC 62 2034100 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10836 3-methoxy-2-me
    O(C)c1ccc2c( 80 2034098 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10837 7-chloro-2,5-dClC1Cc2c1c(OC 113 2034097 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10838 N-phenyl-N-(pO=C(Nc1ccccc 158 2034096 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10839 7-chloro-3-meClC1Cc2cc(OC) 41 2034094 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10840 7-chloro-7-pheClC1(Cc2ccccc 60 2034093 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10841 2,3,4-trimethyCc1cc2CCc2c( 38 2034092 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10842 3,4-dimethoxyb
    O(C)c1cc2CCc 91 2034091 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10843 3-methoxy-4-(1
    O=C(O)C1Cc2c 86 2034090 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10844 3-methoxy-4-me
    O(C)c1cc2CC( 67 2034089 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10845 3-methoxy-4-me
    O=C(O)C1Cc2c 138 2034087 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10846 5,6-dihydrocycO=C(O)C1Cc2 150 2034086 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10847 3-(trimethylsi [Si](C)(C)(C) 56 2034072 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10848 2-(trimethylsi [Si](C)(C)(C 59 2034071 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10849 3-bromo-2-hyd
    Brc1ccc(C)c(c 57 2034068 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10850 (4-bromo-3-me
    Brc1ccc(cc1O 104 2034067 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10851 3-bromo-2-met
    Brc1ccc(C)c(c 125 2034066 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10852 3-bromo-6-meBrc1ccc(OC)c( 163 2034065 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10853 2-prop-2-en-1O=C(O)c1cccc 84 2034064 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10854 2,4-dinitrobe O=[N+]([O-])c 139 2034062 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10855 bis(2,6-dinitr O=[N+]([O-])c 203 2034061 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10856 2,6-dinitrobe O=[N+]([O-])c 90 2034060 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10857 N-{[(2-nitrob O=[N+]([O-]) 141 2034059 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10858 2-nitrobenzyl O=[N+]([O-]) 54 2034058 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10859 2,6-dinitrobe O=[N+]([O-])c 138 2034057 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10860 2,4,6-Trinitro BrCc1c([N+](= 66 2034056 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10861 4,6,7,9-tetra O=C1OC(=O)C 254 2034037 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10862 1-methylbenzo[nH0]1c2c([nH 135 2034034 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10863 1,4-dimethylb[nH0]1c2c([nH 195 2034033 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10864 benzo[3,4]cyc[nH0]1c2c([nH 203 2034032 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10865 2,4,6-trinitro O=[N+]([O-])c 203 2034009 http://dx.doi Karthikeyan M.
    x mixture - AL
    10866 3-methyl-1-ph[nH0]1c(C)cc2 87 2034008 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10867 3-(trifluoromeFC(F)(F)c1[nH 31 2034007 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10868 3-benzylisoqu[nH0]1cc2ccc 64 2034006 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10869 6-methoxy-3-m
    O(C)c1ccc2c[n 115 2034005 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10870 3-(4-methoxypO(C)c1ccc(cc1 99 2034004 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10871 2-[2-(2-methyO=C(O)c1cccc 138 2034003 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10872 4,5,6,7-tetra O=C1CC(c2c1c( 214 2034001 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10873 11,12-dihydroO=C1c2ccccc2 132 2034000 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10874 5,6-bis[(trime [Si](OC1(C#N) 88 2033999 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10875 11',12'-dihydrO1CCOC11c2c 111 2033998 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10876 3'-(2-methylp O1C(=Cc2cccc 75 2033997 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10877 12a-hydroxy-1O=C1NC2=Cc3c 209 2033996 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10878 Spiro[bicyclo[ O=C1OC2(Cc3c 88 2033995 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10879 6'H,12'H-dispiO1CCOC11Cc2c 144 2033994 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10880 5,6,11,12-tet O=C1OC(=O)C2 269 2033992 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10881 (4aR,10aS)-1, O=C1OC(=O)C2 250 2033991 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10882 tetramethyl a O=C(OC)c1cc2 220 2033986 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10883 5a,6,7,10,11, O=C1c2ccccc 155 2033985 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10884 dimethyl 1,2- O=C(OC)c1cc2 124 2033984 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10885 4,5,8,9-tetra O=C1OC(=O)C 204 2033981 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10886 tetramethyl 1O=C(OC)C=1Cc 209 2033980 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10887 dimethyl 1,2, O=C(OC)C=1C 133 2033979 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10888 2,3,4,5-tetramCc1c2CCc2c(C) 139 2033977 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10889 2,5-dimethylbe
    FC(F)(F)C(=O) 89 2033974 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10890 5-chloro-7-met
    Clc1cccc2CC(O 94 2033972 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10891 7-methylbicyclOC1(C)Cc2ccc 78 2033971 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10892 4,6-dimethyl- O1C(C)=CC(C) 171 2033970 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10893 1',4'-dihydros OC1OC2(CCCCC 89 2033969 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10894 N'-methyl-N'- O=CNN(C)c1cc 47 2033966 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10895 5-hydroxy-3,4O=C1OC(O)C( 82 2033964 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10896 1,2,4-tribrom Brc1c(Br)c(C) 90 2033963 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10897 4,5,6,7-tetra O=C1CCc2c1c(C 154 2033962 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10898 7-cyanobicycloO=C(OC1(C#N) 112 2033960 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10899 N-methyl-2-[2O=C(N(C)c1cc 119 2033958 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10900 methyl 3-(4-n O=[N+]([O-]) 134 2033957 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10901 N,N-diethyl-2 O=C(N(CC)CC) 47 2033956 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10902 tert-butyl 3- O=C(OC(C)(C)C 83 2033954 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10903 5-methyl-3-(2N1=NC(C=C1C) 129 2033953 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10904 trimethyl{[1- [Si](OC(=C)c1c 41 2033952 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10905 2,3,4,5,7-pentO=C(OC1(C)Cc2 70 2033951 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10906 1-(1-hydroxy- O=C(C)c1c(O)c 55 2033950 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10907 3-phenylnaphtO=C(Oc1cc(cc2 60 2033948 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10908 1-(pentamethyO=C(C)CC(=O)c 74 2033947 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10909 1-(3-butyl-1- O=C(C)c1c(cc 62 2033946 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10910 3-cyclohexyl- OC1OC(Cc2cc 89 2033943 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10911 3-cyclohexyl- OC1OC(Cc2cc 102 2033943 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10912 3-(4-methoxypOC1OC(Cc2ccc 114 2033942 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10913 4-(1-phenyl-1 Oc1ccc(cc1)C 121 2033941 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10914 3-(4-methoxypOC1(OC(Cc2cc 102 2033940 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10915 1-phenyl-3-(p O=C(CC(C(=O)C 90 2033927 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10916 4-oxo-1,4-dip O=C(OC(CCC(= 73 2033925 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10917 2-(2-phenylet O=C(N)C=1CCC 113 2033923 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10918 1,6-diphenyl- O=C(CC(C(=O)c 169 2033918 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10919 1,1'-(sulfinyl [S+]([O-])(Cc1 210 2033915 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10920 1,1'-(sulfanedS(Cc1c(C)cc(C 146 2033914 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10921 naphthalen-2-S=C(Sc1ccc2cc 114 2033912 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10922 2,2-dimethyl- O=C1OC(OC(=O 142 2033910 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10923 tetramethyl 1O=C(OC)C=1C 261 2033906 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10924 ethyl 2,3-dimeO=[N+]([O-])c 145 2033893 http://dx.doi Karthikeyan M.
    x mixture - AL
    10925 methyl 3-ethylO=[N+]([O-])c 101 2033892 http://dx.doi Karthikeyan M.
    x mixture - AL
    10926 2,4,6-trinitro O=[N+]([O-])c 171 2033891 http://dx.doi Karthikeyan M.
    x mixture - AL
    10927 2,4,6-trinitro O=[N+]([O-])c 132 2033890 http://dx.doi Karthikeyan M.
    x mixture - AL
    10928 2,4,6-trinitro O=[N+]([O-])c 159 2033889 http://dx.doi Karthikeyan M.
    x mixture - AL
    10929 3-oxo-1,3-dihyFC(F)(F)C(=O 58 2033888 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10930 3-(phenylsulf S(c1ccccc1)C 103 2033887 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10931 3-oxo-1,3-dih O=C1OC(OC(=O 128 2033886 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10932 3-oxo-1,3-dih O=COC1OC(=O 82 2033885 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10933 3,4-dichlorobiClc1cc2c(cc1C 183 2033884 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10934 2-ethoxybicyclO=C1c2cccc(O 128 2033883 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10935 2,4-dimethoxyb
    O=C1c2cc(OC) 149 2033882 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10936 2-methoxybicyO=C1c2cccc(O 119 2033881 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10937 2,5-dimethylbiO=C1c2c(c(C) 133 2033880 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10938 4-methyl-11,1O=C1N2C(C)=C 98 2033879 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10939 4-methyl-6H-pO=C1N2C(C)=C 78 2033878 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10940 13,13a-dihydrO=C1N2C=Cc3c 128 2033877 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10941 8H-isoquino[3O=C1N2C=Cc3c 147 2033876 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10942 5,6,6a,7-tetr O=C1N2c3cccc 130 2033875 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10943 6a,7-dihydro- O=C1N2c3cccc 91 2033874 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10944 12H-isoquino[O=C1N2C(C=Cc 125 2033873 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10945 7,9-dimethyl- O=C1N2C=CC=C 114 2033872 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10946 9-methoxy-1,2O=C1N2CCCCC 80 2033871 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10947 9-methoxy-6H-O=C1N2C=CC= 130 2033870 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10948 11,11a-dihydrO=C1N2C=CC= 93 2033869 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10949 6H-benzo[b]quO=C1N2CCCCC 97 2033868 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10950 7,8,9,10-tetr O=C1N2C=CC=C 221 2033867 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10951 4,11a-dimethyO=C1N2C(C)=C 177 2033866 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10952 7,8,9,10-tetr O=C1N2C=CC=C 139 2033865 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10953 7,9-dimethyl- O=C1N2CCCCC2 102 2033864 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10954 7,9-dimethyl- O=C1N2CCCCC2 62 2033863 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10955 7,9-dimethyl- O=C1[nH0+]2c 87 2033862 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10956 5,6-dihydro-8 O=C1N2CCc3cc 101 2033861 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10957 5,6,13,13a-te O=C1N2CCc3cc 173 2033859 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10958 3,4,11,11a-te O=C1CCN2C(= 126 2033858 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10959 2-methyl-1,2-O=C1N2C=CC(C 89 2033856 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10960 2-methyl-6H-pO=C1N2C=CC(C 124 2033855 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10961 methyl 4,7-dim
    O=C1Cc2c1c(C 150 2033854 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10962 5-bromobicyclBrc1cccc2CC( 82 2033853 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10963 5-chlorobicyclClc1cccc2CC( 71 2033852 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10964 5-fluorobicyclFc1cccc2CC(= 41 2033851 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10965 methyl 7-methy
    O=C1Cc2c1c(C 168 2033845 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10966 dimethyl 3,5-dO=C1Cc2c1c(C 117 2033844 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10967 6,7-dimethyltrO=C1Cc2c1c1C 161 2033843 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10968 2,7-dimethyltrO=C1Cc2c1c(C 188 2033842 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10969 6,7-dimethyltrO=C1Cc2c3CC( 207 2033841 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10970 2,7-dimethyltrO=C1Cc2c1c(C 238 2033840 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10971 tricyclo[6.2.0 O=C1Cc2cc3c( 237 2033839 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10972 tricyclo[6.2.0 O=C1Cc2cc3CC 207 2033838 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10973 2,4,5-trimethyO=[N+]([O-])c 164 2033837 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10974 2-nitrobicycloO=[N+]([O-]) 116 2033836 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10975 3-nitrobicycloO=[N+]([O-])c 76 2033835 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10976 3,4-dimethoxyb
    O=C1Cc2cc(OC 141 2033834 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10977 3-methoxy-4-(O=C1Cc2cc(OC 43 2033833 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10978 2,5-dimethoxyO=C1Cc2c1c(O 109 2033832 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10979 2,5-dimethoxyb
    O=C1Cc2c1c(O 105 2033831 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10980 4-bromo-5-met
    Brc1ccc2CC(= 118 2033830 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10981 2-bromo-5-met
    Brc1ccc(OC)c 74 2033829 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10982 5-methoxy-3-m
    O=C1Cc2cc(C) 93 2033828 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10983 3-methoxy-2,4O=C1Cc2c1cc( 51 2033827 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10984 3-methoxy-5-m
    O=C1Cc2cc(OC 83 2033825 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10985 4-methoxybicyO=C1Cc2ccc(O 55 2033824 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10986 3-methoxy-4-m
    O=C1Cc2cc(OC 88 2033823 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10987 cyclobuta[f][ O=C1Cc2cc3O 126 2033822 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10988 3-methoxybicyO=C1Cc2cc(OC 52 2033821 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10989 5-methoxybicyO=C1Cc2cccc( 35 2033820 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10990 cyclobuta[a]n O=C1Cc2c1ccc 72 2033819 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10991 cyclobuta[a]n O=C1Cc2ccc3c 97 2033818 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10992 2,4,5-trimethyO=C1Cc2c1c(C 73 2033817 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10993 2,3,4-trimethyO=C1Cc2c1cc( 86 2033816 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10994 3,4,5-trimethyO=C1Cc2cc(C)c 103 2033815 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10995 4-methylbicyclO=C1Cc2ccc(C 46 2033814 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10996 3-methylbicyclO=C1Cc2cc(C) 53 2033813 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10997 2-methylbicyclO=C1Cc2c1ccc 56 2033812 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10998 2,3,5-trimethyO=C1Cc2c1c(C 98 2033811 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    10999 1-ethyl-4-phe OC1(CCC(c2cc 112 2033810 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11000 1,1'-cyclohexac1ccc(cc1)C1( 57 2033808 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11001 3,4,4a,10-tet O=C1CCCC2Cc3 79 2033804 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11002 dimethyl 1-oxO=C1c2ccccc2 88 2033802 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11003 dimethyl 1-{[ O=C(OC)c1cc2 139 2033801 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11004 dimethyl 1-hyO=C(OC)c1cc2 105 2033800 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11005 2-acetyl-3-ph O=C1c2ccccc2 67 2033799 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11006 dimethyl 5,6, O=C1OC(Cc2c(C 166 2033798 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11007 dimethyl 7-meO=C1OC(Cc2cc 120 2033797 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11008 dimethyl 6-meO=C1OC(Cc2cc 134 2033796 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11009 dimethyl 8-meO=C1OC(Cc2cc 89 2033795 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11010 dimethyl 7-meO=C1OC(Cc2cc 142 2033794 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11011 dimethyl 5-meO=C1OC(Cc2c( 100 2033793 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11012 dimethyl 6-meO=C1OC(Cc2cc 135 2033792 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11013 dimethyl 1-oxO=C1OC(Cc2cc 113 2033791 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11014 5',6',7',8'-te O=C1OC2(Cc3c 257 2033790 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11015 spiro[indene-2O=C1OC2(Cc3c 205 2033789 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11016 3-(2-methylphO=C1OC(C#N)( 122 2033788 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11017 methyl 1-oxo-O=C1OC(Cc2cc 90 2033787 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11018 3-acetyl-3-meO=C1OC(C)(Cc 105 2033786 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11019 3-(trichlorom ClC(Cl)(Cl)C1 119 2033785 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11020 6-methoxy-3-(O=[N+]([O-])c 176 2033783 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11021 3-cyclohexyl- O=C1OC(Cc2c 73 2033778 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11022 3-cyclohexyl- O=C1OC(Cc2c 89 2033778 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11023 3-(4-methoxypO=C1OC(Cc2cc 108 2033777 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11024 3-pyridin-2-y O=C1OC(Cc2cc 156 2033776 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11025 3-(4-nitrophe O=[N+]([O-])c 184 2033773 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11026 bicyclo[4.2.0] O=C(OC1Cc2cc 42 2033772 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11027 bicyclo[4.2.0] O=C(OC1Cc2cc 124 2033771 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11028 bicyclo[4.2.0] O=Nc1ccc(cc1 119 2033770 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11029 7-(phenylethyn
    O(CC=C)C1(C# 50 2033769 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11030 7-phenylbicyclO=C(OC1(Cc2c 76 2033768 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11031 trimethyl{[7-( [Si](OC1(C#Cc 64 2033767 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11032 7-[(trimethyls[Si](C)(C)(C) 47 2033766 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11033 7-(phenylethyn
    OC1(C#Cc2ccc 99 2033765 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11034 7-ethyl-8-meth
    OC1(CC)c2ccc 52 2033764 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11035 1,2,3,7b-tetr OC12CCCC2c2 66 2033763 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11036 1,3,4,8b-tetr OC12CCCCC2c 112 2033762 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11037 5,6,7,8,9,9a- OC12CCCCCC2 100 2033761 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11038 3,5,7-trimethyOC1(C)Cc2cc(C 58 2033760 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11039 7-phenylbicyclOC1(Cc2ccccc 68 2033759 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11040 2,3,4,5,7-pentOC1(C)Cc2c1c( 90 2033758 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11041 5-fluorobicyclFc1cccc2CC(O 56 2033757 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11042 3-methoxybicyc
    OC1Cc2cc(OC) 38 2033755 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11043 N,N,N',N'-tet Br.N(C)(C)C1 245 2033753 http://dx.doi Karthikeyan M.
    x salt - AL
    11044 2,4,6-trinitro O=[N+]([O-])c 193 2033751 http://dx.doi Karthikeyan M.
    x salt - AL
    11045 N,N,N,N',N',N O=[N+]([O-])c 250 2033750 http://dx.doi Karthikeyan M.
    x salt - AL
    11046 N,N,N,N',N',N [I-].[I-].[N+] 272 2033748 http://dx.doi Karthikeyan M.
    x salt - AL
    11047 N,N,N',N'-tet Br.Br.N(C)(C 248 2033746 http://dx.doi Karthikeyan M.
    x salt - AL
    11048 N,N'-cyclodecO=C(NC1CCCC 256 2033745 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11049 4,6-dimethylbe
    FC(F)(F)C(=O) 121 2033729 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11050 1,3-bis(chlor ClCc1ccc(OC)c 97 2033727 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11051 1,5-bis(chlor ClCc1cc(CCl)c 78 2033726 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11052 2,3-dimethyl- O=C(N)[nH0]1 188 2033720 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11053 1-hydroxy-2-mO[nH0]1c2ccc 159 2033719 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11054 2-(2-nitrophenO=[N+]([O-])c 51 2033718 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11055 2-(2-nitrophenO=[N+]([O-])c 72 2033717 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11056 ethyl cyano(2 O=[N+]([O-]) 60 2033716 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11057 2,3-dimethyl- O=C[nH0]1c2c 89 2033715 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11058 (2Z)-3-methoxy
    O=[N+]([O-])c 68 2033714 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11059 2-methyl-1H-iN#CC1=C2C=C 213 2033713 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11060 2,3-dimethyl-1N#C[nH0]1c2c 97 2033710 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11061 2,3-dimethyl-3N#CC1(C)c2cc 73 2033708 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11062 methyl 1-acetO=C(N1c2cccc 60 2033707 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11063 (3,3-dimethyl O=C(c1ccccc1 83 2033706 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11064 methyl 2-acetO=C(C)C1=Nc2 103 2033704 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11065 methyl 2-ethyO=C(OC)C1(C) 72 2033700 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11066 3,3-dimethyl- N1=CC(C)(C)c 228 2033698 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11067 methyl 3,3-di O=C(OC)C1=Nc 75 2033697 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11068 methyl 3,3-di O=C(OC)C1Nc2 169 2033696 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11069 methyl 2,3-di O=C(OC)[nH0] 50 2033695 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11070 methyl 2,3-di O=C(OC)C1(C) 81 2033694 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11071 ethyl 2-cyano O=[N+]([O-])c 68 2033691 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11072 2,3-dimethylnN#Cc1c(C)c(C) 263 2033690 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11073 1,2-dibromo-3Brc1c(Br)c(C)c 72 2033689 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11074 2,5-dimethoxyO=Cc1c(OC)c(C 86 2033688 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11075 ethyl 2,3-dimeO=[N+]([O-])c 90 2033678 http://dx.doi Karthikeyan M.
    x mixture - AL
    11076 3-ethoxy-7-meO=C1OC(OCC)c 67 2033677 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11077 dimethyl 3,6- O=C(OC)c1c(O 101 2033676 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11078 2-methyl-3-oxO=C1N(C)C(OC 93 2033674 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11079 3-hydroxy-2,4O=C1N(C)C(O) 163 2033673 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11080 4,7-dimethyl- O=C1NC(=O)c2 224 2033672 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11081 3-hydroxy-2-mO=C1N(C)C(O) 133 2033671 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11082 3-hydroxy-4,7O=C1OC(O)c2c 158 2033670 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11083 5,6-dichloro- Clc1cc2c(cc1 180 2033669 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11084 3-hydroxy-4,7O=C1OC(O)c2c 192 2033668 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11085 3-hydroxy-5,7O=C1OC(O)c2c 185 2033667 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11086 3-hydroxy-5-mO=C1OC(O)c2c 137 2033665 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11087 3-oxo-1,3-dih O=C1OC(OC(=O 71 2033664 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11088 N-(6-methoxyn
    O1CCOc2cc(Nc 102 2033579 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11089 6-[bis(5-ethyl O=[N+]([O-]) 86 2033578 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11090 2,2',2'',2'''- o1c(ccc1C(c1c 81 2033577 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11091 5,6-dimethoxyo1[nH0]c2cc(O 146 2033576 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11092 N-[phenyl(2-pO=C(N)C(=O)N 203 2033569 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11093 2,4,6-trinitro O=[N+]([O-])c 159 2033516 http://dx.doi Karthikeyan M.
    x mixture - AL
    11094 4-methylpyridO=C(NN)c1c[n 226 2033512 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11095 4-methylpyridiO=[N+]([O-])c 217 2033504 http://dx.doi Karthikeyan M.
    x mixture - AL
    11096 ethyl 4-methylO=[N+]([O-])c 140 2033501 http://dx.doi Karthikeyan M.
    x mixture - AL
    11097 4-methylpyridiO=[N+]([O-])c 186 2033500 http://dx.doi Karthikeyan M.
    x mixture - AL
    11098 2-(dimethylamI.O=C(OCCN(C 251 2033486 http://dx.doi Karthikeyan M.
    x salt - AL
    11099 2-[(2,2-dimet OC(c1ccccc1) 145 2033476 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11100 5-(3,4-dihydr Oc1cc(ccc1OC 129 2033472 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11101 N-[3-(benzyloO=C(NCc1ccc( 143 2033468 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11102 3-carbamoyl-1[Cl+3]([O-])([ 143 2033466 http://dx.doi Karthikeyan M.
    x salt - AL
    11103 6-phenyl-6,7- O=C1CC(Cc2cc 83 2033463 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11104 1-(2-methylbeS=C(NCc1cccc 163 2033461 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11105 1-ethyl-7-metCl.Oc1cc2CCN 186 2033456 http://dx.doi Karthikeyan M.
    x salt - AL
    11106 1-ethyl-7-metCl.Oc1cc2CCN 253 2033454 http://dx.doi Karthikeyan M.
    x salt - AL
    11107 N-[(1E)-1,3-b Cl.O1COc2cc( 198 2033435 http://dx.doi Karthikeyan M.
    x salt - AL
    11108 7-hydroxy-6-m[I-].Oc1cc2C[ 217 2033412 http://dx.doi Karthikeyan M.
    x salt - AL
    11109 1-[4-methoxy-[I-].O=C(OC) 142 2033358 http://dx.doi Karthikeyan M.
    x salt - AL
    11110 7-(benzyloxy) [I-].O(C)c1cc 179 2033356 http://dx.doi Karthikeyan M.
    x salt - AL
    11111 1-[4-methoxy-[I-].O=C(OC) 154 2033354 http://dx.doi Karthikeyan M.
    x salt - AL
    11112 dimethyl 4-pyrO=[N+]([O-])c 146 2033353 http://dx.doi Karthikeyan M.
    x mixture - AL
    11113 methyl 4-(2,5 O=C(OC)CCC( 145 2033352 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11114 7-(benzyloxy) O=[N+]([O-])c 154 2033348 http://dx.doi Karthikeyan M.
    x salt - AL
    11115 2-methyl-5-azO=[N+]([O-])c 220 2033343 http://dx.doi Karthikeyan M.
    x salt - AL
    11116 7-(benzyloxy) O=[N+]([O-])c 173 2033341 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11117 7-ethoxy-6-meO(C)c1cc2CCN 151 2033340 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11118 7-hydroxy-6-mO=[N+]([O-])c 194 2033337 http://dx.doi Karthikeyan M.
    x salt - AL
    11119 N,N-dimethyl-[Br-].O=C(OCC 135 2033336 http://dx.doi Karthikeyan M.
    x salt - AL
    11120 3,4,5-trimeth ClC(=O)C1CC( 82 2033335 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11121 7-Methoxy-1,2Cl.O(C)c1ccc 229 2033325 http://dx.doi Karthikeyan M.
    x salt - AL
    11122 1,3-diphenyl-1N=1N(CC=1c1c 138 2033300 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11123 7-methoxy-9-m
    O(C)c1ccc2c([ 96 2033297 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11124 3-chlorophenyClc1cccc(OC( 96 2033281 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11125 5-{1-[(2,2-di Oc1cc(ccc1OC 88 2033274 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11126 1-(benzyloxy) O=[N+]([O-])C 153 2033266 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11127 2-[3-(benzylo O=C(NCCc1ccc 140 2033264 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11128 (1R)-7-(benzy [Cl-].O(C)c1c 185 2033257 http://dx.doi Karthikeyan M.
    x salt - AL
    11129 7-(benzyloxy) O(C)c1cc2CCN 82 2033246 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11130 4-{2-[(1,3-be Cl.Oc1ccc(cc 122 2033237 http://dx.doi Karthikeyan M.
    x salt - AL
    11131 4-{2-[(3-hydr Cl.Oc1cccc(c1 164 2033234 http://dx.doi Karthikeyan M.
    x salt - AL
    11132 5-(7-hydroxy- O=C1C=CCC(N2 256 2033231 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11133 7,11-dihydroxO=C1CCN2Cc3c 157 2033226 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11134 8-{[8-hydroxy Oc1c(OC)cc2C 164 2033218 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11135 octahydro-2H-O=C1CCN2CCC 208 2033194 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11136 methyl 3-(3-h O=C(OC)CCc1c 78 2033191 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11137 8H-9,7-(prop[ c1cc2c3Cc(c1) 171 2033164 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11138 6H-5,7-ethenoC=1C=Cc2ccc3 130 2033158 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11139 naphthalene-2O=C1C=CC2=C 132 2033125 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11140 bicyclo[4.4.1] O=C1C=CC=C2 147 2033124 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11141 bicyclo[4.4.1] O=C1C=CC2=C 122 2033123 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11142 diethyl 8-oxo O=C1C(=Cc2cc 161 2033107 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11143 6-ethyl-7H-beO=C1C=Cc2cc 49 2033101 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11144 9-(2-methylprCC(C)CC1c2cc 45 2033084 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11145 10-methyl-1,8Cc1c2cccc(c3c 177 2033035 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11146 1,8-diphenylnc1ccc(cc1)c1c 147 2033033 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11147 (7,10,10,13-t O=C1C(C)C2CC 156 2032935 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11148 7-(hydroxymetO=C1C(C)C2C 220 2032934 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11149 7,7,10,10-tet O=C1C(=C)C2C 163 2032921 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11150 7,7,10,10,13- O=C1C(C)C2CC 252 2032917 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11151 4-hydroxy-7,7O=C1C(C)C2C 204 2032916 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11152 11-methyl-5-oO=C1N2c3cccc 296 2032885 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11153 5-oxo-5H-[1,3]S1c2ccccc2N2 275 2032884 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11154 9,11-dimethylO=C1N2c3cccc 243 2032883 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11155 1,3,6-trimeth O=C1N2c3cccc 321 2032882 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11156 6-methyl-2-oxO=C1NC(C)=C( 261 2032862 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11157 methyl 3-formO=CN1C(=O)NC 236 2032861 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11158 ethyl 6-methyO=[N+]([O-]) 220 2032860 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11159 N,N-diethyl-6 O=C1NC(C)=C( 181 2032859 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11160 1,3,6-trimethyO=C1N(C)C(C) 165 2032858 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11161 ethyl 4-(2,3- Clc1cccc(c1C 243 2032856 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11162 N-(6-bromo-1,Brc1ccc2[nH0] 236 2032855 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11163 N-[2-(benzyls Clc1ccc(OC(C) 169 2032854 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11164 N-[2-(benzyls Clc1ccc(OC(C) 168 2032853 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11165 bicyclo[2.2.1] O=C(O)C1C2C= 167 2032852 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11166 4-(Diphenyl-p[P+]([O-])(c1 177 2032802 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11167 N-(2-methylphS=C(Nc1ccccc 124 2032796 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11168 N-(2-chlorophClc1ccccc1NC( 119 2032795 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11169 N-methyl-2-oxS=C(N(C)c1ccc 109 2032794 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11170 N-(4-iodophenIc1ccc(NC(=S) 139 2032793 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11171 N-(4-chlorophClc1ccc(NC(=S 223 2032792 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11172 ethyl 5-methoO=C(OCC)c1[n 39 2032745 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11173 2,2'-(3a,6-di O=C(O)CC1CC 229 2032731 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11174 4a,7,8-trimet OC1CCC2(C)C( 188 2032730 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11175 17-hydroxy-2 O=C1CCC2(C)C 177 2032729 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11176 17-hydroxy-21O=C(OC1CCC2( 138 2032726 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11177 17-hydroxy-21O=C(OC1CCC2( 166 2032725 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11178 7-ethyl-4a,8- OC1CCC2(C)C( 172 2032722 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11179 4a,7,8-trimethO=C(O)C1CCC2 162 2032719 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11180 (2-amino-3,5-OC(c1ccccc1)c 125 2032713 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11181 2-[hydroxy(4- Oc1ccccc1C(O) 105 2032712 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11182 2-[hydroxy(phOc1ccccc1C(O 88 2032711 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11183 2-[(4-bromophBrc1ccc(cc1)C 107 2032710 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11184 2-[hydroxy(4- Oc1ccc(C)cc1C 98 2032709 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11185 2-[hydroxy(phOc1ccc(C)cc1C 103 2032708 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11186 2-(1-hydroxy- Oc1ccc(C)cc1C 83 2032707 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11187 2-(1-hydroxypOc1ccc(C)cc1 143 2032706 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11188 4-carboxy-2,6[Cl+3]([O-])([ 296 2032699 http://dx.doi Karthikeyan M.
    x salt - AL
    11189 2,6-diphenyl- [Cl+3]([O-])([ 228 2032697 http://dx.doi Karthikeyan M.
    x salt - AL
    11190 9-benzyl-1,2, [Cl+3]([O-])( 156 2032695 http://dx.doi Karthikeyan M.
    x salt - AL
    11191 4-carboxy-2,6[Cl+3]([O-])([ 269 2032693 http://dx.doi Karthikeyan M.
    x salt - AL
    11192 2,4-diphenyl- [Cl+3]([O-])([ 238 2032691 http://dx.doi Karthikeyan M.
    x salt - AL
    11193 2,6-di-tert-b [Cl+3]([O-])([ 251 2032689 http://dx.doi Karthikeyan M.
    x salt - AL
    11194 2,6-bis(4-met [Cl+3]([O-])([ 243 2032687 http://dx.doi Karthikeyan M.
    x salt - AL
    11195 7-(phenylcarb[Cl+3]([O-])( 236 2032685 http://dx.doi Karthikeyan M.
    x salt - AL
    11196 2,6-diphenyl- [Cl+3]([O-])([ 228 2032683 http://dx.doi Karthikeyan M.
    x salt - AL
    11197 4-(diphenylph[Cl+3]([O-])([ 306 2032681 http://dx.doi Karthikeyan M.
    x salt - AL
    11198 2-(diphenylph[Cl+3]([O-])([ 216 2032679 http://dx.doi Karthikeyan M.
    x salt - AL
    11199 4-(diphenylph[Cl+3]([O-])([ 268 2032677 http://dx.doi Karthikeyan M.
    x salt - AL
    11200 2-(diphenylph[Cl+3]([O-])([ 231 2032675 http://dx.doi Karthikeyan M.
    x salt - AL
    11201 2,4-bis(4-met [Cl+3]([O-])([ 281 2032673 http://dx.doi Karthikeyan M.
    x salt - AL
    11202 2,4-bis(4-fluo [Cl+3]([O-])([ 274 2032671 http://dx.doi Karthikeyan M.
    x salt - AL
    11203 2,4-bis(4-chl Clc1ccc(cc1)c1 279 2032669 http://dx.doi Karthikeyan M.
    x salt - AL
    11204 2,4-diphenylp[Cl+3]([O-])([ 232 2032667 http://dx.doi Karthikeyan M.
    x salt - AL
    11205 N'-[(2E)-4,6- S1C(=Nc2ccc(N 148 2032664 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11206 N'-(2,6-diphe S1C(=CC(=Nc2c 165 2032663 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11207 N,N-dimethyl-O1C=2CCCCC=2 164 2032662 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11208 [4-(2,6-Diphe O1C(=CC(C=C1c 181 2032661 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11209 2-(Diphenyl-pS1C(=CC(=CC1[ 174 2032660 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11210 (4,6-diphenyl [P+]([O-])(c1 152 2032659 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11211 2-(Diphenyl-pS1c2ccccc2SC1 181 2032658 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11212 (2,6-diphenyl [P+]([O-])(c1 176 2032657 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11213 [2,6-bis(4-br Brc1ccc(cc1)C 194 2032656 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11214 diphenyl(9H-x[P+]([O-])(c1 161 2032654 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11215 2,4,6,8-Tetra- O=C1C2=Nc3cc( 210 2032653 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11216 10-bromo-2,4-Brc1ccc2oc3CC 127 2032651 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11217 10-bromo-4-(2Brc1ccc2oc3CC 209 2032650 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11218 8,10-dibromo-Brc1cc2c3c(oc 194 2032648 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11219 10-chloro-4-( Clc1ccc2oc3CC 198 2032647 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11220 4-(2-methoxypo1c2CCC(C)(c3 179 2032646 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11221 4-(2-methoxypo1c2CCC(C)(c 158 2032645 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11222 8,10-dibromo-Brc1cc2c3c(oc 121 2032644 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11223 8,10-dibromo-Brc1cc2c3c(oc 165 2032643 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11224 10-chloro-4-( Clc1ccc2oc3CC 144 2032642 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11225 4-(4-methoxypo1c2CCC(C)(c3 170 2032641 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11226 4-(4-methoxypo1c2CCC(C)(c3 145 2032640 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11227 2,4,10-trimet o1c2CCC(C)(c3 119 2032639 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11228 4H-benzo[d]cyc
    Ic1cc2c3c(oc2 175 2032638 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11229 10-chloro-2,4 Clc1ccc2oc3CC 128 2032637 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11230 2,4-dimethyl- o1c2CCC(C)(c3 135 2032636 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11231 10-methoxy-2,[Cl+3]([O-])([ 276 2032632 http://dx.doi Karthikeyan M.
    x salt - AL
    11232 8,10-dibromo-Brc1cc2c3c(oc2 261 2032630 http://dx.doi Karthikeyan M.
    x salt - AL
    11233 10-chloro-2,4 Clc1ccc2oc3[c+ 290 2032628 http://dx.doi Karthikeyan M.
    x salt - AL
    11234 2,4,10-trimet [Cl+3]([O-])([ 286 2032626 http://dx.doi Karthikeyan M.
    x salt - AL
    11235 2,4-dimethylb[Cl+3]([O-])([ 240 2032624 http://dx.doi Karthikeyan M.
    x salt - AL
    11236 4-[5-Methyl-3OC(C)(CCc1oc2 85 2032621 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11237 N-[3-(5-methyO=C(Nc1ccc2oc 132 2032620 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11238 4-[5-iodo-3-( Ic1ccc2oc(CCC 94 2032618 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11239 2-[bis(5-methO=[N+]([O-])c 104 2032617 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11240 2-[Bis(5-methBrc1cc([N+](= 100 2032616 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11241 2-[Bis(5-methO=[N+]([O-])c 93 2032615 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11242 2,2'-[(4,5-di s1c(C)ccc1C(c 120 2032614 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11243 2-[Bis(5-methBrc1ccc(O)c(c 97 2032612 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11244 2-[Bis(5-methClc1ccc(O)c(c 85 2032611 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11245 3-[bis(5-methO=C(C)C(C(=O) 60 2032610 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11246 2,2'-[(2-isot S=C=Nc1ccccc1 65 2032609 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11247 6,7-dimethoxyS1C(=Nc2cc(OC 148 2032607 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11248 2,2'-[(2-isot S=C=Nc1cc(OC) 91 2032606 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11249 2,2',2'',2'''- o1c(C)ccc1C(c 156 2032605 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11250 2,2'-[(2-Nitr O=[N+]([O-])c 80 2032603 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11251 2-[bis(5-metho1c(C)ccc1C(c 79 2032602 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11252 2,2'-[(4,5-Di O=[N+]([O-])c 98 2032601 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11253 3,3-bis(5-methO=C1Nc2ccccc 216 2032600 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11254 N-{2-[Bis(5-m O=C(NCc1ccccc 65 2032599 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11255 2-[bis(5-methyo1c(C)ccc1C(c 87 2032598 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11256 2,2'-[(4-Brom Brc1ccc(cc1)C 64 2032597 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11257 2,2'-[(2-Brom Brc1ccccc1C(c 57 2032596 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11258 2-[Bis(5-methIc1ccc(O)c(c1 104 2032595 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11259 2-[Bis(5-methyIc1cc(I)c(O)c( 143 2032594 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11260 2-[Bis(5-methBrc1cc([N+](= 153 2032593 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11261 2-[Bis(5-methBrc1cc(Br)c(O 88 2032592 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11262 2-[Bis(5-methyO=[N+]([O-])c 143 2032591 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11263 2-[Bis(5-methOc1ccccc1C(c1 65 2032590 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11264 2-[4-(3-oxo-3 O=C(OC(COc1c 74 2032542 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11265 2-[4-(3-oxo-3 O=C(OCCOc1cc 142 2032538 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11266 2-[4-(3-oxo-3 O=C(OCCOc1cc 113 2032537 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11267 4-(3-oxo-3-phO=C(Oc1ccc(c 158 2032534 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11268 4-(3-oxo-3-phO=C(C=Cc1ccc 115 2032530 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11269 2-chloroethyl ClCCOC(=O)c1 69 2032528 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11270 1,3-bis[4-(2- ClCCOc1ccc(c 83 2032527 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11271 3-(carboxymetO=C1OC(C(=O) 159 2032385 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11272 N-(4-methylphO=C1C(CCC(=O 114 2032212 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11273 5-methyl-2-(1O=C(OC1CC(C) 65 2032202 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11274 5-methyl-2-(1O=C(OC1CC(C) 76 2032176 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11275 bis[5-methyl-2O=C(OC1CC(C) 125 2032174 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11276 bis[5-methyl-2O=C(OC1CC(C) 68 2032173 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11277 N,2-bis(4-metO=C(Nc1ccc(C) 118 2032172 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11278 4-(2-carboxy- O=C(O)CC(C)c 225 2032170 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11279 N,3-bis(4-metO=C(Nc1ccc(C) 105 2032162 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11280 N,2-bis(4-metO=C(Nc1ccc(C) 105 2032161 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11281 2-chloro-2-(4 ClC(C)(c1ccc( 112 2032160 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11282 (4,7,7-trimethO=[N+]([O-]) 100 2032157 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11283 phenyl 4,7,7- O=C(Oc1ccccc 41 2032154 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11284 phenyl 4,7,7-tO=C(Oc1ccccc 64 2032153 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11285 2-phenyl-3-(2 N#CC(=CNNc1c 156 2032140 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11286 N-(1,2-dibromBrC(N(O)c1ccc 125 2032138 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11287 N-[(Z)-2-bromBrC(=CN(O)c1c 180 2032137 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11288 ethyl 3-[hydr O=C(OCC)C(=C 75 2032134 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11289 3-[hydroxy(phON(C=C(C#N)c 155 2032133 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11290 3-[hydroxy(phO=C(O)C(=CN( 75 2032132 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11291 3-bromo-2,4-dBrC=1N(OC(=O 166 2032131 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11292 2,4-diphenyli O=C1ON(C=C1c 175 2032130 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11293 5-methyl-2-(1O=C(OC1CC(C) 101 2032123 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11294 3,3'-(phenylme
    O=C1C(C(O)C2 149 2032121 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11295 1,8,8-trimethyO=NN(C)C1=CC 167 2032114 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11296 1,8,8-trimethyO=C1OC(C(=O) 201 2032113 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11297 3,4-dibromo-1BrC1=C(Br)C2 103 2032108 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11298 3-bromo-4-met
    BrC1=C(OC)C2 104 2032106 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11299 5,8,8-trimethyO=[N+]([O-]) 121 2032101 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11300 1,8,8-trimeth O=C1C=C(NC)C 195 2032099 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11301 1,8,8-trimethyO=C1CCC2CCC1 193 2032098 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11302 3,3-dibromo-1BrC1(Br)C(=O 155 2032096 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11303 1,8,8-trimethyO=C1C=CC2CCC 174 2032095 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11304 4-methoxy-1,8O=C1C=C(OC)C 55 2032094 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11305 ethyl 5-methyO=C(OCC)C(C( 155 2032081 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11306 bis[5-methyl- O=C1C=C(C)C( 186 2032079 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11307 bis[5-methyl- O=C(OC1CC(C) 200 2032077 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11308 5-methyl-2-(1O=C(OC1CC(C) 139 2032076 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11309 5-methyl-2-(1O=C(OC1CC(C) 115 2032073 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11310 5-methyl-2-(1O=C(OC1CC(C) 64 2032069 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11311 5-methyl-2-(1O=C(OC1CC(C) 68 2032068 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11312 5-methyl-2-(1O=C(OC1CC(C) 133 2032066 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11313 5-methyl-2-(1O=C(OC1CC(C) 84 2032064 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11314 {[4,5-dimethyCC=1C(=CC(C= 54 2032063 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11315 methyl hydroxO=[N+]([O-])c 62 2032062 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11316 1-methyl-5-(1O=C1OC(=O)C2 109 2032060 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11317 2,5-diphenylpO=C(O)C(CCCc 78 2032057 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11318 4,4',7,7,7',7' O=C1C(CCCc2c 162 2032054 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11319 2,2'-bis(2-bro BrC(Cc1ccccc1 215 2032052 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11320 2,2'-bis(2-bro BrC(=Cc1cccc 118 2032051 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11321 2,2'-bis(3-bro BrC(CCC1(C(=O 168 2032049 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11322 O-[2-methyl-2O=C(ON)C(C)(C 119 2032044 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11323 1,1'-(1,2,5,6 BrC(CCC(Br)C( 194 2032043 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11324 N,2,4-triphen S=C(Nc1ccccc 188 2032041 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11325 3,5-diphenyl- O=C(N1CC(C=C 180 2032037 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11326 1-acetyl-3,5-dO=C(N1CC(C=C 105 2032036 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11327 2,4,6-trinitro O=[N+]([O-])c 156 2032035 http://dx.doi Karthikeyan M.
    x mixture - AL
    11328 3,5-diphenyl- O=C(O)C(=O)O 158 2032034 http://dx.doi Karthikeyan M.
    x mixture - AL
    11329 N-(2,2-diphenO=NN(CC(c1ccc 179 2032032 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11330 methyl 1,2,2- O=C(OC)C1(C) 44 2032026 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11331 3-(2-hydroxy-2O=C(O)C1C(CC 119 2032023 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11332 O-[3-oxo-3-(1 S=C(OCCC(=O) 154 2032014 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11333 2-[2-oxo-2-(1,O=C1N(CC(=O) 99 2031995 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11334 (1,2,2,3-tetr O=C1C(C(=O)O 146 2031994 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11335 N-methyl(oxo)[Cl-].O=C([N+ 199 2031989 http://dx.doi Karthikeyan M.
    x salt - AL
    11336 bis[(1,2,2,3- O=C(OCC1(C)C 80 2031988 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11337 (1,2,2,3-tetr OCC1(C)CCC(C 94 2031986 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11338 (1,2,2,3-tetr O=C(OCC1(C)C 74 2031985 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11339 1,2,2,3-tetra O=C(N(c1ccccc 212 2031983 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11340 1-methyl-1-[2S=C(Nc1ccccc 147 2031981 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11341 N-[(1,2,2,3-te N(CC1(C)CCC(C 59 2031980 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11342 (1,2,2,3-tetr O=[N+]([O-])c 95 2031976 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11343 O-[(1,2,2,3-t S=C(OCC1(C)C 101 2031975 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11344 2-oxo-2-(1,2, O=C(OCC(=O)C 82 2031974 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11345 ethyl [(E)-(4, O=C1C(=CNC(= 162 2031951 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11346 ethyl 4-{[(Z)- O=C1C(=CNc2c 105 2031948 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11347 2-{[(E)-(4,7,7 O=C1C(=CNc2c 112 2031946 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11348 2-{[(E)-(4,7,7 O=C1C(=CNc2c 176 2031946 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11349 4-[hydroxy(phO=C1OC(C2CCC 156 2031942 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11350 4-[bromo(phen
    BrC(c1ccccc1 141 2031939 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11351 3-(1,2-dibromBrC(c1ccccc1) 161 2031938 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11352 3-hydroxy-3-( O=C(O)C1(C)C 188 2031937 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11353 1,2,2-trimethyO=C(O)C1(C)C 118 2031936 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11354 1-(2-bromo-2-BrC(CC12OC(= 206 2031935 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11355 3-[(2-hydroxy OC1C(NCC(O)( 119 2031930 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11356 N~3~,N~3~,1,7Cl.NC1C(N(C) 278 2031924 http://dx.doi Karthikeyan M.
    x salt - AL
    11357 ethyl [3-(dimeO=C(OCC)NC1C 237 2031916 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11358 ethyl (3-hydroO=C(OCC)NC1C 76 2031911 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11359 4,8,8-trimeth Cl.O=C1NC2C( 240 2031885 http://dx.doi Karthikeyan M.
    x salt - AL
    11360 N',N'''-(1,7,7 S=C(Nc1ccccc 178 2031883 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11361 (2Z,2'Z)-2,2'- O=C(c1ccccc1 190 2031881 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11362 3,3'-[(1,7,7-t O=C1Nc2ccccc 234 2031880 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11363 1,7,7-trimethyO=[N+]([O-])c 170 2031879 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11364 N,N'-(1,7,7-tr O=[N+]([O-])c 170 2031878 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11365 N,N'-(1,7,7-tr O=C(NC1C(NC( 148 2031877 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11366 N,N'-(1,7,7-tr O=C(NC1C(NC( 250 2031876 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11367 1,7,7-trimeth O=C(O)C(=O)O 245 2031875 http://dx.doi Karthikeyan M.
    x mixture - AL
    11368 1,7,7-trimethyO=C(O)CC(O)( 195 2031873 http://dx.doi Karthikeyan M.
    x salt - AL
    11369 2,4-dioxo-6-p O=C1CC(=O)C( 177 2031864 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11370 4-methoxy-2-oO=C1C=C(OC)C 167 2031845 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11371 3-(diphenylmet
    OC1C(C2CCC1( 171 2031836 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11372 4-methylpheny
    O=C(Oc1ccc(C) 111 2031835 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11373 6-(1-ethyl-1-hS=C(N)NCc1ccc 131 2031834 http://dx.doi Karthikeyan M.
    x mixture - AL
    11374 6-(1-hydroxy-1S=C(N)NCc1ccc 152 2031833 http://dx.doi Karthikeyan M.
    x mixture - AL
    11375 1-(4-nitrobenzCl.S=C(N)NCc1 218 2031831 http://dx.doi Karthikeyan M.
    x salt - AL
    11376 6-(1-hydroxy-2S=C(N)NCc1cc 139 2031830 http://dx.doi Karthikeyan M.
    x mixture - AL
    11377 6-(1-ethyl-1-hS=C(N)NCc1cc 110 2031829 http://dx.doi Karthikeyan M.
    x mixture - AL
    11378 6-(1-hydroxy-1S=C(N)NCc1cc 124 2031828 http://dx.doi Karthikeyan M.
    x mixture - AL
    11379 6-[{[(4-bromoBrc1ccc(cc1) 111 2031827 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11380 6-[cyclohexyl O=C(O)C1CCC( 181 2031826 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11381 5,7-dimethyl-2OCC(CCC(O)(C) 60 2031825 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11382 5,7,7-trimethyO=C1OC(C(C)C 120 2031824 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11383 6-(1-hydroxy- O=C(O)C1CCC( 115 2031823 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11384 6-(1-hydroxybu
    O=C(O)C1CCC( 179 2031822 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11385 6-(1-hydroxy-1O=C(O)C1CCC( 112 2031821 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11386 4,4-diethyl-5, O=C1OC(CC)(C 90 2031819 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11387 6-(1-ethyl-1-hO=C(O)C1CCC( 138 2031818 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11388 4,4,5,7,7-pen O=C1OC(C)(C) 78 2031816 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11389 6-(1-hydroxy- O=C(O)C1CCC( 111 2031815 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11390 6-[hydroxy(di O=C(O)C1CCC(O 211 2031814 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11391 6-(1-benzyl-1 O=C(O)C1CCC( 138 2031813 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11392 6-{hydroxy[bi O=C(O)C1CCC(O 152 2031812 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11393 6-(1,1-diphenyO=C(O)C1CC=C 145 2031811 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11394 5,7,7-trimeth O=C1OC(c2ccc 134 2031810 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11395 methyl 6-[hydO=C(OC)C1CCC( 91 2031809 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11396 6-[hydroxy(di O=C(O)C1CCC(O 163 2031808 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11397 4,4'-ethyne-1,N(=Cc1ccccc1) 207 2031785 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11398 N,N'-benzene-O=C(N(C)c1ccc 152 2031781 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11399 N-[2-(2-nitro O=[N+]([O-]) 94 2031780 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11400 2,4,6-trinitro O=[N+]([O-])c 178 2031774 http://dx.doi Karthikeyan M.
    x mixture - AL
    11401 1,2-bis(4-ami O=C(Cc1ccc(N) 145 2031769 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11402 1,2-bis(4-{[( O=C(Cc1ccc(N= 181 2031768 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11403 N,N'-(ethyne- O=C(Nc1ccc(C# 332 2031763 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11404 3,5-dichloro- Clc1cc(Cl)c([N 91 2031762 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11405 1,5-dichloro- Clc1cc(Cl)c([N 45 2031761 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11406 5-methyl-2-(1O=C(OC1CC(C) 43 2031755 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11407 5-methyl-2-(1O=C(OC1CC(C) 53 2031753 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11408 2-methyl-5-(1O=C(O)C(C)CC 104 2031745 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11409 3-hydroxy-2-mO=C(O)C(C)C(O 182 2031731 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11410 2-methyl-3-phO=C1c2ccccc2 87 2031730 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11411 1-methyl-2-{1[I-].[I-].[nH0 197 2031727 http://dx.doi Karthikeyan M.
    x salt - AL
    11412 2-{2-[4-(dime [Cl+3]([O-])([ 208 2031726 http://dx.doi Karthikeyan M.
    x salt - AL
    11413 1,2-dimethylq[I-].[nH0+]1(C 195 2031718 http://dx.doi Karthikeyan M.
    x salt - AL
    11414 N,N-dimethyl-4
    O=C(N1c2cccc 121 2031714 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11415 N,N-dimethyl-4
    O=NN1c2ccccc 91 2031713 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11416 N,N-dimethyl-4
    Cl.Cl.N1c2ccc 211 2031709 http://dx.doi Karthikeyan M.
    x salt - AL
    11417 N,N-dimethyl-4
    N1c2ccccc2CC 68 2031708 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11418 N-methyl-N-{4[I-].[nH0+]1( 254 2031707 http://dx.doi Karthikeyan M.
    x salt - AL
    11419 4-amino-3-benO=C(C)C(=CN) 95 2031694 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11420 1-phenylpropaO=C(OCCC(OC( 51 2031688 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11421 1-(3,7-dimethyO=C(O)CC(O)( 135 2031685 http://dx.doi Karthikeyan M.
    x salt - AL
    11422 1-(3,7-dimethyO=C(O)CC(O)( 130 2031683 http://dx.doi Karthikeyan M.
    x salt - AL
    11423 N-(3,7-dimethy
    Cl.N(CCC(C)CC 79 2031678 http://dx.doi Karthikeyan M.
    x salt - AL
    11424 N',3-diphenyl O=C(NNc1cccc 117 2031670 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11425 5-Oxo-1-phenyl
    O=C(O)c1[nH0] 180 2031668 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11426 N'-phenylbutaO=C(NNc1cccc 104 2031667 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11427 5-cyclohexyl-2Oc1[nH0]c([n 197 2031665 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11428 5-oxo-1-phenyO=C1N(N=C(N1 133 2031664 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11429 5-(1,2-dibromBrC(C)C(Br)c1 128 2031663 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11430 2-phenyl-5-(2-Oc1[nH0]c([n 182 2031662 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11431 1-phenyl-3-proO=C(Oc1[nH0] 84 2031661 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11432 2-phenyl-5-proOc1[nH0]c([n 146 2031660 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11433 3-cyclohexyl-1O=C(Oc1[nH0] 108 2031658 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11434 1-phenyl-3-(2-O=C(Oc1[nH0] 109 2031657 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11435 3-cyclohexyl- O=C1N(N=C(N1 198 2031656 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11436 1-(5-bromonaBrc1cccc2cc(c 112 2031636 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11437 1-[(5-bromonaBrc1cccc2cc( 151 2031635 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11438 5-bromonaphtBrc1cccc2cc( 270 2031633 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11439 5-bromo-2-naBrc1cccc2cc(c 78 2031632 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11440 1-(5-bromonap
    Brc1cccc2c(cc 142 2031630 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11441 1-(5-bromonaBrc1cccc2c(cc 139 2031626 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11442 N-(5-cyanonapO=C(Nc1cccc2 212 2031622 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11443 5-aminonaphth
    N#Cc1cccc2c( 137 2031621 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11444 4-bromo-4-{brBrC(C1C(=O)N( 309 2031618 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11445 N-[4-(5-oxo-1 O=C1N(N=C(C1 210 2031615 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11446 5-(4-aminopheO=C1N(N=C(C1 160 2031614 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11447 5-(4-nitrophe O=[N+]([O-])c 189 2031612 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11448 diethyl 4,4'-( ClC(C1C(=O)N 221 2031611 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11449 ethyl 4-chloroClc1ccc(N2N=C 99 2031610 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11450 ethyl 4-bromoBrC(C1C(=O)N 201 2031609 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11451 diethyl 4,4'- O=C1N(N=C(C( 179 2031607 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11452 4-bromo-4-[brBrC(C1C(=O)N 308 2031605 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11453 (4'Z)-4,4'-[( BrC(=C1C(=O) 219 2031604 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11454 4,4'-methanedCl.O=C1N(N=C 240 2031602 http://dx.doi Karthikeyan M.
    x salt - AL
    11455 4-(4-hydroxybO=C1N(N=C(C) 210 2031601 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11456 4,4'-[(4-hydr O=C1N(N=C(C) 241 2031600 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11457 4-(2-hydroxybO=C1N(N=C(C) 140 2031599 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11458 methyl 7-oxooO=C1c2ccccc 221 2031597 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11459 N,N'-[(nitrosoO=NN(CCc1ccc 172 2031595 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11460 N,N-bis{2-[2- O=C(Nc1ccccc 189 2031594 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11461 N,N'-[iminobi O=C(Nc1ccccc 110 2031592 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11462 5,6-dimethyl- [I-].[nH0+]1( 224 2031589 http://dx.doi Karthikeyan M.
    x salt - AL
    11463 bis(2-nitropheO=[N+]([O-])c 110 2031587 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11464 6-acetyl-6H-inO=C([nH0]1c2 187 2031586 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11465 1,2,2,3-tetra O=C(NNc1cccc 92 2031584 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11466 [(1E,3Z)-1,2, BrC(c1ccccc1) 236 2031582 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11467 5-methyl-2-(1O=C(OC1CC(C) 50 2031581 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11468 7-(diphenylmeCC12C3CC(C(=C 164 2031579 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11469 6-(diphenylmeC=C1C2CC(C(=C 115 2031578 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11470 4-[7-(diphenylO(C)c1ccc(cc1 124 2031577 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11471 2,5-bis(2-ami Cl.Cl.Cl.Cl.N 275 2031569 http://dx.doi Karthikeyan M.
    x salt - AL
    11472 N,N'-{[2,6-bi O=C(Nc1cc(cc 268 2031568 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11473 N,N'-[(2,6-din O=[N+]([O-])c 217 2031566 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11474 N,N'-{[2,5-bi O=C(Nc1cc(CC 285 2031563 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11475 N,N'-{[2-(ace O=C(Nc1cc(cc 176 2031560 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11476 N,N'-[(2-amin O=C(NCCc1ccc 210 2031559 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11477 (2Z,2'Z)-2,2'- N#CC(=Nc1ccc( 240 2031555 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11478 (2-oxo-2,3-dihO=C1Nc2cc(cc 238 2031544 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11479 3,7-diphenylpNc1[nH0]c2cc3 301 2031533 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11480 N,N'-(1,9-diacO=C(N=C1N(c2 239 2031532 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11481 N,N'-(ethane- O=C(Nc1ccccc 250 2031515 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11482 N-[2-(1H-indoO=C(Nc1cccc 152 2031514 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11483 1,2-bis(2-nit O=[N+]([O-])c 166 2031513 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11484 (4,7,7-trimethO=COCC1C(=O) 74 2031473 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11485 (4,7,7-trimethO=C1C(COC(=O 96 2031472 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11486 3-bromo-3-(brBrCC1(Br)C(= 109 2031471 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11487 3,3'-ethane-1,O=C1C(CCC2C( 210 2031468 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11488 1,7,7-trimeth O=C1C(=C)C2C 45 2031466 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11489 3,3'-ethane-1,O=C1C(=CC=C2 240 2031461 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11490 3,3'-ethane-1,O=C1C(=CC=C2 284 2031461 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11491 N-(4-methylphO=C1C(CC(=O) 158 2031444 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11492 3-(2-hydroxyetOCCC1C(O)C2( 83 2031442 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11493 2-(4,7,7-trimeO=C1C(CC(=O) 101 2031441 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11494 1,1'-benzene-O=C(N)NN=C(C 238 2031403 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11495 3,3'-benzene-1O=C(O)C#Cc1c 168 2031402 http://dx.doi Karthikeyan M.
    x mixture - AL
    11496 5,5'-benzene-O=C1N(N=C(C1 263 2031401 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11497 2-(2-{2-chloroClC1=C(C=CC2= 259 2031390 http://dx.doi Karthikeyan M.
    x salt - AL
    11498 2-(2-{2-chlor ClC1=C(C=CC2= 281 2031388 http://dx.doi Karthikeyan M.
    x salt - AL
    11499 2-(2-{2-chloroClC1=C(C=CC2= 268 2031386 http://dx.doi Karthikeyan M.
    x salt - AL
    11500 2-(2-{2-chloroClC1=C(C=CC2= 257 2031385 http://dx.doi Karthikeyan M.
    x salt - AL
    11501 5-chloro-2-[7-Clc1ccc2[N+]( 207 2031383 http://dx.doi Karthikeyan M.
    x salt - AL
    11502 4,7,7-trimethyO=C1C2(OC(=O 207 2031379 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11503 4-bromo-8,9,9BrC1=CC(=O)O 105 2031377 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11504 4-(1H-triazire N#Cc1ccc(N2N 70 2031376 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11505 1,3-benzodioxo
    O1COc2cc(N3 129 2031375 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11506 methyl 4-(1H-tO=C(OC)c1ccc 40 2031374 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11507 (3Z)-3-{[(ace O=C1C(=CN(OC 163 2031356 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11508 (3Z)-3-{[chlo ClN(C=C1C(=O 103 2031353 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11509 (3Z)-1,7,7-tr O=[N+]([O-])c 180 2031352 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11510 (3Z)-3-{[(4-c Clc1ccc(NC=C 168 2031351 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11511 7,8,8-trimeth [nH0]1[nH0](c 125 2031350 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11512 (3Z)-1,7,7-tr O=C1C(=CNc2c 166 2031349 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11513 4-{[(Z)-(4,7,7 O=C1C(=CNc2c 222 2031348 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11514 3-{bromo[hydrBrC(N(O)c1cc 121 2031347 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11515 (3Z)-3-{[meth O=C1C(=CN(OC 76 2031346 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11516 (3Z)-3-{[(4-m O=C1C(=CNc2c 171 2031345 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11517 (3Z)-3-{[hydr O=C1C(=CN(O) 107 2031344 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11518 2,3-dimethyl- [I-].O=[N+]([ 277 2031318 http://dx.doi Karthikeyan M.
    x salt - AL
    11519 (4Z)-2-(4,7,7- O=C1C(=C2OC( 196 2031315 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11520 1,7,7-trimeth O=C1C(C(=O)c 98 2031314 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11521 3-acetyl-1,7,7O=C1C(C(=O)C 201 2031312 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11522 1,7,7-trimeth O=C1C(C(=O)c 104 2031311 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11523 N,N',N'',N'''- O=C(Nc1ccc(c 283 2031246 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11524 (E)-diazene-1,O=C(Oc1cccc( 180 2031245 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11525 (E)-diazene-1,O=C(Oc1cccc( 144 2031244 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11526 3-[(Z)-{3-[(p O=C(Oc1cccc(N 175 2031243 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11527 3-{(Z)-[3-(ac O=C(Oc1cccc(N 102 2031242 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11528 N-{3-[(Z)-{3- O=C(Nc1cccc(N 247 2031241 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11529 N-(3-{(Z)-[3- O=C(Nc1cccc(N 254 2031240 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11530 N,N'-[(E)-diaz O=C(Nc1cccc( 272 2031238 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11531 N,N'-[(E)-dia O=C(Nc1cccc( 285 2031237 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11532 benzoic acid, O=[N+]([O-])c 95 2031233 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11533 2-[3-(2-aminoOCCc1cccc(c1 264 2031207 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11534 2-phenylethylS(CCc1ccccc1) 138 2031197 http://dx.doi Karthikeyan M.
    x mixture
    11535 N-{3-[(2-oxo- O=C(Nc1cccc( 171 2031158 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11536 2-[(3-nitroph O=[N+]([O-])c 169 2031156 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11537 2-methoxy-N-O(C)C=1N=C2 165 2031154 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11538 N-(2-oxo-2,3- O=C1Nc2cc(NC 335 2031153 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11539 tetraethyl 2,2 O=C(OCC)C(Nc 79 2031151 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11540 2,2'-(benzeneO=C(CNc1cccc 164 2031147 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11541 2,2'-(benzeneO=C(CNc1ccc( 151 2031144 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11542 pyrido[2,3-g]qO.[nH0]1cccc 234 2031141 http://dx.doi Karthikeyan M.
    x salt
    11543 methyl 3-(6,8-O=[N+]([O-]) 166 2031137 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11544 3-(6-nitro-2-oO=[N+]([O-]) 258 2031134 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11545 ethyl 3-(2-oxoO=C1Nc2cc(cc 124 2031132 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11546 methyl 3-(2-o O=C1Nc2cc(cc 143 2031131 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11547 3-(2-oxo-1,2,3O=C1Nc2cc(cc 240 2031130 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11548 N,N'-[(2-nitro O=[N+]([O-])c 134 2031118 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11549 2-nitrobenzenO=[N+]([O-]) 97 2031117 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11550 5-(ethoxycarbo
    O=[N+]([O-])c 154 2031114 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11551 (4,6-dinitrob O=[N+]([O-])c 174 2031111 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11552 1-acetyl-2,6-dO=C(N1c2cc3[ 275 2031097 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11553 N,N'-[(2-nitr O=[N+]([O-]) 38 2031096 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11554 N,N'-[benzene-
    O=[N+]([O-])C 127 2031093 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11555 1,1'-benzene-1O=[N+]([O-])C 160 2031091 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11556 1,1'-(2-nitrob O=[N+]([O-])c 172 2031089 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11557 N,N'-[benzeneO(CC)C(OCC)C 61 2031087 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11558 3,3'-benzene-1S=C(Cc1cccc(c 85 2031084 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11559 1,1'-benzene-ClCC(=O)c1ccc 90 2031073 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11560 4-furan-2-yl-1O=C(Cc1ccccc 130 2031070 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11561 1,3-diphenyl- O=C(Cc1ccccc 137 2031069 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11562 N,N'-(buta-1, O=C(Nc1ccccc 211 2031068 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11563 N,N'-(butane-O=C(Nc1ccccc 211 2031063 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11564 N,N'-(butane-O=C(Nc1ccccc 236 2031062 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11565 2,2'-butane-1,Nc1ccccc1CCC 74 2031061 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11566 1,4-dichloro- Clc1cc(c(Cl)cc 72 2031059 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11567 methyl [2-(2- Cl.O=C(OC)NC 167 2031056 http://dx.doi Karthikeyan M.
    x salt
    11568 N-{2-[2-(acet O=C(NCCc1ccc 144 2031055 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11569 methyl {2-[2-(O=[N+]([O-])c 181 2031053 http://dx.doi Karthikeyan M.
    x mixture
    11570 methyl {2-[2- O=C(OC)NCCc1 107 2031052 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11571 1,3-bis(1,2-d BrC([N+](=O)[O 147 2031041 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11572 2-(2-phenylhyNc1ccccc1NNc 107 2031040 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11573 (E)-1-phenyl-2[O-][N+](=Nc1 253 2031039 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11574 N-{4-[2-acety O=C(Nc1ccc(N 218 2031038 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11575 N-[4'-(1-acet O=C(Nc1ccc(cc 233 2031021 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11576 N'-phenyl-N-{4O=C(N(Nc1cccc 244 2031020 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11577 N-[2-(2-phenyO=C(Nc1ccccc 168 2031019 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11578 N-[4-(1-acety O=C(Nc1ccc(N 199 2031018 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11579 4'-(2-phenylh Nc1ccc(cc1)c1 140 2031017 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11580 N-{4'-[(E)-pheO=C(Nc1ccc(cc 237 2031016 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11581 N,N'-biphenyl-O=C(N(Nc1cccc 235 2031015 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11582 N-[(1E)-(4-meO(C)c1ccc(cc1 215 2031013 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11583 (E)-1-phenyl-2N(=Nc1ccc(cc1 173 2031012 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11584 N'-(4'-nitrobi O=[N+]([O-])c 161 2031011 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11585 (E)-1-(4'-nitr O=[N+]([O-])c 179 2031010 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11586 4'-[(E)-pheny N(=Nc1ccc(cc1 226 2031009 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11587 3-amino-5,6,7O=Cc1cc2cc3C 218 2030994 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11588 (E,E)-1,1'-[(E N(=Nc1ccc(N= 233 2030992 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11589 N,N'-{(E)-diaz O=C(Nc1ccc(N 247 2030989 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11590 4,4'-{benzene-Nc1ccc(N=Nc2 292 2030987 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11591 (E,E)-2,2'-ben N(=Nc1ccc(N= 275 2030986 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11592 N,N'-{benzeneO=C(Nc1ccc(N 336 2030985 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11593 4,4'-[benzene-Nc1ccc(N=Nc2 247 2030978 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11594 N'-phenyl-N-{ O=C(N(Nc1ccc 186 2030975 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11595 2,2'-(4,6-dini O=[N+]([O-])c 267 2030967 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11596 diethyl 2,2'-{ O=C(OCC)Nc1c 140 2030966 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11597 (2Z,2'Z)-2,2'- N#CC(=Nc1ccc( 150 2030965 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11598 1,7-diacetyl-5O=C1N(c2cc3N 295 2030960 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11599 3-cyclohexylhOC(CCC)C(O)( 78 2030950 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11600 2-(4-methoxycO=C(Nc1ccc(C 144 2030939 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11601 2-(4-methoxycO=C(Nc1cccc2 163 2030938 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11602 5-ethyl-5-(4- O=C1NC(=O)C( 240 2030935 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11603 5-(4-methoxycO=C1NC(=O)C( 215 2030934 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11604 (4-methoxycycO=C(O)CC1CC 78 2030933 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11605 N-(4-bromophBrc1ccc(NC(= 154 2030929 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11606 acetamide, N-O=C(Nc1ccc(O 132 2030928 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11607 N-phenyl-N-[(O=C(N(CC(=Nc1 142 2030925 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11608 (1E)-N,N'-dib N(c1ccc(cc1)c 190 2030924 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11609 (1E)-N,N'-bis O(CC)c1ccc(N 113 2030923 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11610 (1E)-N,N'-bis O(C)c1ccc(N=C 159 2030922 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11611 (1E)-N,N'-bis N(c1ccc(C)cc1 136 2030921 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11612 2,8-diphenylpy[nH0]1c(ccc2c 279 2030907 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11613 diethyl 2,8-di O=C(OCC)c1cc 167 2030901 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11614 2,2'-(4,6-dini O=[N+]([O-])c 154 2030886 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11615 N,N'-[(4,6-din O=[N+]([O-])c 165 2030883 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11616 1,1'-(2,4,6,8- O=C(C)c1c([nH 247 2030877 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11617 4,6-dimethyl- [nH0]1c(cc(C) 285 2030875 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11618 2,2'-(4,6-din O=[N+]([O-])c 148 2030871 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11619 4,6-dinitrobenClC(=O)c1cc(c 107 2030870 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11620 o-ChloroacetoClCC(=O)c1cc 113 2030869 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11621 2-[1,2-dibromBr.BrC(c1[nH0 254 2030864 http://dx.doi Karthikeyan M.
    x salt
    11622 2,4,6-trinitro BrC(c1[nH0]cc 174 2030863 http://dx.doi Karthikeyan M.
    x mixture
    11623 2-[1,2-dibromo
    BrC(c1[nH0]cc 182 2030862 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11624 2-pyridin-2-yl O=[N+]([O-])c 178 2030859 http://dx.doi Karthikeyan M.
    x mixture
    11625 2-pyridin-2-yl Cl.O=C1c2cccc 196 2030857 http://dx.doi Karthikeyan M.
    x salt
    11626 2-pyridin-2-y O=C1c2ccccc2 160 2030856 http://dx.doi Karthikeyan M.
    x mixture
    11627 4-methyl-2-[2-S1CC(SC1C=Cc 70 2030855 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11628 2-pyridin-2-yl O=C1c2ccccc2 186 2030850 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11629 2-pyridin-2-yl O=[N+]([O-])c 202 2030849 http://dx.doi Karthikeyan M.
    x mixture
    11630 2-pyridin-2-yl O=C(OC1=C2C 130 2030848 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11631 2,4,6-trinitro O=[N+]([O-])c 175 2030847 http://dx.doi Karthikeyan M.
    x mixture
    11632 2-[(2-nitropheO=[N+]([O-])c 55 2030846 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11633 2,4,6-trinitro ClC(c1[nH0]cc 168 2030845 http://dx.doi Karthikeyan M.
    x mixture
    11634 2-[1,2-dichlor Cl.ClC(c1[nH0 176 2030844 http://dx.doi Karthikeyan M.
    x salt
    11635 2-[1,2-dichlor ClC(c1[nH0]cc 144 2030843 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11636 1-amino-2-(2-O=C1c2ccccc2 214 2030832 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11637 1-(1,2-dihydr O=C(c1ccc2CC 138 2030828 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11638 1-(1,2-dihydr O=C(c1ccccc1 148 2030824 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11639 2-(1,2-dihydr [nH0]1c2ccccc 162 2030821 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11640 2-(1,2-dihydr O=C(OC(c1ccc 156 2030820 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11641 2-bromo-1-(1,BrC(c1ccccc1) 118 2030818 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11642 1-naphthalen-O=C(c1ccccc1) 102 2030815 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11643 2-hydroxy-1-nO=C(c1cccc2cc 105 2030812 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11644 2-(phenylethyC(#Cc1ccc2ccc 117 2030811 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11645 2-naphthalen-[nH0]1c2ccccc 122 2030810 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11646 2-Naphthalen-[nH0]1c2ccccc 138 2030809 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11647 2-hydroxy-1-nO=C(c1ccc2ccc 152 2030808 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11648 2-bromo-1-nap
    BrC(c1ccccc1) 64 2030806 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11649 1-naphthalen-2
    O=[N+]([O-])c 143 2030803 http://dx.doi Karthikeyan M.
    x mixture
    11650 1-naphthalen-1
    O=[N+]([O-])c 102 2030802 http://dx.doi Karthikeyan M.
    x mixture
    11651 1,1'-(4,6-dini ClCC(=O)c1cc( 148 2030797 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11652 4,4'-[benzene-ClC(c1cccc(c1 248 2030784 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11653 4,4'-[benzene-ClC(c1ccc(cc1 278 2030780 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11654 2,2'-benzene-1O=[N+]([O-])c 287 2030779 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11655 1,1'-[benzene-BrC(c1ccc(cc1 265 2030775 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11656 bis(1-methylpy[S+2]([O-])([O 247 2030769 http://dx.doi Karthikeyan M.
    x mixture
    11657 tetraethyl 2, BrC(c1cc(c([N 130 2030761 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11658 N,N'-[(Z)-1,2 O=C(NC(c1cccc 100 2030758 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11659 alpha,alpha'- NC(c1ccccc1)= 108 2030757 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11660 N-[2-(phenyleO=C(Nc1ccccc 119 2030755 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11661 dimethyl 3,3' ClC(c1cccc(c1 131 2030751 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11662 3,3'-benzene-BrC(c1cccc(c1 225 2030750 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11663 3-(2-oxo-1,2,3O=C1Nc2ccc(c 234 2030749 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11664 dimethyl 3,3' O=C(OC)C#Cc1 93 2030748 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11665 3,3'-benzene-1O=C(O)C#Cc1c 209 2030747 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11666 tetraethyl 2,2 ClC(Cc1cc(CC( 146 2030736 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11667 dimethyl 3,3' BrC(c1cccc(c1 145 2030735 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11668 tetraethyl 2,2 O=[N+]([O-]) 80 2030734 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11669 tetraethyl 2, O=C(OCC)C(=C 174 2030733 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11670 methyl 3-(2-o O=C1Nc2ccc(c 134 2030730 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11671 N-[2-(2-phenyO=C(Nc1ccccc 117 2030728 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11672 diethyl 2,8-di O=C1Nc2cc3N 242 2030722 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11673 5,5'-(benzeneO=C1NC(=O)C( 272 2030721 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11674 5,5'-(benzeneO=C1NC(=O)C( 340 2030720 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11675 2,4,6-trinitro O=[N+]([O-])c 205 2030718 http://dx.doi Karthikeyan M.
    x mixture
    11676 1,2,3,4,6,7,8, N1CCCc2cc3C 113 2030717 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11677 1,2,3,4,6,7,8 O=C(c1ccccc1 209 2030716 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11678 1,1'-(1,2,3,4, O=C(C)c1c2NC 143 2030715 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11679 5,10-dinitro-1O=[N+]([O-]) 187 2030714 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11680 3,4,6,7,8,9-h O=C1Nc2cc3N 235 2030713 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11681 methyl 3-[7-( O=C1Nc2cc(NC 245 2030711 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11682 dimethyl 3,3'-O=[N+]([O-])c 71 2030709 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11683 2,4,6-trinitro O=[N+]([O-])c 98 2030695 http://dx.doi Karthikeyan M.
    x mixture
    11684 diethyl 4,6-di O=[N+]([O-])c 124 2030689 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11685 (phenylimino)N#CC(=Nc1ccc 87 2030657 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11686 (E)-bis{4-[(Z [O-][N+](=Nc1 139 2030654 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11687 2,2',2''-benze [nH0]1cc([nH0 302 2030652 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11688 1,1',1''-benze BrCC(=O)c1cc( 111 2030650 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11689 diethyl 2,2'-( O=C(OCC)C(C( 99 2030645 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11690 1,1'-(2-nitrob O=[N+]([O-])c 46 2030639 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11691 2,2'-benzene-1N1=CC=NC(C1) 262 2030638 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11692 (2E,2'E)-1,1'- O=C(C=Nc1ccc 155 2030637 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11693 1,1'-benzene-1ClC(Cl)(Cl)C(= 121 2030633 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11694 2,2,2-trichlor ClC(Cl)C(=O)c1 136 2030632 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11695 1,1'-benzene-1ClC(Cl)C(=O)c1 143 2030631 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11696 2,2-dichloro- ClCC(=O)c1ccc 147 2030630 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11697 N-{4-[(E)-(4- O=C(Nc1ccc(N 212 2030629 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11698 N,N'-{4-methyO=C(Nc1cc(N= 255 2030628 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11699 4,4'-{[2-methyNc1ccc(N=Nc2c 177 2030627 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11700 N,N'-{[2-methyO=C(Nc1ccc(N 284 2030626 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11701 (E,E)-1,1'-[2- N(=Nc1cc(c(N= 108 2030625 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11702 (E,E)-2,2'-[2- N(=Nc1ccc(N=N 226 2030624 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11703 (E,E)-2,2'-(2- N(=Nc1ccc(N= 209 2030623 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11704 (E)-1-{2-methy[O-][N+](=Nc1 193 2030622 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11705 2-methyl-1,4-[O-][N+](=Nc1 100 2030621 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11706 (E,E)-1,1'-(2- N(=Nc1ccc(N=N 109 2030620 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11707 (E,E)-1,1'-[2- N(=Nc1cc(c(N= 140 2030619 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11708 1-methyl-4-(1[O-][N+](=Nc1 127 2030618 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11709 (E)-1-{2-meth [O-][N+](=Nc1 103 2030617 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11710 2-methyl-1,4-O=Nc1ccc(N=O 137 2030616 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11711 (E)-1-{5-meth [O-][N+](=Nc1 118 2030615 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11712 (E)-1-phenyl- [O-][N+](=Nc1 131 2030614 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11713 N-[(1E)-(5-br Brc1ccc([N+]( 232 2030612 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11714 1-[(5-bromo-8Brc1ccc([N+]( 205 2030611 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11715 1-[(5-bromonaBrc1cccc2c(cc 222 2030610 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11716 1-[(5-bromo-8Brc1ccc([N+]( 244 2030608 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11717 5-bromo-8-nitBrc1ccc([N+]( 135 2030607 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11718 1-[(5-bromonaBrc1cccc2c(cc 268 2030605 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11719 1-bromo-5-(diBrc1ccc([N+]( 95 2030603 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11720 5-bromonaphtBrc1cccc2c(cc 105 2030602 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11721 1-[1,2-dibromBrC(c1ccc([N+ 161 2030600 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11722 2-naphthalen-O=[N+]([O-])c 223 2030599 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11723 N,N'-(2-hydroO=C(Nc1ccc2c 235 2030593 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11724 6-[(phenylcar O=C(Oc1ccc2c 227 2030588 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11725 5-[(phenylcar O=C(Oc1ccc2c 223 2030587 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11726 4-{2-methyl-5-O=[N+]([O-])c 115 2030583 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11727 4-{2-methyl-6-O=[N+]([O-])c 173 2030582 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11728 2,4,6-trinitro O=[N+]([O-])c 141 2030580 http://dx.doi Karthikeyan M.
    x mixture
    11729 4-(2-methyl-6-O=[N+]([O-]) 95 2030579 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11730 4-[2-methyl-6-O=[N+]([O-])c 138 2030578 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11731 2-{(E)-[2-methO=C(C)CCc1cc 157 2030577 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11732 N-{1-methyl-3O=C(C)CCc1cc 122 2030575 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11733 4-(2-methyl-1,OC(C)CCc1ccc 79 2030573 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11734 4-(2-methylquiO=[N+]([O-])c 169 2030571 http://dx.doi Karthikeyan M.
    x mixture
    11735 4-[2-methyl-1O=C(C)CCc1cc 74 2030570 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11736 4-(2-methyl-1O=C(C)CCc1cc 54 2030569 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11737 4,4'-(2-nitrob O=[N+]([O-])c 58 2030567 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11738 2,4,6-trinitro O=[N+]([O-])c 172 2030566 http://dx.doi Karthikeyan M.
    x mixture
    11739 2,7-dimethyl-1O=C(N1c2cc3C 145 2030565 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11740 2,7-dimethyl-1O=C(N1c2cc3C 270 2030564 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11741 2,7-dimethylp[nH0]1c(C)ccc 238 2030563 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11742 2,7-dimethyl-1[nH0]1c(C)cc 171 2030561 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11743 2,7-dimethyl-1O=C(N1c2cc3c 155 2030560 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11744 2,2'-benzene-1[nH0]1cc([nH0 203 2030507 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11745 1,1'-benzene-BrCC(=O)c1ccc 91 2030505 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11746 benzene-1,3-dO=C(OC(C)c1c 136 2030504 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11747 benzene-1,3-diO=C(OC(C)c1cc 105 2030503 http://dx.doi Karthikeyan M.
    x mixture
    11748 1,5-bis(phenylO=C(N1CCc2cc 294 2030501 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11749 (2,5-dinitrobeO=[N+]([O-])c 158 2030500 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11750 1,4-bis(2-bro BrCCc1cc([N+] 123 2030499 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11751 1,4-bis(2-iod ICCc1ccc(cc1) 111 2030498 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11752 1,4-bis(2-bro BrCCc1ccc(cc1 73 2030497 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11753 1,4-bis(2-chl ClCCc1ccc(cc1 47 2030496 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11754 benzene-1,4-dO=C(OCCc1ccc 213 2030495 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11755 benzene-1,4-diO=[N+]([O-])c 173 2030494 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11756 benzene-1,4-dO=C(OCCc1ccc 137 2030493 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11757 benzene-1,4-diO=C(OCCc1ccc 65 2030492 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11758 naphthalene-2Nc1ccc2cc(N) 213 2030489 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11759 N-(2,3-diphenO=C(Nc1cccc2c 249 2030482 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11760 N-(5-aminonap
    O=C(Nc1cccc2 166 2030479 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11761 2,3-dibenzylq [nH0]1c2ccccc 118 2030478 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11762 1,4-dibromo-1BrC(c1ccccc1) 124 2030477 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11763 1-bromo-1,4-dBrC(c1ccccc1) 73 2030476 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11764 3-[(4-bromophBrc1ccc(NN=C( 139 2030470 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11765 3-[(4-nitroph O=[N+]([O-])c 122 2030469 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11766 4-methoxy-N-[O=C(Nc1ccc(cc 106 2030467 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11767 N-[4-(2-phenyO=C(Nc1ccc(cc 173 2030466 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11768 4-(2-phenyl-2HNc1ccc(cc1)c1 143 2030465 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11769 2-[(2-aminophO=C(Nc1ccccc1 160 2030463 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11770 N-{2-[(E)-phe O=C(Nc1ccccc 123 2030462 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11771 2,4,4-triphenyO=C1N(N(c2cc 163 2030461 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11772 N-phenyl-N'-{ O=C(N(Nc1ccc 103 2030460 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11773 (E)-1-phenyl- N(=Nc1ccccc1 99 2030459 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11774 (E,E)-1,1'-ben N(=Nc1ccccc1 111 2030458 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11775 2-methoxy-6-nO=[N+]([O-])c 134 2030457 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11776 4,4'-benzene-1OC(C)CCc1ccc 44 2030456 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11777 4,4'-benzene-O=C(C)CCc1cc 56 2030455 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11778 8-nitronaphthO=[N+]([O-])c 125 2030454 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11779 N-[(1E)-(8-nit O=[N+]([O-])c 115 2030452 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11780 2-methoxy-1- O(C)c1ccc2cc 126 2030451 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11781 N-[(1E)-(5-nit O=[N+]([O-])c 84 2030450 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11782 2-methoxy-6-nO=[N+]([O-])c 187 2030449 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11783 2-methoxy-6-nO=[N+]([O-])c 174 2030448 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11784 2-(4-nitrobenzO=[N+]([O-])c 82 2030447 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11785 3-(4-nitrophenO=[N+]([O-])c 134 2030446 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11786 3-(4-nitrophe O=[N+]([O-])c 152 2030443 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11787 3-(4-nitrophe O=[N+]([O-])c 176 2030442 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11788 2-methyl-3,5-o1c(cc(c2cccc 44 2030441 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11789 2-acetyl-4-oxoO=C(CC(C#N)(c 94 2030438 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11790 1-(2-nitrophe O=[N+]([O-])c 100 2030435 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11791 1-(acetyloxy)-O=C(O[nH0]1c 195 2030434 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11792 N-[2,4-dibromBrc1cc(Br)c(N 156 2030433 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11793 N-[2-(3,4-dip O=C(Nc1ccccc1 190 2030432 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11794 2-(3,5-diphenyo1[nH0]c(c2cc 185 2030431 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11795 5-(2-nitrophenO=[N+]([O-])c 127 2030429 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11796 (2-aminopheny
    OC(c1ccccc1)( 122 2030428 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11797 6,8-dibromo-4Brc1cc(Br)c2[ 211 2030427 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11798 2-benzyl-4,6- Brc1cc(Br)c(N 195 2030426 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11799 2-AMINO-3,5 Brc1cc(Br)c(N 98 2030425 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11800 (2-amino-3,5-Brc1cc(Br)c(N 152 2030424 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11801 (2-amino-4-b Brc1ccc(c(N)c 113 2030423 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11802 2-phenyl-5-(2 N(=Cc1ccccc1 118 2030417 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11803 1-acetyl-2-ph O=C(N1c2cccc 129 2030414 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11804 N-[2-(2-phenyO=C(Nc1ccccc 166 2030398 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11805 2-(2-phenylet Oc1ccccc1CCc 85 2030397 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11806 [6-nitro-2-ph O=[N+]([O-])c 204 2030388 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11807 1-acetyl-6-nit O=[N+]([O-])c 179 2030383 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11808 4-nitro-2-[(p O=[N+]([O-])c 252 2030382 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11809 7-oxido-5-oxo-O=C1c2cc3c([n 246 2030381 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11810 ethyl 4-nitro O=[N+]([O-])c 179 2030378 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11811 1-acetyl-6-nit O=[N+]([O-])c 178 2030374 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11812 1-acetyl-6-nit O=[N+]([O-])c 133 2030371 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11813 6-nitro-2-phe O=[N+]([O-])c 185 2030369 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11814 1,1'-(4,6-dia O=C(C)c1cc(c( 235 2030366 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11815 5,6,7,8-tetra Clc1c(Cl)c(Cl 267 2030335 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11816 1,2,3,4-tetra Clc1c(Cl)c(Cl 262 2030328 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11817 (5,6,7,8-tetr Clc1c(Cl)c(Cl 172 2030327 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11818 5,6,7,8-tetra Clc1c(Cl)c(Cl 183 2030325 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11819 1,2,3,4-tetra BrC(Br)c1ccc2C 247 2030324 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11820 N,N'-[4,6-bis O=C(Nc1cc(NC 206 2030320 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11821 (4,6-dinitrobeO=[N+]([O-])c 165 2030319 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11822 (4,6-dinitrobeO=[N+]([O-]) 91 2030318 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11823 2,2'-[(4,6-din O=[N+]([O-])c 136 2030317 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11824 ethyl N-(5-chl Clc1cc(NCC(=O 146 2030315 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11825 diethyl 2,2'-[ O=[N+]([O-]) 198 2030314 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11826 N,N'-(4,6-din O=[N+]([O-])c 233 2030313 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11827 diethyl 2,2'-( O=[N+]([O-])c 118 2030311 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11828 1,1'-(1,7-diph O=C(C)c1[nH0] 311 2030310 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11829 2,2'-(4,6-dini O=[N+]([O-])c 239 2030307 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11830 1,1'-(4,6-dini O=[N+]([O-])c 119 2030306 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11831 (1Z,1'Z)-1,1'- O=[N+]([O-])c 175 2030305 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11832 2-(5-chloro-2 Clc1cc(c([N+] 185 2030302 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11833 2-(5-chloro-2 Clc1cc(c([N+] 131 2030300 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11834 2-(5-chloro-2 Clc1cc(c([N+] 131 2030298 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11835 ethyl (5-chlor Clc1cc(c([N+] 109 2030297 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11836 2-(5-chloro-2 Clc1cc(CC(=O) 133 2030296 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11837 2,2'-(4,6-dini O=[N+]([O-])c 171 2030293 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11838 (4,6-dinitrobeO=[N+]([O-])c 133 2030291 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11839 (4,6-dinitrobeO=[N+]([O-])c 167 2030290 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11840 1-acetyl-2,6-dO=C(N1C2=CC 279 2030289 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11841 [4-(benzyloxy O=C([nH0]1cc( 181 2030043 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11842 5-pyrimidineprO=C1N(C)C=C( 225 2029987 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11843 2-amino-4-metO=C1N(c2ccccc 233 2029978 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11844 2-bromo-N-cycBrC(C(=O)NC1C 87 2029967 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11845 propanamide,Fc1ccc(NC(=O)C
    3 44 2029966 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11846 N-(3-chloro-4 Clc1cc(NC(=O)C 72 2029965 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11847 N-(2,4-dinitroFC(F)(F)C(C(=O 164 2029960 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11848 N-(2,4-dibromBrc1ccc(NC(=O) 229 2029959 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11849 N-(4-acetylpheFC(F)(F)C(C(=O 224 2029958 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11850 3,3,3-trifluor FC(F)(F)C(C(=O 281 2029957 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11851 3,3,3-trifluo FC(F)(F)C(C(=O 188 2029956 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11852 2,2,3,3,4,4,5 FC(F)(F)C(F)(F 92 2029949 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11853 N-(2,4-dioxo-1FC(F)(F)C(F)(F 251 2029948 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11854 N-(1,5-dimethFC(F)(F)C(F)(F 177 2029947 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11855 2,2,3,3,4,4,5, FC(F)(F)C(F)(F 161 2029946 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11856 N-(2,4-dinitroFC(F)(F)C(F)(F 125 2029945 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11857 2,2,3,3,4,4,5, Clc1cc(Cl)c(NC 115 2029944 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11858 N-(2,4-dibromBrc1ccc(NC(=O) 95 2029943 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11859 2,2,3,3,4,4,5 FC(F)(F)C(F)(F 118 2029942 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11860 N-(3,4-dimethFC(F)(F)C(F)(F 111 2029941 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11861 N-(2,4-dimethFC(F)(F)C(F)(F 83 2029940 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11862 N-(4-butoxyphFC(F)(F)C(F)(F 137 2029939 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11863 N-(4-ethoxyphFC(F)(F)C(F)(F 135 2029938 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11864 N-[5-(ethylsuls1c(SCC)[nH0][ 131 2029937 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11865 N-1,3-benzothis1c2ccccc2[nH0 169 2029936 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11866 ethyl 4-[(2,2, FC(F)(F)C(F)(F 136 2029935 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11867 N-(4-acetylphFC(F)(F)C(F)(F 155 2029934 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11868 2,2,3,3,4,4,5 FC(F)(F)C(F)(F 63 2029933 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11869 2,2,3,3,4,4,5, FC(F)(F)C(F)(F 151 2029932 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11870 2,2,3,3,4,4,5, s1cc[nH0]c1NC( 146 2029931 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11871 2,2,3,3,4,4,5 FC(F)(F)C(F)(F 94 2029930 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11872 nonanamide, 2,
    FC(F)(F)C(F)(F 119 2029929 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11873 Nonanamide, FC(F)(F)C(F)(F
    2, 66 2029928 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11874 2,2,3,3,4,4,5, FC(F)(F)C(F)(F 145 2029927 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11875 nonanamide, 2FC(F)(F)C(F)(F 97 2029926 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11876 2,2,3,3,4,4,5 FC(F)(F)C(F)(F 100 2029925 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11877 N-cyclohexyl- FC(F)(F)C(F)(F 57 2029923 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11878 N,N-dibenzyl- FC(F)(F)C(F)(F 49 2029922 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11879 propanamide,Brc1ccccc1NC( 184 2029911 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11880 N-(2,4-dinitroFC(F)(F)C(C(= 121 2029910 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11881 propanamide,Clc1cc(Cl)c(NC
    3 219 2029909 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11882 N-(2,6-dichlorClc1cccc(Cl)c1 196 2029908 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11883 3,3,3-trifluo FC(F)(F)C(C(= 211 2029907 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11884 N-(3,4-dimethFC(F)(F)C(C(=O 189 2029906 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11885 N-(4-butoxyphFC(F)(F)C(C(= 172 2029905 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11886 N-(4-ethoxyphFC(F)(F)C(C(= 181 2029904 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11887 propanamide,FC(F)(F)C(C(=
    N 174 2029903 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11888 3,3,3-trifluor FC(F)(F)C(C(=O 189 2029902 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11889 3,3,3-trifluor FC(F)(F)C(C(= 156 2029901 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11890 3,3,3-trifluo Ic1ccc(NC(=O)C 236 2029900 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11891 3,3,3-trifluo FC(F)(F)C(C(= 163 2029899 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11892 propanamide,FC(F)(F)C(C(=
    3 137 2029898 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11893 3,3,3-trifluor FC(F)(F)C(C(= 201 2029897 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11894 N-cyclohexyl- FC(F)(F)C(C(= 169 2029896 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11895 propanamide,FC(F)(F)C(C(=
    3 76 2029895 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11896 N-decyl-3,3,3-FC(F)(F)C(C(= 66 2029891 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11897 3,3,3-trifluo FC(F)(F)C(C(= 112 2029889 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11898 3,3,3-trifluor FC(F)(F)C(C(= 111 2029888 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11899 N-butyl-3,3,3-FC(F)(F)C(C(= 94 2029887 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11900 3,3,3-trifluor FC(F)(F)C(C(= 117 2029886 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11901 3,3,3-trifluor FC(F)(F)C(C(=O 136 2029885 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11902 propanamide,FC(F)(F)C(C(=
    3 106 2029884 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11903 dimethyl 4,4' O=C(OC)c1ccc( 115 2029811 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11904 benzyl 4-(3,4 O=C1NC(C)=C( 215 2029753 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11905 benzyl 4-[2-( O=C1NC(C)=C( 202 2029752 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11906 5-pyrimidinecaO=C1NC(C)=C( 195 2029751 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11907 methyl 4-(4-c Clc1ccc(cc1) 172 2029750 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11908 propyl 4-(2-h O=C1NC(C)=C( 189 2029749 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11909 isopropyl 4-( O=C1NC(C)=C( 167 2029748 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11910 propyl 4-(2,3 O=C1NC(C)=C( 163 2029747 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11911 methyl 4-(2-h O=C1NC(C)=C( 208 2029746 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11912 5-pyrimidinecaO=C1NC(C)=C( 159 2029745 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11913 5-pyrimidinecaO=C1NC(C)=C( 144 2029744 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11914 tert-butyl 4-( O=C1NC(C)=C( 210 2029743 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11915 Isobutyl 6-(1 O=C1NC(C)=C( 178 2029742 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11916 butyl 4-(1,3-b O=C1NC(C)=C( 143 2029741 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11917 Isopropyl 6-( O=C1NC(C)=C( 186 2029740 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11918 5-pyrimidinecaO=C1NC(C)=C( 184 2029739 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11919 methyl 4-(1,3 O=C1NC(C)=C( 240 2029738 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11920 5-pyrimidinecaO=C1NC(C)=C( 176 2029737 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11921 benzyl 4-fura O=C1NC(C)=C( 195 2029736 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11922 3-methylbutylO=C1NC(C)=C( 176 2029735 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11923 pentyl 4-fura O=C1NC(C)=C( 166 2029734 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11924 tert-butyl 4-f O=C1NC(C)=C( 208 2029733 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11925 1-methylpropyO=C1NC(C)=C( 185 2029732 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11926 2-methylpropyO=C1NC(C)=C( 170 2029731 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11927 butyl 4-furan-O=C1NC(C)=C( 170 2029730 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11928 isopropyl 4-(2O=C1NC(C)=C( 205 2029729 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11929 1-methylethylS=C1NC(C)=C(C 75 2029728 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11930 methyl 6-methS=C1NC(C)=C(C 175 2029727 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11931 benzyl 6-methS=C1NC(C)=C(C 176 2029726 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11932 isopropyl 6-meS=C1NC(C)=C(C 225 2029725 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11933 5-pyrimidinecaS=C1NC(C)=C( 175 2029724 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11934 isobutyl 6-meS=C1NC(C)=C( 153 2029723 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11935 propyl 6-methy
    S=C1NC(C)=C(C 209 2029722 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11936 methyl 6-methS=C1NC(C)=C(C 247 2029721 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11937 Isopropyl 4-mS=C1NC(C)=C( 177 2029720 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11938 propyl 6-methS=C1NC(C)=C( 169 2029719 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11939 benzyl 4-furanS=C1NC(C)=C( 164 2029718 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11940 1-methylethylS=C1NC(C)=C( 191 2029717 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11941 propyl 4-furanS=C1NC(C)=C( 177 2029716 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11942 Ethyl 6-(2-fur S=C1NC(C)=C( 174 2029715 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11943 bis(1-methyleO=C(OC(C)C)C 141 2029714 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11944 bis(1-methyleO=C(OC(C)C)C 196 2029713 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11945 dipropyl 4-(2 O=C(OCCC)C1= 167 2029712 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11946 diethyl 4-(2- O=C(OCC)C1=C 207 2029711 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11947 dimethyl 4-(2 O=C(OC)C1=C( 191 2029710 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11948 dibutyl 4-fura O=C(OCCCC)C1 87 2029709 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11949 dipropyl 4-furO=C(OCCC)C1= 112 2029708 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11950 dipropyl 2,6- O=C(OCCC)C1= 119 2029707 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11951 5-methylandroO=C1CCC2(C)C 148 2029705 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11952 benzyl(methylO=C(O)C(C)(C 132 2029704 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11953 2-(1-carboxypO=C(O)c1cccc 170 2029703 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11954 N-(2-hydroxy-O=C(NC(CO)c1 140 2029702 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11955 1,1-diphenylpOC(C)C(O)(c1c 92 2029700 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11956 2,7-Dimethyl-O=C1c2ccc(C)c 163 2029699 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11957 1,1'-{methaneO=C(C)c1cc(C 143 2029696 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11958 N-(2-methylcyO=C(NC=1CCC 90 2029694 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11959 17-oxoandrostO=C1CCC2C3C 164 2029687 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11960 4a,7,8-trimet Cc1ccc2c(CCC 156 2029684 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11961 6-methoxy-1-m
    O=C(O)C1CCc2 133 2029680 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11962 10,17,17-trimO=C1CCC2(C)C 135 2029679 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11963 3-hydroxy-14-O=C1CCC2(C)c 261 2029677 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11964 1-(6-methoxynOC(C)C(O)c1c 115 2029669 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11965 7-methylideneO=C(OC1CCC2( 192 2029668 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11966 pregna-5,17-dO=C(OC1CCC2( 137 2029666 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11967 methyl chol-6O=C(OC)CCC( 60 2029664 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11968 16-methyl-17-O=C1C(C)CC2 141 2029657 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11969 10,13-dimethyO=C1CCC2(C) 188 2029655 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11970 3-[(acetyloxy)O=C1CCC2C3CC 141 2029652 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11971 3-(3,12-dihyd O=C(O)CC(C)C 181 2029650 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11972 3-acetylandroO=C(OC1CCC2 140 2029646 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11973 androstane-3,O=C1CCC2(C)C 163 2029645 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11974 21-phenylpregCC12CCC3C(C 118 2029644 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11975 3,17-dihydroxO=C1CC2CC(O) 198 2029641 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11976 androsta-4,14O=C1C=C2CCC 117 2029639 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11977 17-methyl-21-O=C(OC1CCC2( 135 2029635 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11978 21-phenylpregO=C(OC1CCC2( 119 2029628 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11979 4-bromo-3-oxo
    BrC1C(=O)CCC 190 2029623 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11980 21-phenylpregO=COC1CCC2(C 180 2029622 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11981 10,13-dimethyO=C(OC1CCC2 144 2029617 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11982 3-hydroxyandrO=C1C=C2CC(O 238 2029605 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11983 3,17-dipropoxO=C1CC2CC(O 161 2029604 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11984 3,17-dipropoxO=C1CC2CC(O 163 2029604 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11985 7-benzyl-4a,8 Cc1ccc2c(CCC 95 2029598 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11986 21-phenylpregO=C(OC1CCC2( 166 2029593 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11987 21-phenylpregOC1CCC2(C)C( 152 2029590 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11988 21-phenylpregOC1CCC2(C)C( 162 2029590 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11989 10,13-dimethyO1CCOC11CCC 209 2029589 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11990 10,13-dimethyO=C1CCC2C3C 153 2029587 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11991 21-phenylpregOC1(C#Cc2cc 103 2029586 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11992 10,13-dimethyS1CCOC11CCC 201 2029579 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11993 3-(benzyloxy) O=C1CCC2C3C 216 2029577 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11994 3-(benzyloxy) O=C1CCC2C3C 220 2029577 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11995 10,13-dimethyO=C(OC1CCC2( 153 2029574 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11996 7,17-dioxoandO=C1CC2CC(OC 164 2029571 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11997 7,17-dioxoandO=C1CC2CC(OC 165 2029571 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11998 10,13-dimethyOC1CCC2(C)C 151 2029570 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    11999 pregn-17-en-3O=C(OC1CCC2( 119 2029566 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12000 3,3'-(3a,6-di O=C(O)CCC1C 232 2029554 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12001 androstane-3,O=C(OC1CCC2C 194 2029552 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12002 17-[2-(bromom
    BrCC1(OCCO1 171 2029549 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12003 3-(acetyloxy) O=C1CC2CC(OC 175 2029548 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12004 3-(chloroethy ClC#CC1(O)CC 120 2029547 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12005 3-ethynylpregOC1(C#C)CCC2 147 2029545 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12006 17-(benzyloxyO=C1C=C2CC(O 203 2029543 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12007 3-ethynylandrOC1CCC2C3CC 186 2029542 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12008 3-ethynylandrOC1CCC2C3CC 192 2029542 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12009 3-ethynyl-17- OC1(C#C)CCC2 190 2029541 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12010 1-(17-hydroxyO=C(C)C1CCC2 145 2029537 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12011 10,13-dimethyO=C(OC1CCC2( 114 2029535 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12012 5,10,13-trimeO=C1CCC2C3C 158 2029531 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12013 5,10,13-trimeO=C1CCC2C3C 159 2029531 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12014 hexamethyl 5,5
    O=C(OC)c1cc( 188 2029526 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12015 [benzene-1,3,OCc1cc(OCc2c 144 2029525 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12016 2,6-dibromo-4Brc1c(O)c(CN( 208 2029524 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12017 4-[4-(prop-2- Oc1ccc(cc1)C 60 2029521 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12018 2,2'-methanedOc1cccc(O)c1 255 2029519 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12019 2,2',2''-[benzeClc1[nH0]c(Cl 240 2029512 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12020 diethyl 3,3-b O=C(OCC)CC(CC 178 2029509 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12021 [1,4]benzodioO1c2[nH0]c3c 256 2029502 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12022 8,9,20,21-tet O1CC#CCOCc2 130 2029501 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12023 5,11-dimethoxy
    O=C1N(CCCCCC 238 2029500 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12024 3,6-bis(3-bro BrCCCOc1ccc2 142 2029496 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12025 N-(2-hydroxy-O=CNC(c1cccc 205 2029476 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12026 1,2,4,5-tetra O(CC#C)Cc1cc 66 2029466 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12027 7,8,17,18-tet O=C1OCCOC(=O 192 2029435 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12028 5,8-dimethyl- O=C(OC1CCCc2 52 2029433 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12029 ethyl 2-[2-(4 O=C1OC(CC1)( 59 2029429 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12030 5-methoxy-4,4O=C(O)CC(c1c 111 2029428 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12031 4-(2,5-dimethO=C(O)C(C)(C) 78 2029427 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12032 4-(2,5-dimethO=C(CC(C)(C)C 118 2029426 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12033 (2,2-dimethyl O=CC(C)(C)C(c 153 2029424 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12034 2,2-dimethyl- O.O=C(O)CC(c1 111 2029423 http://dx.doi Karthikeyan M.
    x salt
    12035 2,2-dimethyl- O=C(O)CC(c1cc 171 2029422 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12036 bis[5-methyl- O=C(OC1CC(C) 106 2029391 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12037 methyl 3,5-d O=C(OC)c1cc( 104 2029389 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12038 2-(17-hydroxyO=C(O)C(CCCC 193 2029386 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12039 hexadecahydro
    O=C1OCCOC(= 140 2029363 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12040 2-[(2-hydroxy O=C(O)C1CCC 90 2029361 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12041 3-(2-methoxyph
    S1CN(C[nH0]2 240 2029357 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12042 3-(2-methoxyph
    S1CN(C[nH0]2 207 2029355 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12043 6-(2-nitrophenS1CN(C[nH0]2c 159 2029354 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12044 6-(2-methylphe
    S1CN(C[nH0]2 202 2029353 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12045 6-phenyl-3-pyrS1CN(C[nH0]2 214 2029352 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12046 6-(1-methylethS1CN(C[nH0]2 289 2029351 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12047 6-pyridin-2-yl S1CN(C[nH0]2 279 2029350 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12048 6-(1-methylethS1CN(C[nH0]2 226 2029349 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12049 3-phenyl-6-pyrS1CN(C[nH0]2 224 2029348 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12050 6-(2-methylphe
    S1CN(C[nH0]2 199 2029346 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12051 3,6-diphenyl-6S1CN(C[nH0]2 205 2029345 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12052 3,6-bis(3-nitr S1CN(C[nH0]2c 240 2029343 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12053 6-(2-nitrophenS1CN(C[nH0]2c 183 2029342 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12054 6-(2-methylphe
    S1CN(C[nH0]2c 240 2029340 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12055 6-(2-nitrophenS1CN(C[nH0]2c 184 2029337 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12056 3-phenyl-5-(phS=C1SC(C(=O) 159 2029333 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12057 2-[(E)-(4-oxo- S=C1SC(N=Nc2 199 2029332 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12058 5-chloro-2-[(EClc1ccc(N=NC 211 2029331 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12059 2-[(E)-(4-oxo- S=C1SC(N=Nc2 245 2029330 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12060 6-(4-chloropheClc1ccc(cc1)C 113 2029329 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12061 3-(4-butoxyphe
    Clc1ccc(cc1[N 70 2029327 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12062 6-naphthalen-1
    S1c2[nH0][nH 134 2029325 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12063 5-[(4-chlorop Clc1ccc(cc1)C 217 2029322 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12064 5-({4-[bis(2- ClCCN(CCCl)c 164 2029318 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12065 3-{[bis(2-chlo ClCCN(CN1C(= 106 2029317 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12066 5-[(4-hydroxy S=C1SC(=Cc2cc 215 2029306 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12067 5-[(4-hydroxy S=C1SC(=Cc2cc 195 2029305 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12068 3-(4-butoxyphe
    S1c2[nH0][nH 127 2029300 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12069 4-[3-(4-butoxyS1c2[nH0][nH 144 2029299 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12070 3-(4-ethoxyphe
    S1c2[nH0][nH 90 2029298 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12071 3-(4-ethoxyphe
    S1c2[nH0][nH 194 2029297 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12072 2-[3-(4-ethoxyS1c2[nH0][nH 177 2029295 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12073 4-[3-(4-ethoxyS1c2[nH0][nH0 137 2029294 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12074 6-(4-chloropheClc1ccc(cc1)C 109 2029293 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12075 3-(4-ethoxyphe
    S1c2[nH0][nH0 98 2029292 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12076 4-[3-(4-ethoxyS1c2[nH0][nH 133 2029291 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12077 3-(4-ethoxyphe
    S1c2[nH0][nH 199 2029290 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12078 3-(4-ethoxyphe
    S1c2[nH0][nH 118 2029289 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12079 3-(3-nitrophenS1c2[nH0][nH0 129 2029288 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12080 N,N-dimethyl-4
    S1c2[nH0][nH0 198 2029285 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12081 2-methoxy-4-[3
    S1c2[nH0][nH0 165 2029284 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12082 6-(2-methoxyph
    S1c2[nH0][nH0 152 2029281 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12083 2-[3-(4-nitropS1c2[nH0][nH0 195 2029279 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12084 N,N-dimethyl-4
    S1c2[nH0][nH0 176 2029278 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12085 3,6-bis(4-nitr S1c2[nH0][nH0 229 2029276 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12086 2-methoxy-4-[3
    S1c2[nH0][nH0 226 2029275 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12087 6-(4-methoxyph
    S1c2[nH0][nH0 153 2029274 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12088 3-(4-nitrophenS1c2[nH0][nH0 220 2029273 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12089 2-[3-(3-nitropS1c2[nH0][nH0 210 2029271 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12090 6-(4-chloropheClc1ccc(cc1)C 199 2029270 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12091 6-(4-methoxyph
    S1c2[nH0][nH0 206 2029269 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12092 3-(3-nitrophenS1c2[nH0][nH0 205 2029268 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12093 6-(2-methoxypS1c2[nH0][nH 126 2029266 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12094 6-furan-2-yl-3S1c2[nH0][nH 102 2029265 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12095 2-[3-(phenoxym
    S1c2[nH0][nH 217 2029264 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12096 N,N-dimethyl-4
    S1c2[nH0][nH 144 2029263 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12097 6-(4-nitrophenS1c2[nH0][nH0 184 2029262 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12098 3-(2-methoxyph
    S1CN[nH0]2c1 123 2029261 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12099 3,6-bis(2-methS1c2[nH0][nH 173 2029259 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12100 6-furan-2-yl-3S1c2[nH0][nH 226 2029258 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12101 2-[3-(2-methox
    S1c2[nH0][nH 205 2029257 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12102 4-[3-(2-methox
    S1c2[nH0][nH 229 2029256 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12103 6-(4-chloropheClc1ccc(cc1)C 203 2029255 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12104 3-(2-methoxyph
    S1c2[nH0][nH0 196 2029254 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12105 2-methoxy-4-[3
    S1c2[nH0][nH 137 2029253 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12106 3-(2-methoxypS1c2[nH0][nH 204 2029252 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12107 3-(2-methoxyph
    S1c2[nH0][nH 208 2029251 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12108 6-(2-methoxypS1c2[nH0][nH 166 2029250 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12109 6-furan-2-yl-3S1c2[nH0][nH 161 2029247 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12110 4-[3-(4-methox
    S1c2[nH0][nH0 167 2029245 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12111 6-(4-chloropheClc1ccc(cc1)C 160 2029244 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12112 3-(4-methoxyph
    S1c2[nH0][nH0 210 2029243 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12113 2-methoxy-4-[3
    S1c2[nH0][nH0 173 2029242 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12114 3,6-bis(4-methS1c2[nH0][nH 152 2029241 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12115 6-(2-methoxyph
    S1c2[nH0][nH 221 2029239 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12116 6-(4-nitrophenS1c2[nH0][nH0 246 2029237 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12117 2-methoxy-4-(3
    S1c2[nH0][nH 216 2029236 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12118 6-(4-Methoxyph
    S1c2[nH0][nH 219 2029235 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12119 6-Phenyl-3-(pyS1c2[nH0][nH 220 2029234 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12120 6-(2-methoxyph
    S1c2[nH0][nH 196 2029233 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12121 6-(4-nitrophenS1c2[nH0][nH0 225 2029231 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12122 2-methoxy-4-(3
    S1c2[nH0][nH0 149 2029230 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12123 6-(4-Methoxyph
    S1c2[nH0][nH 160 2029229 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12124 3,6-diphenyl-5S1c2[nH0][nH 83 2029228 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12125 N-(4-methoxyO=C(Nc1ccc(O 127 2029221 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12126 N-(4-bromophBrc1ccc(NC(=O 166 2029220 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12127 2-hydrazino-5[O-][N+](O)c1 207 2029214 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12128 4-phenoxy-2-pO(C1=NC(=Nc2 247 2029207 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12129 methyl 6-formO=Cc1ccc(OC) 83 2029203 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12130 methyl (2R,3ROCC1OC(=CC( 196 2029200 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12131 N,N'-bis[4-(h O=C(NO)CCCN 163 2029196 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12132 N,N'-bis{4-[(2 O=C1N(OC(=O 145 2029195 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12133 4,4'-[(1,6-dio O=C(O)CCCNC 145 2029194 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12134 Methyl N-[2,2-S(C)C(NCC(=O 90 2029191 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12135 2-Cyano-3,3-bS(C)C(SC)=C( 102 2029188 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12136 Ethyl 2-cyano-S(C)C(SC)=C( 54 2029187 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12137 1-(4-hydroxy- Oc1ccc(cc1OC 209 2029185 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12138 9-propadienylNc1[nH0]c[nH 186 2029184 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12139 2-[4-(benzyloxO=C1C(OC(=O) 150 2029181 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12140 5-(2-bromo-1-BrCC(O)C1OC( 96 2029168 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12141 2-bromo-1-(3,BrCC(OC(=O)C 74 2029167 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12142 4-(4-methoxypO=C1N(N(C)c2 217 2029164 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12143 1-methyl-2,4-dO=C1N(N(C)c2 159 2029163 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12144 3-methyl-5-(mS(C)c1cc2N(N 176 2029162 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12145 9-methoxy-3-m
    O=C1N(N(C)c2 162 2029161 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12146 3-methyl-5-(mS(C)c1cc2N(N( 181 2029160 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12147 1-methyl-6-(mS(C)c1cc2N(N( 179 2029159 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12148 3H-indazol-3- Clc1ccc(cc1)c 167 2029158 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12149 1,1'-biphenyl-N1(CCCC1)c1c 174 2029156 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12150 Ethyl 6-methyS=C1NC(C)=C( 205 2019053 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12151 5-(5-nitro-2-fuSc1sc([nH0][n 174 2018703 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12152 Valodex O(CCN(C)C)c1c 96 2015313 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12153 diethyl 4-(4-f Fc1ccc(cc1)C1 84 2014575 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12154 benzyl 1,6-di O=C1NC(c2ccc 118 2011418 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12155 methyl 6-methS=C1NC(C)=C( 225 2010885 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12156 1,4,6-trimethyO=C1NN(C)c2[ 216 2010717 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12157 2-cyano-3-(di S(C)C(N(CC=C 110 2010620 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12158 1-amino-2-oxo-
    s1cccc1C=1N(N 234 2010499 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12159 1-Methyl-1H-te
    Sc1[nH0][nH0 122 2005963 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12160 4-Methylpyrimi
    Cl.Sc1[nH0]cc 222 2005896 http://dx.doi Karthikeyan M.
    x salt
    12161 N,N'-diphenylS=C(Nc1ccccc1 135 1785395 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12162 N,N'-diphenylS=C(Nc1ccccc1 151 1785395 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12163 1,3-benzothiazs1c2ccccc2[n 235 1760846 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12164 1,3-dimethyl- S1c2ccccc2N2 287 1734560 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12165 3-{[5-(3-nitr O=[N+]([O-])c 154 1721772 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12166 5-(5-Phenyl-f O=C1NC(=O)C( 270 1721203 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12167 biphenyl-4-yl O=C(c1ccc(cc1 108 1711119 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12168 3,3,3-trifluor FC(F)(F)C(C(= 181 1701794 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12169 (4Z)-4-(4-chl Clc1ccc(cc1) 322 1684124 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12170 Pyrazolidine-3Fc1ccc(cc1)C 300 1677421 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12171 (4Z)-4-{4-[(E O=C1OC(=NC1= 271 1645167 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12172 5-{[5-(4-MethO=C1NC(=O)C( 265 1626278 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12173 benzamide, N-O=C(Nc1ccc(c 147 1622395 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12174 3-(4-chlorophClc1ccc(cc1)C 101 1554626 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12175 4-Cyclohexyl O=C1Oc2cccc 194 1543813 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12176 N1-phenyl-3,3FC(F)(F)C(C(= 166 1500066 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12177 N1-phenyl-3,3FC(F)(F)C(C(= 191 1500066 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12178 7-(Diphenyl-p[P+]([O-])(c1 215 1495173 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12179 3,3,3-trifluo FC(F)(F)C(C(=O 175 1484992 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12180 Ethyl 4-{[3,3, FC(F)(F)C(C(= 166 1480287 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12181 3,3,3-trifluor FC(F)(F)C(C(= 107 1480169 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12182 (4Z)-4-[(5-Br Brc1oc(cc1)C 122 1477983 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12183 (4E)-4-{[5-(2- O=[N+]([O-]) 210 1476498 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12184 9-(Diphenyl-p[P+]([O-])(c 157 1475422 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12185 N-(4-bromophe
    Brc1ccc(NC(=O) 186 1475403 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12186 (2E,4E)-2-metO=C(O)C(C)=C 159 1474847 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12187 (3Z)-5-IsobutyO=C1OC(=CC1= 76 1474618 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12188 (3Z)-5-Isobut O=C1OC(=CC1= 89 1473706 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12189 5-{[5-(2-bromBrc1ccccc1c1 255 1468919 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12190 Propanamide,FC(F)(F)C(C(=
    3 109 1468105 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12191 N-(2,5-dichlorClc1ccc(Cl)c(N 211 1467271 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12192 (2,4-Dichloro Clc1ccc(c(Cl) 114 1466860 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12193 N-(1,5-dimethy
    FC(F)(F)C(C(= 238 1466603 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12194 Ethyl (2Z)-2-c O=C(OCC)C(C# 121 1466399 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12195 (4E)-4-{[5-(2 Brc1ccccc1c1 160 1466094 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12196 9-(4-MethoxypO1C=2CCCCC=2 104 1462536 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12197 (4E)-4-{[5-(3- O=[N+]([O-])c 145 1459517 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12198 3,3,3-trifluo FC(F)(F)C(C(=O 196 1454827 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12199 N'-(2,6-Diphe O1C(=CC(=Nc2 148 1451888 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12200 2-(2,4-dichlor Clc1ccc(OCC(= 105 1417665 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12201 (2E)-2-benzyl O=C1C(=Cc2cc 75 1415813 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12202 5-methyl-1,3,4Sc1sc([nH0][n 187 1414905 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12203 3-[(E)-2-(nap c1ccc2cc(ccc2 213 1376561 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12204 N-(2,4-dimethFC(F)(F)C(C(= 193 1374735 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12205 Azepan-1-yl(4O=[N+]([O-])c 106 1366868 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12206 Ethyl (2Z)-2-c O=C(OCC)C(C# 117 1363617 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12207 4-(Propylami O=C1Oc2cccc 111 1363277 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12208 1,3-bis[(E)-2 c1ccc(cc1)C=C 150 1362402 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12209 1,1'-[1,2-Ethe O=[N+]([O-])c 88 1361688 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12210 [(methylsulfa S(C)C(Nc1ccc 80 1355020 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12211 2-Oxazolin-5-oO=C1OC(=NC1= 159 1270745 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12212 Ethyl (2Z)-2-c O=C(OCC)C(C# 124 1270678 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12213 (4E)-4-{[5-(4 Brc1ccc(cc1) 180 1268113 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12214 4-(2,4-Dichlo Clc1ccc(C=C2N 180 1267753 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12215 4-(4-Chloro-b Clc1ccc(cc1) 193 1267607 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12216 Ethyl 2-cyano O=C(OCC)C(C# 172 1267446 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12217 Ethyl 2-cyano O=C(OCC)C(C# 311 1267423 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12218 4-(2-Fluoro-b Fc1ccccc1C=C 149 1266814 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12219 2-Methyl-4-(4O=C1OC(=NC1= 245 1266784 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12220 4-(4-Nitro-be O=[N+]([O-]) 215 1266720 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12221 4-[(E)-2-(2,4- O=[N+]([O-])c 191 1266566 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12222 2-phenyl-4-(t s1cccc1C=C1N 167 1266556 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12223 4-(4-Bromo-beBrc1ccc(cc1) 193 1266410 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12224 (2Z)-2-cyano- S=C(N)C(C#N)= 189 1266212 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12225 8,9-dihydroacN=1CCN=C2C=1 95 1256403 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12226 3-phenyl-1H-iO=C1C=C(c2cc 51 1255376 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12227 (3,4-dimetho O=C(c1ccc(C)c 109 1254607 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12228 2-{[5-(4-Chlo Clc1ccc(cc1)c 206 1252946 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12229 5-{[5-(4-BromBrc1ccc(cc1) 182 1250928 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12230 (5Z)-5-(4-nitr S=C1SC(=Cc2c 160 1238960 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12231 N,N'-(ethyne- O=C(Nc1ccc(C 281 1229382 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12232 6052-15-9 [RNNc1ccc(C#Cc2c 236 1229380 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12233 2,2-dimethyl-1O=C1OC(OC(=O 158 1216404 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12234 5-{[5-(3-Nitr O=[N+]([O-]) 280 1180522 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12235 9-(4-methoxybO1C=2CCCCC=2 124 1154380 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12236 5-Benzylidene-S=C1SC(=Cc2c 114 1153871 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12237 1H-indole, 2-eN1=C2C=CCC= 64 1151448 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12238 (5E)-5-(4-ChloClc1ccc(cc1) 149 1130377 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12239 (5Z)-5-benzyliS=C1SC(=Cc2c 121 1129108 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12240 6-(4-nitrophenS1c2[nH0][nH0 213 1068038 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12241 3-(1,3-dithiol S1CCSC1=C(C( 91 1067585 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12242 7-methyl-5-phS1c2ccccc2N= 231 1050834 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12243 2-benzylideneO=C1c2ccccc2 110 1042430 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12244 1,6-diamino-4-Fc1ccc(cc1)C 304 1041841 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12245 (5Z)-5-(2-hydrS=C1SC(=Cc2 166 1041396 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12246 1,3-dimethyl- [nH0]1(C)c2cc 69 1018779 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12247 5-{[5-(4-BromBrc1ccc(cc1) 255 1016173 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12248 (4-Benzyloxy- S=C(N1CCCCC1 72 970833 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12249 2-(5-Bromo-2-Brc1ccc(OC)c 251 923660 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12250 Diethyl-4-(1,3O=C(OCC)C1=C 135 851527 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12251 3-NitrostilbenO=[N+]([O-])c 102 847317 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12252 1,2,3,4,5,6,7 O=C1C=2CCCC 130 831264 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12253 4-[2-(2,4-diox O=C(O)c1ccc( 215 824766 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12254 5,5-Dimethyl-O=C1CC(C)(C) 109 824706 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12255 (3Z)-5-Isobut O=C1OC(=CC1= 88 802623 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12256 2-[(4-BromophBrc1ccc(NN=C 204 801069 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12257 (2-ChlorophenClc1ccccc1C(= 122 801016 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12258 4-[2-(2,2-DimeO=C1OC(OC(=O 223 800783 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12259 (4Z)-4-{[5-(2 O=C1OC(=NC1= 170 800204 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12260 5-[(4-BromophBrc1ccc(NN=C 260 799951 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12261 (3E)-3-{[5-(4 O=C1OC(=CC1= 78 794161 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12262 N,2-bis(4-metO=C(Nc1ccc(C) 163 777053 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12263 (4Z)-4-{[5-(4 O=C1OC(=NC1= 150 765172 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12264 2(3H)-BenzoxaS=C1Oc2cccc 255 746396 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12265 3-(2-methylphO=C1OC(=Cc2c 86 743736 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12266 1H-pyrazole-4-S(C)C1=NNC(N 143 742557 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12267 (5E)-5-benzyl O=C1NC(=O)C( 222 736975 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12268 3-methoxybicyO=C1c2ccc(OC 102 733227 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12269 2,5-dimethoxyb
    O=C1c2c(c(OC 191 733175 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12270 (4E)-4-benzyl O=C1NN(c2ccc 275 728351 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12271 3-{[5-(2-nitr O=[N+]([O-])c 128 727614 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12272 2-Phenyl-4-(5 O=C1OC(=NC1= 143 725185 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12273 4-methoxy-N-S=C(Nc1ccccc1 157 718123 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12274 1,2,4-triazolo S1c2[nH0][nH 177 717778 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12275 4-(EthylaminoO=CC=1C(=O) 181 717148 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12276 4-(Ethylamin O=C1Oc2ccccc 150 717147 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12277 4-Amino-2-oxO=CC=1C(=O) 268 717146 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12278 4-Amino-chroO=C1Oc2ccccc 233 717142 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12279 4-chloro-6-et Clc1[nH0]c(N) 139 716642 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12280 2-amino-6-ethOc1[nH0]c(N) 303 716641 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12281 (4-Ethoxy-3-mS=C(N1CCOCC1 119 710684 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12282 N-(2-ethylpheO=C(Nc1ccccc 175 708711 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12283 N-(4-methylp O=C(Nc1ccc(C) 174 708710 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12284 1-(2,2-diphen S=C(NCC(c1ccc 171 707634 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12285 N-(4-methoxyS=C(Nc1ccc(OC 133 704751 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12286 5-[(5-Bromo-2Brc1oc(cc1)C 215 704556 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12287 1-(3,5-Di-tert O=C(C)c1c(O)c 180 699344 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12288 4-[5-Chloro-3-Clc1ccc2oc(C= 119 699337 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12289 4-[5-Bromo-3-Brc1ccc2oc(CC 79 699333 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12290 4-[5-Methyl-3O=C(C)CCc1oc2 76 699332 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12291 4-[5-Chloro-3 Clc1ccc2oc(CC 75 699330 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12292 4-[5-Methoxy-O=C(C)CCc1oc 36 699329 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12293 (4-Chlorophe Clc1ccc(cc1)C 109 698628 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12294 (2E,2'E)-3,3'- O=C(O)C=Cc1c 280 694515 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12295 4-(4-(DimethyO=C1OC(=NC1= 205 692255 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12296 N-(2-methylb O=C(NCc1cccc 118 690604 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12297 Ethyl (2E)-2-c O=[N+]([O-])c 238 688274 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12298 5-bromo-N-phBrc1cccc2c1c 217 687823 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12299 4-(DimethylamO=[N+]([O-])C 188 676685 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12300 3,5-dimethyl- O=C1C(C)=C(O 144 662783 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12301 2-(4-chloropheClc1ccc(cc1)c 176 660062 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12302 2-(4-Methoxy-FC(F)(F)C=1[n 167 660061 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12303 2,6-Diphenyl- S=C1C=C(OC(= 170 656967 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12304 benzamide, N-(
    s1cc([nH0]c1N 123 652690 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12305 3-{[5-(2-MethO=C(C)C(=Cc1 146 651528 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12306 Ethyl (2E)-3-[ Clc1ccc(cc1)c 140 651519 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12307 ethyl (2E)-3- Brc1ccccc1c1 124 651516 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12308 4-[3-(5-MethylO=[N+]([O-])c 124 650520 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12309 4-[3-(5-MethyO=C(C)CCc1oc 54 650519 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12310 5-{[5-(2-MethO=C1OC(OC(=O 147 650491 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12311 2,2-Dimethyl-O=C1OC(OC(=O 143 650488 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12312 2,2-Dimethyl-O=C1OC(OC(=O 166 648773 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12313 5-[(5-Bromo-2Brc1oc(cc1)C 116 645708 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12314 4-Isopropylid O=C1NN(c2ccc 166 645706 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12315 1H-pyrazole-4-S(C)C1N=NC( 190 643332 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12316 3-hydroxy-4-mO=C(O)C=Cc1c 234 643318 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12317 2-(1H-Indol-2-Nc1ccccc1C1 153 643109 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12318 RV1U1VR &&tO=C(C=CC(=O) 111 643104 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12319 1H-pyrazole-5OCC=1N=NC(C 79 637713 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12320 (2Z)-2-cyano- S=C(N)C(C#N)= 311 634687 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12321 2-CYANO-3-P O=C(N)C(C#N) 155 633463 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12322 Diethyl 3,4-d s1c2sc(c(C)c 187 630284 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12323 (2Z)-2-cyano- O=C(N)C(C#N) 321 628626 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12324 4-methyl-5-phe
    Sc1[nH0][nH0] 188 628268 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12325 2,2-Dimethyl-s1cccc1C=C1C 182 627613 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12326 5-(1-benzofuraClCN1N=C(OC1 300 625246 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12327 1H-Pyrazolo[3,[nH0]1c2[nH0] 114 623092 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12328 Acetamide, N-Clc1ccc(OCC( 139 620505 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12329 4-(5-Methyl-f O=C1OC(=NC1= 160 619501 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12330 5-Methyl-2-phFC(F)(F)C=1[n 174 617551 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12331 4-benzylideneO=C1OC(=NC1= 167 616495 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12332 4-[3-(5-MethylO=[N+]([O-])c 103 614419 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12333 4-[3-(5-MethylO=[N+]([O-])c 178 614410 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12334 2,3-DiphenylacO=C(O)C(=Cc1 171 610579 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12335 para-methoxycO=C(O)C=Cc1c 174 609479 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12336 Ethyl (1-oxo-4O=C1N(N=C(c2 224 607633 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12337 2,2-Dimethyl-5O=[N+]([O-])c 221 602698 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12338 2,2-Dimethyl-5O=[N+]([O-])c 179 602696 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12339 2,2-Dimethyl-O=C1OC(OC(=O 93 601528 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12340 4-(4-methoxybO=C1OC(=NC1= 152 600848 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12341 5-{[5-(4-Chlo Clc1ccc(cc1) 280 600595 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12342 4H-1,2,4-triazClc1ccc(cc1)c 322 600441 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12343 2-(benzyloxy) O=[N+]([O-])C 120 599678 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12344 Dimethyl 2,3- O=C(OC)c1cc2 49 599601 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12345 methanethione,
    S=C(N1CCCCC1 77 596634 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12346 1H-pyrazole-4N#Cc1c(N)[nH 78 595703 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12347 1,2-Dimethyl-1N#Cc1c2ccccc 105 595642 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12348 2-(3,4-DimethS1c2[nH0]c3c 221 595241 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12349 Ethyl (2E)-3-[ Brc1ccc(cc1) 167 594867 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12350 [bis(benzylsul S(Cc1ccccc1) 82 594766 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12351 (2Z)-3-(4-hyd SC(=Cc1ccc(O 161 594207 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12352 3-(1,3-dithian S1CCCSC1=C(C 91 594080 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12353 benzamide, N-[
    Clc1ccc(cc1)c 120 593816 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12354 3-{[5-thioxo-3Sc1[nH0][nH0 300 593801 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12355 (4Z)-4-(3,4-d O=C1OC(=NC1= 133 592107 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12356 2-[(2-ethylani O=C1N(CNc2cc 104 591447 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12357 1-(3,4-DimethO=C(Cc1ccccc1 73 591147 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12358 3-methyl-5-phO=C1N(c2cccc 283 588037 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12359 6-(3,4-dimethoS1c2[nH0][nH 106 576854 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12360 6-phenyl-3-(3,S1CC(=N[nH0] 197 576124 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12361 Ethyl 6-(1,3- O=C1NC(C)=C( 189 573994 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12362 Propanamide,s1c(SCC)[nH0]
    N 159 573531 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12363 ranitidine S(CCNC(NC)=C[ 69 571454 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12364 b-2-FurylacrylO=C(O)C=Cc1o 133 558553 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12365 2,4,7-trimethyO=C1N(C)C(=O 170 557079 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12366 Chalcone, 4-mO=C(C=Cc1ccc 76 557051 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12367 Ethyl 3-(2-chl Clc1ccccc1C= 88 556604 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12368 Ethyl 3-(4-chl Clc1ccc(cc1) 138 556603 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12369 2,2,7,7-Tetra ClC1(Cl)CC(C) 91 556457 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12370 1-(1H-inden-2O=C(C)C1=Cc2 122 555929 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12371 N,N'-(4,6-Din O=[N+]([O-])c 248 555637 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12372 1-benzoyl-2,3O=C([nH0]1c2c 98 555172 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12373 Ethyl 2-methyO=C1Oc2ccccc 167 554482 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12374 2-methylbicyclO=C1c2cccc(C 121 554383 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12375 7-methyl-2-beO=C1OCc2cccc 86 554238 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12376 Ethyl 2-(ethy O=C1Oc2ccccc 186 554010 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12377 Methyl 2-aminO=C1Oc2ccccc 264 554008 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12378 stilbene c1ccc(cc1)C=C 126 553649 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12379 dimethyl fumaO=C(OC)C=CC 102 553171 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12380 3,5-dihydroxyO=C(OC1CC2C3 141 549937 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12381 1,8-diiodonapIc1cccc2cccc(I 106 549794 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12382 3-(acetyloxy) O=C(OC1CCC2( 164 549267 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12383 2-Bromo-3-phBrC=1C(=O)c2 111 543054 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12384 androstan-17-OC1CCC2C3CC 166 542037 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12385 androstan-16 O=C1CC2C3CC 108 541836 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12386 3,12-dihydroxO=C(O)CCC(C) 172 541527 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12387 7-(benzyloxy) O(C)c1cc2CCN 91 540959 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12388 BenzimidazoleO=[N+]([O-])c 152 540798 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12389 3H-Pyrido[2,1-S1c2ccccc2N2 205 540081 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12390 androstane-3,O=C1CCC2(C)C 232 539234 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12391 methyl 3,12-bO=C(OC1CCC2( 234 538954 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12392 7,12-dioxochoO=C1CC2CCCCC 176 538009 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12393 methyl 3,12-dO=C1CCC2(C)C 130 537920 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12394 1,5-dichloroa Clc1cccc2cc3c 189 537859 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12395 ethyl 2-oxo-4 O=C1NC(c2ccc 172 537717 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12396 2-methyltriphCc1ccc2c3ccc 100 537123 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12397 4,4'-Diethoxy O(CC)c1ccc(cc 174 537080 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12398 methyl 2,4,6-tO=[N+]([O-])c 156 536798 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12399 propanamide,FC(F)(F)C(C(=O
    N 201 535989 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12400 methyl 12-oxoO=C1CC2C(CC 109 535657 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12401 1,4-Bis(bromoBrCC(=O)c1ccc 173 534170 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12402 N,N-Dimethyl-FC(F)(F)C(C(=O 54 533608 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12403 3,3,3-trifluor FC(F)(F)C(C(=O 53 533402 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12404 Ethyl 6-(2-fur O=C1NC(C)=C( 206 533287 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12405 4-(10,13-dimeOCCCC(C)C1C 130 532510 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12406 pregn-20-yn-1OC1(C#C)CCC 155 532378 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12407 2,2'-DimethoxO(C)c1ccccc1 156 531832 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12408 3-methyl-1-phCC1=CC(c2ccc 61 530161 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12409 2-methyl-3-phCC=1Cc2ccccc 58 530153 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12410 3-phenylisoqu[nH0]1cc2cccc 103 529919 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12411 1,3-bis(chlor ClCc1c(C)c(C)c 117 527417 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12412 N-(5-nitronapO=[N+]([O-])c 218 525673 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12413 4,4'-BiphenyldO=C(Oc1ccc(cc 161 525308 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12414 methyl 6-met O=C(OC)c1ccc 130 525085 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12415 Ethyl 2-hydro O=[N+]([O-]) 208 524212 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12416 Ethyl 2-hydro O=C1NC(C)=C( 190 524210 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12417 Ethyl-4-(4-ch Clc1ccc(cc1) 185 524087 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12418 2,2'-DibenzoyO=C(c1ccccc1 205 523652 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12419 2-Bornanone, O=C1C(C2CCC1 107 519562 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12420 1',4'-dihydro C1=CC2c3ccc 43 519466 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12421 2,3-DIMETHY O=Cc1ccc(OC) 53 518142 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12422 4,6-dimethyl- O=C1Oc2cc(C) 105 517690 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12423 2,6-naphthalen
    O=C(Oc1ccc2c 215 517184 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12424 Methyl 3-[3-( O=C(OC)CCc1c 51 516518 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12425 1-Methyl-3-acO=C(C)c1c[nH0 107 516500 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12426 5-acetyl-6-meO=C1NC(C)=C( 238 515186 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12427 Propanamide,s1c2ccccc2[nH
    N 174 514041 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12428 2-[(allylamin S(C)C(NCC=C) 91 510123 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12429 Terephthalic aO=C(OC1CC(C) 75 510029 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12430 2-nitrobenzyl O=[N+]([O-]) 141 509210 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12431 4,7-dimethyl- O=C1OCc2c1c( 88 507540 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12432 N-(3-chlorophe
    Clc1cccc(NC(=O 154 505190 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12433 methyl 5-(2-h O=C(OC)CC(C) 70 504793 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12434 3,3,3-trifluo FC(F)(F)C(C(= 186 503211 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12435 methyl 7-(aceO=C1CCC2(C)C 166 503012 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12436 3-(4-methoxypO=C(O)C(=O)C 194 502838 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12437 3,3,3-trifluor FC(F)(F)C(C(= 224 500379 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12438 4-benzyl-3,5- N=1NC(C)=C(C 119 498427 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12439 4-ethyl-3,5-d N1=NC(C)=C(C 43 498075 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12440 N-(2,2-diphenO=C(NCC(c1ccc 123 496474 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12441 Phenyl-m-tolyOC(c1ccccc1)c 53 496169 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12442 1,4-BenzenediO=C(Oc1ccc(O 115 495175 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12443 propanamide,s1cc[nH0]c1NC
    3 148 493616 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12444 10,13-dimethyO1CCOC11CCC 143 493438 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12445 10,13-dimethyO1CCOC11CCC 117 493341 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12446 10,13-dimethyO=C1CCC2(C)C 207 493325 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12447 2-Norbornanon
    O=C1C(C)C2CC 38 491583 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12448 3a',4',7',7a'- C1=CC2(CC2) 45 490537 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12449 bicyclo[4.2.0] OC1Cc2ccccc2 58 488915 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12450 N-benzyl-3,3, FC(F)(F)C(C(= 194 488648 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12451 3-ethyl-3-hyd O=C1CCC2C3C 115 488482 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12452 3,3,3-trifluor FC(F)(F)C(C(=O 200 488142 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12453 bicyclo[6.1.0] O=C(O)C1(C( 217 480084 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12454 2-Hydroxy-3,5O=C1CC(C)(C) 89 479415 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12455 3-[(Z)-(3-hyd [O-][N+](=Nc1 183 477441 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12456 N'-phenylcycl O=C(NNc1ccc 164 473546 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12457 3-oxocholan-2O=C1CCC2(C)C 140 473110 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12458 1,3-Dioxane-4O=[N+]([O-]) 177 470578 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12459 benzyl 2,3,4- O=C(OC1C(OC( 112 468912 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12460 17-(1,5-dimetOC1CCC2(C)C3 237 467749 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12461 17-(1,5-dimetOC1CCC2(C)C3 238 467749 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12462 Benzoic acid, O=[N+]([O-])c 61 460163 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12463 3-oxoandrostaO=COC1CCC2C 125 459374 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12464 N-Acetyl-2,3- O=C([nH0]1c2 74 457393 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12465 androstan-17 O=C1CCC2C3C 121 456374 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12466 5-Methyl-2-triFC(F)(F)C1=N 215 452231 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12467 3,5-dinitro-N-O=[N+]([O-])c 120 445276 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12468 benzamide, 3,5
    O=[N+]([O-])c 120 445273 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12469 3,7-dihydroxyO=C1CC2C(C3C 221 437559 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12470 (diphenylmeth[P+](c1ccccc1 170 436055 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12471 methyl 3-oxocO=C1CCC2(C)C 117 433363 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12472 ethyl 4-(2-ch Clc1ccccc1C1 217 431823 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12473 2-(Methylami O=C1C=C(NC)C 230 408094 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12474 o-(3-Nitro-p-t O=[N+]([O-])c 205 403929 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12475 3-chlorocholeClC1CCC2(C)C 93 403122 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12476 androstan-3- O=C1CCC2(C)C 102 388674 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12477 androstan-3-oOC1CCC2(C)C( 148 388361 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12478 1,3,4-triphenyO=C1N(c2cccc 134 385870 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12479 4-methyl-5-phO=C(O)CCC(C) 56 379360 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12480 6-Amino-2-naOc1ccc2cc(N) 185 379140 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12481 7-methoxy-1,2Oc1cc2CCNCc 222 369388 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12482 N,N,N',N'-tet [nH0]1[nH0](C 175 358312 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12483 dimethyl 1,1' O=C(OC)c1[nH 125 358301 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12484 5-pyrimidinecaFC(F)(F)c1cc 203 356903 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12485 [2,2'-bipyridinO=C(OCC)c1cc 90 354934 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12486 3-(3-nitrophenS1c2[nH0][nH0 205 354916 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12487 4-chloro-5-meClC=1CC[P+]([ 143 353623 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12488 3,3'-oxybis(2 O=C1OC(OC2OC 222 350639 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12489 11-methyl-5-oO=C1N2c3cccc 293 350348 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12490 (1-methyl-1H-b
    O=[N+]([O-])c 214 348310 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12491 5-(3,4-DimethO=C1OC(OC(=O 164 328710 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12492 5-(4-ChlorobeClc1ccc(cc1) 172 325926 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12493 5-(2-fluorobe Fc1ccccc1C=C 142 325839 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12494 N-(2-methyl-9O=C1c2ccccc2 133 322725 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12495 2-Phenylinde c1ccc(cc1)C1= 167 313775 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12496 methyl 3,7,12O=C1CCC2(C)C 243 312743 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12497 3,4,5,6,7-pen BrCC(=O)C(OC 124 312624 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12498 3-oxoandrost-O=C1C=C2CCC3 140 312395 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12499 3,5-Dinitro-N O=[N+]([O-])c 204 311782 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12500 benzamide, N-O=[N+]([O-])c 149 311775 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12501 3-methoxy-2- O=C1OC(OC)c2 44 309815 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12502 methanethione
    S=C(N1CCCCC 113 308651 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12503 Methanethione
    S=C(N1CCOCC 154 308647 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12504 methyl 2-(benO=C(OC)c1ccc 99 308037 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12505 2,6-Dimethyl-O=C1c2ccc(C)c 240 307752 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12506 3-(benzoylamiO=C(Oc1cccc( 153 307427 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12507 3a,4,9,9a-tet O=C1OC(=O)C 188 307391 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12508 4-hydroxy-1,4O=C(CCC(O)c1 95 305820 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12509 5-amino-3-(meS(C)C1=NNC(N 176 301623 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12510 5-(4-Chloroben
    Clc1ccc(cc1) 243 299819 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12511 2,2-Dimethyl-O=[N+]([O-]) 165 299625 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12512 5-[2-(4-chlor Clc1ccc(NN=C 156 299622 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12513 2,2-Dimethyl-O=C1OC(OC(=O 130 299621 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12514 1,4-Methanopy
    O=C1N2N(C(=O 231 298998 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12515 5-pyrimidinecaO=C1NC(C)=C( 209 294983 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12516 2,2-dimethyl-5O=[N+]([O-]) 153 294970 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12517 5-(4-(DimethyO=C1OC(OC(=O 162 294967 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12518 CarbonothioicS=C(Oc1ccccc 106 294345 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12519 ethyl 3-aminos1c(SCC(=O)O 141 291801 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12520 2-acetyl-1,1-dO=C(N1C(Cc2c 160 289383 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12521 2-amino-4,6-dOc1c(N)cc(cc1 161 287448 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12522 diethyl 3,3'-b O=C(OCC)C#Cc 56 286127 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12523 5-Methoxybenz
    [O-][nH0+]1o 118 284177 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12524 1,1'-benzene-ClCC(=O)c1ccc 153 282375 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12525 (4-amino-1-met
    N#CCc1[nH0][ 137 281430 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12526 2-oxo-N-phenO=C(Nc1ccccc 100 281023 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12527 8a-methyl-6-oO=C1C=C2CCCC 90 280597 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12528 biphenyl-2,2',Nc1ccc(c(N)c1 158 279849 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12529 5-(3,4-dimethO=C1NC(=O)C( 265 277431 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12530 Methyl 3,12-dO=C(OC1CCC2( 116 276909 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12531 methyl 3,7-bi O=C(OC1CCC2( 186 276908 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12532 3-(acetylaminoO=C(OCC1OC(O 140 276682 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12533 methyl 2,3,6- O=C(OCC1OC(O 131 276665 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12534 6-(2,5-dimethO=C(O)CCCCC( 76 275768 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12535 5,6,11,12-tet c1ccc2CCc3cc 109 272185 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12536 1,2-bis(chlor ClCc1c(C)c(C)c 135 269919 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12537 2-[(2-Phenyle O=C1C=C(NCCc 141 269238 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12538 3,5-dimethylbiO=C1Cc2cc(C) 48 267189 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12539 bicyclo[4.2.0] O=C(O)C1Cc2c 74 267186 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12540 5,5-dimethyl- O=C1CC(C)(C) 148 265441 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12541 3-hydroxy-7-mO=C1OC(O)c2c 117 264265 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12542 1-(benzyloxy) ClCc1ccc(OCc2 73 263114 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12543 1-bromo-2,5-dBrc1c(OC)c(C) 72 262542 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12544 1(2H)-NaphthaO=C1CCC(c2cc 75 261995 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12545 ethyl 2-(buty O=C(OCC)NNC 97 261843 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12546 1-benzyl-5-ni O=[N+]([O-]) 96 260937 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12547 ethyl 2-methyls1cc([nH0]c1 57 258907 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12548 2-methyl-3,3-O=C(O)C(C)=C( 163 258422 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12549 Ethanone, 2-( S=C(N1CCOCC1 75 258296 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12550 4-(o-MethoxyS=C(N1CCOCC1 86 258009 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12551 (2-methoxyphe
    S=C(N1CCCCC1 85 257496 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12552 ethyl 3-hydro O=C(OCC)C(C)C 102 257232 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12553 5-hydroxy-4a-O=C1C=C2CCC 57 256674 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12554 3,4-Dimethoxyb
    O(C)c1cc2CC( 82 256321 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12555 6H-pyrido[1,2O=C1N2C=CC= 166 256176 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12556 benzamide, N-s1c2CCCCc2c( 110 256067 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12557 7-methyl-3-oxO=C1CCC2(C)C 142 254984 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12558 2,2'-(3a,6-di O=C1CCC2C3CC 224 254172 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12559 3H-1,5-benzodN=1c2ccccc2N 194 253877 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12560 bicyclo[4.2.0] O=C(OC1Cc2cc 31 253187 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12561 Terephthalic aClc1ccc(OC(=O 197 252785 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12562 N-[3-(6-aminoO=[N+]([O-])c 234 252559 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12563 1-(6-nitro-1, O=[N+]([O-])c 189 251736 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12564 3,3-dimethylhO=C1OC(C)(C 80 250788 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12565 6-methyl-2H-pO=C1OC(C)=C 188 250118 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12566 7,17-dioxoandO=C1C=C2CC(O 182 248225 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12567 O-2-Naphthyl S=C(Oc1ccc2c 90 247074 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12568 [3-(Benzyloxy O=C(O)Cc1ccc 126 246821 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12569 N,N'-bis[(E)- O1COc2cc(cc 178 246799 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12570 1,6,6-trimethyO=C1CC(C)(C) 109 246772 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12571 1-methyl-1,5, O=C1CCCc2[nH 85 246771 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12572 4,6-Dimethyl-NC=1N=NC2N= 280 245836 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12573 1,3-dimethyl- Nc1[nH0]c[nH 238 244856 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12574 2-(2,4-dinitro O=[N+]([O-])c 123 244846 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12575 4-methyl-3a,4O=C1OC(=O)C 70 244239 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12576 octahydrocyclO=C1CCC2C3C 67 243193 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12577 1,2-dimethyl- [nH0]1(C)c2cc 111 243150 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12578 17-oxoandrostO=C1CCC2C3C 138 241542 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12579 dibenzo[a,e][ O=C1Cc2ccccc 208 241016 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12580 androstane-3,OC1CCC2(C)C( 164 240351 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12581 1,4,5,8-tetra OC12CC=CCC2 83 239873 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12582 2-quinolinol, Oc1[nH0]c2ccc 240 237069 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12583 2-furanmethan
    OCC1OC([nH0] 190 235950 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12584 1-PhenylpyrazO=C1NN(c2ccc 191 235668 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12585 2-acetylhydraO=C(N)NN=C( 165 233923 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12586 PentamethylbO=Cc1c(C)c(C) 133 231675 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12587 2,3,4,5-TetramO=C1Cc2c1c(C) 161 231672 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12588 5-methoxy-2-m
    O=C(O)c1cc(O 147 231210 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12589 1,4-dibromo-2Brc1c(C)c(C)c 164 230297 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12590 4-NitrophenylO=[N+]([O-]) 177 227823 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12591 4-benzyl-6-meOc1cc2c[nH0] 207 227518 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12592 3-METHYL-2- N1=C2C=CC=CC 91 226885 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12593 1-(diphenylmeO=[N+]([O-])c 156 226692 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12594 17-(2-methyl-OC1CCC2(C)C( 174 226025 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12595 (2,4-Dinitro-p O=[N+]([O-])c 140 224822 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12596 Fragivil O=C(c1ccc(O) 124 224468 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12597 3-(6-amino-9HN#CCC[nH0]1c 255 223474 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12598 N-[(4-methylpO=C(NCc1c[nH 92 223419 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12599 9-(2,3,5-tri- O=C(OCC1OC([ 175 222310 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12600 6-methoxy-2,3O(C)C=1C=CC= 212 222246 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12601 Benzeneacetam
    O=C(Nc1ccccc1 177 221351 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12602 octahydro-4,8-O=C1OC(=O)C 356 220995 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12603 androstan-3-on
    O=C1CCC2(C)C 146 220821 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12604 2,4-dimethox O=Cc1c(OC)cc 65 220512 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12605 androst-5-en-OC1CCC2(C)C( 136 219954 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12606 3-(Piperidino S=C1Sc2cccc 277 217792 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12607 4-chloro-N'-( Clc1ccc(cc1)C 260 216040 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12608 Medmain [nH]1c2ccc(N( 100 215737 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12609 (2-Oxo-1,2-di O=C1Nc2cccc 211 213846 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12610 3-acetyl-17-h O=C(OC1(CCC2 193 212476 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12611 4-methylpyridO=C(N)c1c[nH0 280 212058 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12612 4-methylpyridi[O-][nH0+]1cc 185 212057 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12613 1-carbamoyl-3O=C(N)[nH0]1 148 211943 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12614 1-(2-naphthyl O=C(C)CC(=O) 78 209367 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12615 5,6,7,8-tetra O=C(O)c1cccc 149 209323 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12616 5,6,7,8-tetra O=C(O)c1cccc 160 209323 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12617 10,13-dimethyO=C1CCC2C3C 104 209162 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12618 5-bromo-1-met
    BrC1CN(C)C( 149 207806 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12619 1-methyldihydO=C1NC(=O)C 171 207805 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12620 2,3,4,5,6-pentO=C(OCC(OC(= 110 207680 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12621 1,3-Bis(3-nitr O=[N+]([O-])c 234 207665 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12622 6-hydroxytetrO=C1c2ccccc2 321 206786 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12623 3-ethynyl-3-h O=C1CCC2C3C 238 205888 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12624 3-hydroxyandrO=C1CC2CC(O) 200 205887 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12625 1-(1,2-dihydr O=C(Cc1ccccc 114 203840 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12626 Methyl (6-metO=C1c2ccc(OC 71 203026 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12627 N-{2-[4-(benz O=C(NCCc1ccc 114 202641 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12628 N,N'-1,2-Phe O=C(Nc1ccccc 302 202040 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12629 4-Nitrophthal O=[N+]([O-]) 115 201213 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12630 2,4,6-trinitro O=[N+]([O-])c 146 201128 http://dx.doi Karthikeyan M.
    x mixture
    12631 N,N-bis[2-hydOc1ccccc1CNC 162 201104 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12632 1,4-diphenylbO=C(Cc1ccccc 86 199981 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12633 4-methylpyridO=C(NN)c1c[n 177 199510 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12634 2-(phenylacetO=C(N)NN=C(O 168 198522 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12635 3-(benzyloxy) O=C(O)c1cc(O 178 198214 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12636 3-(acetyloxy) O=C(Oc1cc(cc 151 198212 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12637 ethyl 3-methyO=C(OCC)C1= 137 198012 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12638 pregn-5-en-20OC1CCC2(C)C( 248 197022 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12639 3-hydroxy-3,3O=C(O)CC(O)(c 210 196643 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12640 5-nitronaphthO=[N+]([O-])c 136 196549 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12641 p-Fluoroazob Fc1ccc(N=Nc2 80 196542 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12642 2,3-di(acetyloS(CC)C(SCC)C 112 196409 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12643 3-phenyl-1,4- O=C1OC2(OC1 87 196096 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12644 5-Amino-1-(2-O=C(N)c1c[nH 239 194311 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12645 4,6-BIS(CHL ClCc1cc(CCl)c 97 191030 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12646 Ethyl 2-hydro O=C1NC(C)=C( 180 191006 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12647 1H-pyrazolo[3OCC[nH0]1[nH 218 190625 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12648 1,3-dimethyl- Nc1[nH0]c[nH0 190 190609 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12649 [Bicyclohexyl]-OC1(CCCCC1) 127 190551 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12650 Naphthalene, Brc1c(C)c(C)c 63 190549 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12651 4-hydrazinyl- NNc1[nH0]c[n 257 190548 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12652 1,3,4,6-tetra O=C(OCc1cccc 150 190477 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12653 N-benzhydryl N(C)(C)C(c1cc 69 190089 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12654 ethyl 3,5-dim O=C(OCC)C=1 119 186783 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12655 diethyl 4-(2-f O=C(OCC)C1=C 164 183298 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12656 dimethyl 4-(2-O=C(OC)C1=C( 186 178657 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12657 3-CYANOCOUO=C1Oc2cccc 177 176504 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12658 6,7-dimethoxy-
    Cl.Oc1c(OC)c 248 173607 http://dx.doi Karthikeyan M.
    x salt
    12659 Efosin N1(CCCCC1)CC 41 171191 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12660 6H-pyrimido[1,
    Clc1cccc(Cl) 264 170591 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12661 5-Formyl-3,4- O=Cc1cccc2C( 140 165975 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12662 4,6-Diamino-2Brc1[nH0]c(N 257 149209 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12663 Acenaphtho(1,[nH0]1cc[nH0 146 144265 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12664 (2,2-dibromoeBrC(Br)=Cc1cc 75 142042 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12665 1,3,3-Trimethy[Cl+3]([O-])( 202 140497 http://dx.doi Karthikeyan M.
    x salt
    12666 2-Phenyl-2H-b[nH0]1[nH0]([ 107 135802 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12667 2-(4-methylphO=C(O)C(C)c1c 41 132972 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12668 2-Propanol, 1-OC(COc1cccc( 57 129009 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12669 Acenaphthene,
    O=C(c1ccccc1 101 128581 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12670 2,5,7,10-tetr Cc1ccc(C)c2Cc 72 128074 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12671 8H-CycloheptaO=C1C(C)=Cc2 182 125602 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12672 1,4-Diphenyl- OC(CCCc1cccc 47 124873 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12673 2,3-di(acetyloO=C(OCC1OC(O 138 124287 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12674 5-Methylbenzo
    [O-][nH0+]1o[ 96 123905 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12675 11,11-Difluor FC1(F)c2ccccc 119 123886 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12676 N-(4-methoxyO=C(Nc1ccc(O 153 122623 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12677 9-(propan-2-yCC(C)=C1C2CC 90 122596 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12678 1,4-Dihydro-mCC(C)=C1C2C= 92 122595 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12679 Bicyclo(4.2.0) O=C1c2ccccc 131 122348 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12680 N-methyl-1,2,[nH0]1(C)c2c 53 122330 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12681 1,5-dimethyl- O=C(OCC)c1[n 87 122195 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12682 Tricyclo[5.2.1 O=C1C=CC2C3 56 122148 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12683 1H-pyrazole, 3N1=NC(C)=C(C 138 122146 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12684 4,4'-Dinitroa O=[N+]([O-])c 212 121644 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12685 BenzocyclobuO=C1Cc2ccccc 14 121599 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12686 ethyl 3,5-dimeO=C(OCC)C=1 126 121141 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12687 tricyclo[6.2.0 c1c2CCc2cc2C 101 120816 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12688 1,1,2-Triphen c1ccc(cc1)CC( 52 120763 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12689 dispiro[5.1.5. O=C1C2(CCCC 166 120525 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12690 2,3-DinitroaniO=[N+]([O-])c 122 120172 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12691 1,2-DibenzoylO=C(CCC(=O)c 144 120096 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12692 4-Fluoro-2-ni Fc1ccc(O)c([N 73 120011 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12693 2,6-Dimethyl-O=C(OC)C1=C( 198 114940 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12694 2-(2-pyridyl)- O=C1c2ccccc2[ 182 110759 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12695 ((5-((Dipheny P(CC1OC(OC1CP 87 109291 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12696 4-(benzoyloxyO=C(O)c1ccc( 89 107115 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12697 methyl 3,7-bi O=C1CC2C(C3C 178 106993 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12698 2-phenylindolN1c2ccccc2CC 49 105237 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12699 1,3-bis(1,2-d BrCC(Br)c1ccc 65 104805 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12700 9-D-(2,3-Dihy OCC(O)C[nH0] 203 102748 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12701 Racecadotril S(CC(Cc1cccc 89 96913 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12702 1,2-di(2,2-dimOC(C1OC(OC1) 114 93735 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12703 Terebinic AcidO=C1OC(C)(C) 176 91750 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12704 Phenyl{[(2,2,2ClC(Cl)(Cl)CO 142 91315 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12705 [1,1'-biphenylO=C(Nc1[nH0]c 122 90781 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12706 4,6-O-benzyl OC1OC2COC(O 174 90445 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12707 1,4:3,6-dianh OC1COC2C(O) 61 90294 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12708 2-methyl-3-phO=C(O)C(C)Cc 37 90227 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12709 3-oxoindane-1O=C1CC(c2ccc 116 90183 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12710 [Bis(Methylth S(C)C(SC)=C( 61 89647 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12711 2,2'-Ethane-1,Nc1ccccc1CCc 33 89131 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12712 METHYLPHTHA
    O=C1OC(=O)c2 116 88955 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12713 2,3,4,9-tetrahO=C(O)C1NCC 296 88749 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12714 4,5-Dihydro-3O1N=C(CC1c1c 75 88708 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12715 3-phenylindanO=C1CC(c2ccc 77 88617 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12716 p-(2,2,4-Trim Oc1ccc(cc1)C1 140 88264 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12717 5-NorborneneOCC1C2C=CC( 85 88201 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12718 N-(2-benzoylpO=C(Nc1ccccc 88 87981 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12719 2,6-dimethyl- S=C1C=C(OC(C 142 87076 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12720 2,3-di(acetyloO=C(OC1C2OC 110 86322 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12721 2-Phenylcycl O=C1CCCCC1c 57 86285 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12722 5,5-di(ethylth S(CC)C(SCC)C 127 86246 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12723 1,1,2-triphenyOC(c1ccccc1)C 163 86221 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12724 3-chloro-2-be ClC1OC(=O)c2 60 86164 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12725 6,6-di(ethylth S(CC)C(SCC)C 128 86116 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12726 2,3-dibromobuBrC(C)C(Br)C( 85 86082 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12727 N,N'-bis[(benzS(SCC(NC(=O) 84 85849 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12728 N-Hydroxygly O=C(NO)CN 156 85544 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12729 9-PhenanthrenO=C(O)c1cc2c 253 85501 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12730 Bibenzyl, alphBrC(c1ccccc1) 239 83963 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12731 phenopyrazonO=C1NN(c2ccc 233 83912 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12732 1,2-CyclopentO=C(O)C1CCC 160 80824 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12733 2,5-dichloroteClc1cc(c(Cl)c 295 75561 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12734 1-nitro-2,2-bi S(C)C(SC)=C[N 126 75448 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12735 o,o'-DibromobBrc1ccccc1c1c 81 74932 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12736 2-Azidobiphen[N-]=[N+]=Nc1 49 74072 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12737 3-(chloromethClCc1c(C)c(C) 168 73945 http://dx.doi Karthikeyan M.
    x clearly out of range JCB
    12738 1,4-bis(dichl ClC(Cl)c1ccc(c 93 73892 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12739 Biphenylene, 2Clc1cc2c(cc1Cl 239 73567 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12740 Ethyl-5-aminoO=C(OCC)C=1 103 73512 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12741 Propane-1,3-dP(CCCP(c1cccc 60 73276 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12742 Methylenedian
    Nc1ccccc1Cc1 55 73134 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12743 2,5-Di(Chloro ClCc1cc(C)c(c 132 72729 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12744 Methyl carbazO=C(OC)NN 72 72718 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12745 piperazine-1, O=C(N1CCN(CC 194 72430 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12746 1,4-DiacetoxyO=C(Oc1ccc(O 124 72070 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12747 DiphenylpropiO=C(O)C(C)(c1 173 71976 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12748 2,6-dimethox O(C)c1ccc2cc( 150 71934 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12749 Tricyclo[6.2. O=C1C=CC(=O 73 71481 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12750 3,5-Dimethyl-NC=1C(=NNC= 192 71265 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12751 2-quinoxaline O=C(N)c1[nH0 195 71192 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12752 1-bromo-2,3, Brc1c(C)c(C)c( 165 71166 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12753 3'-NitrobenzanO=[N+]([O-])c 155 70867 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12754 2-Amino-4,5,6s1c2CCCCc2c( 143 70751 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12755 4-(4-methoxypO=C(O)CCCc1c 59 70652 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12756 Ethyl 2-aminos1c2CCCCc2c( 116 70635 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12757 PiperonylonitrO1COc2cc(C#N 94 70512 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12758 1,4-Dihydro-3O=C1OCc2ccc 83 70470 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12759 Ethyl 5-methyO=C(OCC)C=1 82 70048 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12760 Ethyl 5-methyO=C(OCC)C1= 87 70048 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12761 N-(4-butylpheO=C(Nc1ccc(c 105 69654 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12762 N-(4-nitropheO=[N+]([O-])c 198 69381 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12763 4-Hydroxy-3-nO=[N+]([O-])c 141 69214 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12764 Hexa(bromome
    BrCc1c(CBr)c( 292 69007 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12765 Bis(chlorometClCc1c(C)c(C)c 194 68877 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12766 N-carbobenzox
    O=C(OCc1cccc 111 68506 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12767 2,4-Dimethyl-O=C(OCC)C1N= 137 68052 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12768 4-(benzyloxy O=Cc1ccc(OCc 63 68034 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12769 2,3,4-trihydr O=Cc1ccc(O)c 167 67616 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12770 Methylenebis(P(CP(c1ccccc1 121 67509 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12771 3H-indol-3-one
    O=C1c2ccccc2[ 186 67357 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12772 3,4-dimethoxyO=C(O)c1cc(O 195 67282 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12773 [3-(Benzyloxy OCc1ccc(OC)c 85 67197 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12774 oxazole, 4,5-dO1CC(N=C1C)( 114 67077 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12775 bis(2,4-dimet OC(c1ccccc1O 137 67053 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12776 5-[4-(dimethyO=C1NC(=O)C( 245 67051 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12777 3,3-dimethyl- O=C1OC(C)(C) 70 66915 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12778 TETRAPHENYLC(=C(c1ccccc1 140 66894 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12779 BromodureneBrc1c(C)c(C)c 56 66847 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12780 5-Chlor-2-nitr Clc1ccc([N+]( 119 66825 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12781 1,4-bis(dibro BrC(Br)c1ccc(c 168 66740 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12782 N-BenzylbenzO=C(NCc1cccc 105 66512 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12783 4-thiazolidinoS=C1SCC(=O)N 240 66456 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12784 1H-pyrido[3,4-O=C(O)C1NC( 244 66213 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12785 4-Brom-3-metBrc1ccc(O)cc1 64 65689 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12786 Butyvinal O=C1NC(=O)C( 90 65109 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12787 N-Ethyl-1,2-b s1[nH0]c(NCC 78 65065 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12788 Bamipine N1(C)CCC(N(C 114 65061 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12789 Alibendol O=C(NCCO)c1c 95 64927 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12790 3-[2-(N'-m-ChClc1cccc(N2CC 106 64909 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12791 AmphothalideO=C1N(CCCCCO 113 64830 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12792 Aceclofenac Clc1cccc(Cl) 149 64809 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12793 9-Fluoro-6,7-dFc1cc2C(=O)C 194 64324 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12794 9-Fluoro-6,7-dFc1cc2C(=O)C 269 64324 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12795 3-Ethyl-1-ben O(C)c1cc2cc([ 78 64045 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12796 methyl 4-cya O=C(OC)c1ccc 62 63956 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12797 1-MethylcycloO=C(O)C1(C)C 38 63909 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12798 3-methylpyridOc1[nH0]cccc 138 63658 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12799 4-nitrophenyl O=[N+]([O-])c 139 63575 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12800 2,6-di-tert-bu Sc1cc(c(O)c(c1 76 63551 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12801 ethyl 5-nitro- O=[N+]([O-])c 101 63522 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12802 5,6-Dichlor-2 Clc1cc2c(cc1 186 63515 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12803 Butadiyne, di C(C#Cc1ccccc 148 63360 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12804 2,6-dichloro-4Clc1[nH0]c(Cl 113 63319 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12805 N-(2-nitropheO=[N+]([O-])c 96 62968 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12806 FXFFR DVR FC(F)(F)c1ccc 116 62966 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12807 naphtho[2,3-cO=C1OC(=O)c2 249 62943 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12808 Acefylline O=C1N(C)c2[n 271 62754 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12809 N,N'-ethane-1O=C(NCCNC(=O 244 62723 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12810 N-(Methylcar O=C(NC)NC(= 178 62546 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12811 p-Xylylene di N#CCc1ccc(cc 96 62536 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12812 1,4-DibenzyloO(Cc1ccccc1)c 128 62525 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12813 diphenyl succ O=C(Oc1ccccc 88 62511 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12814 1,3-bis(4-toly O=C(Nc1ccc(C) 266 62506 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12815 2,2'-binaphth c1ccc2cc(ccc2 187 62381 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12816 4-nitrophthaliO=[N+]([O-])c 162 62338 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12817 2,2'-binaphthaOc1c2ccccc2c 300 62275 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12818 3-nitrophthaliO=[N+]([O-])c 212 62265 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12819 2-(p-Chlorophe
    Clc1ccc(cc1)c 238 62098 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12820 Dacemazine [ S1c2ccccc2N( 144 62079 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12821 diethylallylac O=C(N)C(CC)( 75 62078 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12822 Incasan O(C)c1ccc2[n 164 61964 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12823 722 D O=C(OCc1[nH0 119 61962 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12824 2-[2-[(2-EthoxS1CC(NC1CCS 142 61958 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12825 N-(3-methylp O=C(Nc1cccc(C 125 61771 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12826 Opianyl O=C1OCc2ccc( 101 61717 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12827 4-NitrophenylaO=[N+]([O-])c 116 61672 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12828 Pentamethylbe
    ClCc1c(C)c(C)c 82 61399 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12829 benzofuroxan[O-][nH0+]1o 69 61388 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12830 Phenokoll O=C(Nc1ccc(O 101 60263 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12831 Lintrin O=C(Oc1ccc2c 105 60100 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12832 2-(4-methylbeO=C(O)c1ccccc 140 59933 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12833 Dimethyl cyanS(C)C(SC)=NC 54 59668 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12834 .alpha.,.alpha ClCc1c(Cl)c(Cl 174 59566 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12835 2,5-Dibromo-pBrc1cc(C)c(Br 74 59562 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12836 4-ButyrylphenO=C(CCC)c1cc 91 59481 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12837 Isopropyl 6-( O=C(OC(C)C)c 150 59323 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12838 (±)-1-[2,4-D Clc1ccc(c(Cl) 146 59273 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12839 1-(tert-Butyl Clc1ccc(Cl)c( 82 59229 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12840 Erdosteine S1CCC(NC(=O 156 59073 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12841 2-Benzhydryl-OCCN1CCCCC1C 106 59048 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12842 Cyanoacetop O=C(CC#N)c1c 83 58331 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12843 FADROZOLE N#Cc1ccc(cc1 117 53850 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12844 Domosedan [nH0]1c[nH]cc 114 50586 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12845 Ananxyl ClC1=C[nH0]2c 140 49570 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12846 N-{[6-MethoxyS=C(N(C)CC(=O 164 48194 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12847 Ethyl {2-amin Fc1ccc(cc1)C 114 48119 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12848 N-[(4-methylpO=C(NCc1c[nH 112 47109 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12849 2-Methyl-2-phO=C1C=C(OC1( 176 46712 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12850 Doxofylline O=C1N(C)c2[n 144 46175 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12851 N-[(1-Allyl-2 O=C(NCC1N(CC 139 39202 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12852 4-(4-methylphO=C(O)CCC(C)c 42 39146 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12853 N-(4-octanoylO=C(Nc1ccc(c 123 38451 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12854 Arprinocid Clc1cccc(F)c1 245 37936 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12855 6-methoxy-1,2Oc1cc2c(cc1O 183 36641 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12856 Rosimon-Neu O=C1N(N(C)C( 149 36216 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12857 DICA Clc1ccc(C[nH0 207 36170 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12858 bezafibrate Clc1ccc(cc1)C 186 35728 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12859 Zitoxil OC(CN1CCN(CC 83 33868 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12860 3,5-Dichlorob Clc1cc(Cl)cc( 68 32882 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12861 Moricizine S1c2ccccc2N( 156 31872 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12862 FTHALIDE Clc1c2COC(=O) 208 31144 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12863 Baratol O=C(NC1CCN(C 208 31014 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12864 Mindolic Acid Clc1ccc(cc1)C 242 30657 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12865 1-acetyl-3-meO=C([nH0]1cc( 65 29657 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12866 7-Chloro-5-phe
    Clc1ccc2N(CC( 164 29343 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12867 2-Methyl-1-niO=[N+]([O-])c 268 29156 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12868 Epinal Clc1cc(ccc1O 92 28714 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12869 4,4',6,6'-Tetr Brc1cc(Br)c(O) 205 28660 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12870 2-(a-(2,6-Dic Clc1cccc(Cl) 126 28460 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12871 C 3 O=C(O)CCCCCN 121 28425 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12872 2H-1,3-benzoxO=C1Oc2cccc 203 27057 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12873 Ellsyl s1c2ccccc2c( 156 26683 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12874 AN 1 N#CC(NC(C)Cc 85 26613 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12875 2-[(methoxycaO=C(OC)Oc1cc 134 24760 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12876 Tolyprin O=C1N2N(c3cc 228 24310 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12877 N-Acetylgluta O=C(NC(CCC(= 197 23836 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12878 1H-indole, 2,3O=NN1CCc2cc 83 22694 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12879 4-formyl-N,N,[I-].O=Cc1ccc( 144 22594 http://dx.doi Karthikeyan M.
    x salt
    12880 Molindone O=C1c2c([nH] 180 22342 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12881 6-(a,a,a-Trifl FC(F)(F)c1ccc 116 21983 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12882 1,1'-(1,3-Phe O=C(C)c1cccc( 32 21733 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12883 3-NitropyridinO=[N+]([O-]) 232 21369 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12884 N,N-bis(2-pheCl.N(CCc1cccc 260 21366 http://dx.doi Karthikeyan M.
    x salt
    12885 2-Amino-6-nits1c2cc([N+](= 248 21284 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12886 Benzetimide O=C1NC(=O)C( 156 20533 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12887 3,6-dimethylpO=C1OC(=O)c2 195 20315 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12888 Diaveridine O(C)c1ccc(cc 233 20162 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12889 Glycol Benzyl O=C(OCCO)NC 40 19566 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12890 1,3,3-TrimethCC1(C)CC(C)(c 50 18644 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12891 1,4-DisulfanylSCC(O)C(O)CS 43 17939 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12892 2-furohydrazi O=C(NN)c1occ 80 17687 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12893 N-(Cyclohexyl[S+2]([O-])([ 188 17470 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12894 3,5-dibromo- Brc1cc(cc(Br) 182 17097 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12895 6-methyl-16-mO=C1C=C2C(C) 224 17024 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12896 p-OctyloxybenO=C(O)c1ccc( 101 16310 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12897 1,5-Naphthal Nc1cccc2c(N) 158 15851 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12898 5-Phenyl-2-imO1C(N)=NCC1c 136 15767 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12899 (1,4-BenzodioO1CC(Oc2cccc 164 15704 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12900 1-[1-[3-(p-Flu Fc1ccc(cc1)C 170 15521 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12901 Meldrum's AcO=C1OC(OC(=O 98 15418 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12902 methyl 3,4,5- O=C(OC)c1cc( 85 15161 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12903 3,4,5-trimeth O(C)c1cc(C#N 94 15105 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12904 p-ChlorobenzyClc1ccc(cc1) 91 15062 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12905 Calmeran OC(c1ccccc1) 160 14952 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12906 N-cyclohexyl O=C(NC1CCCCC 145 14892 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12907 N-cyclohexyl O=C(NC1CCCCC 162 14892 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12908 PropoxypheneO=C(OC(Cc1ccc 75 14592 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12909 4-[4-(o-MethoFc1ccc(cc1)C 68 14410 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12910 Dilosyn S1c2ccccc2N( 87 14009 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12911 Diethyl 4-phenO=C(OCC)C1=C 157 13774 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12912 3-methylisoqu[nH0]1cc2ccc 63 13668 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12913 tetracene-5,1 O=C1c2ccccc2 291 13534 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12914 Bucetalon O=C(Nc1ccc(O 160 13507 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12915 HexahydrotereO=C(O)C1CCC( 171 13484 http://dx.doi Karthikeyan M.
    x stereochem undefined JCB
    12916 S-[2-(Benzoyl S(c1ccccc1NC( 152 13370 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12917 1,2,3,4-TET N1=C2C=CCC= 118 13075 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12918 Tetramethyl-1O=C1C(C)(C)C 114 13028 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12919 Tetrachloro-pClc1c(Cl)c(C)c 216 12837 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12920 DimethylbenzeO=C(O)C(C)(C) 79 12667 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12921 9,10-dihydro c1ccc2c(c1)CC 34 12515 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12922 3-Acetylindol O=C(C)C=1C= 194 12275 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12923 HomophthalicO=C1OC(=O)c2 143 12274 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12924 2-(DimethylamO=C1N=C(OC1c 133 12082 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12925 5-nitro-2-furoO=[N+]([O-])c 184 12057 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12926 Benzydamine O(CCCN(C)C)c 160 12036 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12927 Dibenzyl Sulfo[S+]([O-])(Cc 133 11618 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12928 2-Amino-4-chlClc1ccc(S)c(N) 98 11505 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12929 2-Hydroxyphen
    O=C(O)Cc1ccc 149 11476 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12930 4-MethylphenO=C(Oc1ccc(C) 70 11468 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12931 9,10-dihydroac1ccc2Cc3ccc 108 11446 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12932 610-72-0 O=C(O)c1cc(C 134 11399 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12933 2-NitrophenylaO=[N+]([O-]) 82 11395 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12934 binaphthyl c1ccc2c(c1)cc 154 11296 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12935 BINOL Oc1ccc2ccccc 216 11269 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12936 androstane-3,OC1CCC2(C)C( 167 10826 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12937 2-Methyl-9-phN1(C)CCC=2c3 91 10817 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12938 Uracil, 6-aminO=C1N(C)C(=O 175 10600 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12939 10-hydroxyestO=C1C=CC2(O) 220 10593 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12940 propallylonal BrC(=C)CC1(C 177 10554 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12941 2-ButynediamO=C(N)C#CC( 238 10506 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12942 4,4'-Dimethyl Cc1ccc(cc1)CC 78 10397 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12943 heptabarbital O=C1NC(=O)C( 174 10081 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12944 DesaminotyroO=C(O)CCc1cc 130 9965 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12945 diphenylacetyC(#Cc1ccccc1) 63 9961 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12946 4,4'-Dimethyl N(=Nc1ccc(C)c 140 9960 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12947 2-(p-ChloroaniClc1ccc(Nc2[n 233 9946 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12948 ThiaxanthoneS1c2ccccc2C( 210 9873 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12949 cholestane CC(C)CCCC(C 80 9787 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12950 2,4,6-trimethyO=C(O)c1c(C)c 152 9779 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12951 Ketogan O=C(CC)C1(CC 156 9697 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12952 hydantoin O=C1NCC(=O) 221 9612 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12953 N,N,N',N'-Tet N(C)(C)c1ccc( 194 9321 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12954 DextromoramO=C(N1CCCC1) 180 9269 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12955 2-Methyl-3-(2Clc1ccccc1N1 126 9192 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12956 5-Methyl-10b-O=C1N(CCN(C) 116 9048 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12957 Cedad O=C(OCCN(CC) 51 8966 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12958 biphenylene c1ccc2c(c1)c1 115 8859 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12959 Triphenylene c1ccc2c(c1)c1 199 8816 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12960 2-phenylethanCl.NCCc1ccccc 217 8722 http://dx.doi Karthikeyan M.
    x salt
    12961 Anileridine (UO=C(OCC)C1(C 83 8600 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12962 1-(4-ChlorophClc1ccc(NC(=O 206 8466 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12963 4-MethylbenzO=C(c1ccccc1) 50 8330 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12964 1-(3-AminopheO=C1N(C=CC=C 183 8320 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12965 isophthalic ac O=C(O)c1cccc 68 8182 http://dx.doi Karthikeyan M.
    x clearly out of range JCB
    12966 Eudesmic acidO=C(O)c1cc(O 172 8054 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12967 diphenylaceticO=C(O)C(c1ccc 146 8030 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12968 5-Allyl-5-phenO=C1NC(=O)C( 156 7975 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12969 R-mephobarbiO=C1NC(=O)C( 176 7972 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12970 2-CyanacetamO=C(N)CC#N 120 7610 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12971 bibenzyl c1ccc(cc1)CCc 55 7364 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12972 Agerite Oc1ccc(OCc2c 120 7356 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12973 1,3-DIPHENYLO=C(Nc1ccccc 232 7314 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12974 CyclohexylimiON=C1CCCCC 89 7236 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12975 100-32-3 S(Sc1ccc([N+] 182 7215 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12976 4-(Dimethyla O=Cc1ccc(N(C 75 7199 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12977 b-Resorcylald O=Cc1ccc(O)c 136 6943 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12978 N-(2-Methylp O=CNc1ccccc 53 6933 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12979 Mekkings B O=C(OCCCC)c1 72 6916 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12980 phenyl benzoaO=C(Oc1ccccc 67 6901 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12981 styrene glycolOCC(O)c1cccc 68 6882 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12982 2-AcetylnaphtO=C(C)c1ccc2 55 6855 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12983 2-Nitro-4-chl Clc1ccc(O)c([ 89 6714 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12984 4-nitrophthal O=[N+]([O-]) 198 6703 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12985 fluorene c1ccc2c(c1)Cc 116 6592 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12986 9,10-Phenant O=C1C(=O)c2c 206 6505 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12987 3,6-DIMETHYLOC(C)(C#CC(O 53 6298 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12988 AcecarbromalBrC(CC)(CC)C 109 6244 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12989 3,3-diethyl-2, O=C1NCCC(=O 102 6222 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12990 Hydroxy(dipheO=C(O)C(O)(c1 230 6220 http://dx.doi Karthikeyan M.
    x value clearly out of range JCB
    12991 phenacyl bro BrCC(=O)c1cc 49 6023 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12992 MEGA O=C(OCC(C)(C 77 5919 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12993 carbaryl O=C(Oc1cccc2 142 5899 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12994 2-BenzoxazolaClc1ccc2oc(N) 184 5878 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12995 Spasmo-Dolvi S(CCN(CC)CC)C 48 5786 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12996 1H-pyrrole-2-aClc1ccc(cc1)C 178 5531 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12997 N-pentanoyl-N-
    O=C(N(Cc1ccc 116 5448 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12998 Urapidil O=C1N(C)C(= 156 5437 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    12999 tyramine Oc1ccc(cc1)C 164 5408 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13000 Tropicamide O=C(N(CC)Cc1 96 5391 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13001 Spiroperone Fc1ccc(cc1)C 190 5075 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13002 2-(HydroxymetOCc1ccccc1OC 199 4961 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13003 propranolol OC(COc1cccc2 162 4777 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13004 Romergan S1c2ccccc2N(C 60 4758 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13005 Konlax OC(CCN1CCCCC 120 4735 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13006 Prazosin O=C(N1CCN(CC 285 4724 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13007 Praziquantel O=C1N2CCc3c 136 4722 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13008 1,4-Bis(3-bro BrCCC(=O)N1C 106 4676 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13009 pindolol OC(COc1cccc2 170 4662 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13010 4-Phenylbuta O=C(O)CCCc1c 48 4611 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13011 perphenazineClc1ccc2Sc3c 94 4586 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13012 PropericiazineS1c2ccccc2N( 82 4585 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13013 Loditac O=C(OC)Nc1[n 230 4461 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13014 Oxazepam Clc1ccc2NC(= 205 4455 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13015 Omeprazole [S+]([O-])(Cc 156 4433 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13016 1-(tert-Butyla OC1Cc2cccc(O 124 4258 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13017 Luvatren Fc1ccc(cc1)C( 118 4100 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13018 Modafinil [S+]([O-])(CC 164 4088 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13019 MetoclopramiClc1cc(c(OC) 147 4024 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13020 metaproterenOc1cc(O)cc(c1 100 3944 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13021 Sowell O=C(OCC(C)(C 104 3924 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13022 Mephenytoin O=C1NC(CC)(c 136 3920 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13023 Mephenytoin O=C1NC(CC)(c 210 3920 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13024 Maprotiline N(C)CCCC12CC 92 3871 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13025 Lorazepam Clc1ccc2NC(=O 166 3821 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13026 1-piperazineacFc1ccc(cc1)C( 159 3789 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13027 Letrozole N#Cc1ccc(cc1) 181 3765 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13028 Ketoprofen O=C(c1ccccc1) 94 3693 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13029 piperazine, 1- Clc1ccc(c(Cl) 146 3691 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13030 Isolait Oc1ccc(cc1)C( 103 3651 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13031 Isoniazid O=C(NN)c1cc[ 171 3635 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13032 Irbesartan O=C1N(Cc2ccc 180 3618 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13033 Iprosten O=C1c2ccc(OC 115 3616 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13034 Validex Oc1ccc(cc1)C 114 3561 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13035 Ibumetin O=C(O)C(C)c1c 75 3544 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13036 Hyoscyamine O=C(OC1CC2N( 114 3534 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13037 9-Amino-1,2,3OC1CCCc2[nH0 245 3528 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13038 11,17,21-Trih O=C1C=C2CCC3 223 3514 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13039 1-{[2-(Diethy S1c2ccccc2C( 101 3508 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13040 10-Bromo-11b-
    Brc1ccc2NC(= 185 3442 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13041 Haloperidol Clc1ccc(cc1)C 148 3438 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13042 spiro[benzofurClc1c2OC3(C( 219 3392 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13043 Gemfibrozil O=C(O)C(C)(C 61 3345 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13044 2-(Phosphonoo
    [P+]([O-])(O) 168 3300 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13045 FlutoprazepamClc1ccc2N(CC 118 3283 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13046 Flurbiprofen Fc1cc(ccc1c1c 110 3277 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13047 Flumequine Fc1cc2CCC(N3 253 3257 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13048 Telfast O=C(O)C(C)(C) 142 3231 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13049 Fentanyl O=C(N(c1cccc 83 3228 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13050 Felodipine Clc1cccc(c1C 145 3216 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13051 Felbamate O=C(OCC(COC( 151 3214 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13052 EthapropazineS1c2ccccc2N( 53 3174 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13053 17a-EthynylesOc1ccc2c(c1) 141 3170 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13054 6-{[4-(dimeth O=C1OC(CC)C( 135 3140 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13055 Ecostatin Clc1ccc(cc1)C 87 3086 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13056 Clotrimazole Clc1ccccc1C([ 147 2710 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13057 Clonidine Clc1cccc(Cl) 130 2701 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13058 ChlophedianolClc1ccccc1C(O 120 2693 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13059 4-Amino-N-(1-Clc1cc(c(OC) 194 2678 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13060 ciprofloxacin Fc1cc2c(N(C= 266 2662 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13061 Cimetidine S(CCNC(=NC#N 141 2654 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13062 chloroquine Clc1ccc2c([n 87 2618 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13063 Celectol O=C(Nc1ccc(O 110 2563 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13064 Carisoprodol O=C(OCC(C)(C 92 2478 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13065 CarbamazepinO=C(N)N1c2cc 190 2457 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13066 BUTALBITAL O=C1NC(=O)C( 138 2387 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13067 17-(cyclopropOc1ccc2CC3N( 209 2382 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13068 bupivacaine O=C(Nc1c(C)c 107 2380 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13069 Bufexamac O=C(NO)Cc1cc 153 2372 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13070 7-Phenyl-7-(2,O=C1C(C)=C(C 128 2355 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13071 dl-BamethaneOc1ccc(cc1)C 124 2204 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13072 atenolol O=C(N)Cc1ccc 146 2162 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13073 Astemizole Fc1ccc(cc1)C 149 2160 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13074 aspirin O=C(Oc1ccccc 142 2157 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13075 Histazine N=1CCNC=1CN( 120 2115 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13076 Inmetal O=C1NC(=O)C( 156 2079 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13077 Theophylline O=C1N(C)c2[n 270 2068 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13078 Albendazole S(CCC)c1ccc2 208 1998 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13079 Azone O=C1NC(N)=Nc 255 1945 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13080 1-Acetyl-3-(2 O=C(NC(=O)C) 100 1922 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13081 AcetaminosaloO=C(Nc1ccc(O 187 1907 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13082 paracetamol O=C(Nc1ccc(O 169 1906 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13083 Acemetacin Clc1ccc(cc1) 150 1904 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13084 acebutolol O=C(Nc1ccc(O 119 1901 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13085 3,4-Dihydro-4-s1c2ccc(cc2[ 197 1554 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13086 DL-Naproxen O=C(O)C(C)c1 152 1262 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13087 Pyrazinamide O=C(N)c1[nH0 189 1017 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13088 4-nitrophenolO=[N+]([O-])c 112 955 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13089 Cholergol O=C1NC(=O)C 345 942 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13090 acetanilide O=C(Nc1ccccc 154 880 http://dx.doi Karthikeyan M.
    x clearly out of range JCB
    13091 Hippuric acid O=C(O)CNC(=O 222 451 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13092 androstane-3,O=C1CCC2(C)C 132 430 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13093 androstane-3,O=C1CCC2(C)C 180 430 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13094 salicylic acid O=C(O)c1cccc 157 331 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13095 cholest-5-en-3OC1CCC2(C)C( 148 298 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13096 Benzoic Acid O=C(O)c1cccc 122 238 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13097 3-HydroxyandO=C1CCC2C3C 174 220 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13098 17-hydroxyanO=C1CCC2(C)C 121 14 http://dx.doi Karthikeyan M.; Glen R.C.; Bender A. General melting point prediction
    13099 methanol CO -98 864 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13100 methyl_cyani CC#N -46 6102 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13101 acetaldehyde CC=O -125 172 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13102 dimethylaminCNC -92 654 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13103 ethanol CCO -114 682 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13104 2-butyne CC#CC -32 9990 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13105 ethyl_cyanideCCC#N -93 7566 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13106 propionitrile CCC#N -93 7566 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13107 cyclobutane C1CCC1 -91 8894 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13108 acrolein C=CC=O -87 7559 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13109 propargyl_alc C#CCO -17 21106466 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13110 allylamine C=CCN -88 13835977 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13111 butane CCCC -138 7555 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13112 allyl_alcohol C=CCO -129 13872989 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13113 acetone CC(C)=O -95 175 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13114 propanal CCC=O -80 512 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13115 2-aminopropaCC(C)N -95 6123 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13116 1-aminopropaCCCN -83 7564 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13117 n-methylformCNC=O -40 28994 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13118 acetamide CC(N)=O 80 173 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13119 1-propanol CCCO -126 1004 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13120 methyl_formaO=COC -100 7577 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13121 2-propanol CC(C)O -88 3644 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13122 acetic_acid CC(=O)O 17 171 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13123 dimethyl_sulfCSC -98 1039 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13124 ethylene_glycOCCO -13 13835235 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13125 malononitrile N#CCC#N 34 13884495 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13126 methacrylonitrC=C(C)C#N -36 29101 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13127 1,4-pentadienC=CCC=C -148 11099 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13128 2-methyl-1,3-C=C(C)C=C -146 6309 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13129 1,cis-3-penta C=CC=C/C -141 558883 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13130 cyclopentene C1C=CCC1 -135 8544 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13131 2-pentyne CC#CCC -109 11807 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13132 1-pentyne CCCC#C -106 11806 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13133 3-methyl-1-buC#CC(C)C -90 62241 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13134 1,trans-3-pen C=CC=CC -87 56020 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13135 propyl_cyanidCCCC#N -112 7717 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13136 isobutyronitri CC(C)C#N -72 6311 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13137 3-methyl-1-b C=CC(C)C -168 10765 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13138 1-pentene CCCC=C -165 7713 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13139 cis-2-penteneCC=C/CC -151 4483638 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13140 trans-1,2-dim C[C@@H]1C[ -150 4932497 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13141 ethylcyclopro CCC1CC1 -149 64095 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13142 cis-1,2-dimet C[C@H]1C[C@ -141 221078 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13143 trans-2-penteCC=CCC -140 4483639 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13144 2-methyl-1-b C=C(C)CC -138 10766 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13145 2-methyl-2-b CC=C(/C)C -134 10113 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13146 1,1-dimethylcCC1(C)CC1 -109 66810 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13147 cyclopentane C1CCCC1 -94 8896 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13148 acrylamide C=CC(N)=O 84 6331 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13149 2-methylbuta CC(C)CC -160 6308 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13150 pentane CCCCC -130 7712 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13151 tetrahydrofur C1CCCO1 -108 7737 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13152 butanal CCCC=O -97 256 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13153 2-butanone CC(=O)CC -86 6321 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13154 2-methylpropCC(C)C=O -65 6313 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13155 2,2-dimethyl CC(C)(C)C -17 9646 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13156 acrylic_acid C=CC(=O)O 13 6333 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13157 2-aminobutanCC(N)CC -105 23255 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13158 1-amino-2-meCC(C)CN -87 6310 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13159 2-amino-2-meCC(C)(C)N -68 6145 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13160 dimethylformCN(C)C=O -61 5993 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13161 diethylamine CCNCC -50 7730 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13162 1-aminobutanCCCCN -49 7716 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13163 diethyl_ether CCOCC -116 3168 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13164 methyl_acetaCC(=O)OC -98 6335 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13165 1-butanol CCCCO -89 258 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13166 ethyl_formateO=COCC -80 7734 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13167 propanoic_aciCCC(=O)O -21 1005 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13168 2-methyl-2-prCC(C)(C)O 26 6146 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13169 dl-1-amino-2-CC(O)CN -2 3 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13170 3-chloro-1-pr C=CCCl -135 13836674 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13171 2-propanethioCC(C)S -131 6124 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13172 1-propanethioCCCS -113 7560 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13173 methyl_ethyl_CCSC -106 11729 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13174 dimethoxymeCOCOC -105 13837190 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13175 2-methoxyethOCCOC -85 7728 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13176 1,2-propanediCC(O)CO -60 13835224 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13177 1,3-propanediOCCCO -27 13839553 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13178 1-chloroprop CCCCl -123 10437 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13179 2-chloroprop CC(C)Cl -117 6121 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13180 acetyl_chloridCC(Cl)=O -112 6127 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13181 benzene c1ccccc1 6 236 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13182 dimethyl_sulfCS(C)=O 18 659 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13183 pyridine c1ccccn1 -42 1020 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13184 succinonitrile N#CCCC#N 56 21106481 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13185 4-methylcycl CC1CC=CC1 -161 14893 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13186 1,5-hexadieneC=CCCC=C -141 11110 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13187 1-hexyne C#CCCCC -132 12209 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13188 3-methylcycl CC1C=CCC1 -127 13625 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13189 1-methylcycl CC1=CCCC1 -127 12222 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13190 4-methyl-2-p CC#CC(C)C -110 124180 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13191 4-methyl-1-p CC(C)CC#C -105 122546 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13192 cyclohexene C1C=CCCC1 -104 7788 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13193 3-hexyne CCC#CCC -103 12979 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13194 2-hexyne CCCC#CC -90 31016 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13195 3,3-dimethyl- C#CC(C)(C)C -78 12924 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13196 2,3-dimethyl- C=C(C)C(=C)C -76 10124 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13197 butyl_cyanideCCCCC#N -96 7770 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13198 2,3-dimethyl- C=C(C)C(C)C -157 10775 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13199 4-methyl-1-p CC(C)CC=C -154 12201 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13200 3-methyl-1-p C=CC(C)CC -153 12429 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13201 ethylcyclobut CCC1CCC1 -143 221079 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13202 methylcyclop CC1CCCC1 -142 7024 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13203 cis-2-hexene CCC/C=CC -141 558930 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13204 4-methyl-tranCC=CC(C)C -141 150420 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13205 1-hexene C=CCCCC -140 11109 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13206 1,1,2-trimeth CC1CC1(C)C -138 121766 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13207 cis-3-hexene CCC=C/CC -138 558881 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13208 3-methyl-tranCC=C(/C)CC -138 557853 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13209 2-methyl-1-p C=C(C)CCC -136 12446 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13210 2-methyl-2-p C/C(C)=CCC -135 11742 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13211 3-methyl-cis- CC=C(C)CC -135 559027 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13212 4-methyl-cis- CC=C/C(C)C -134 4483637 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13213 trans-2-hexenCCCC=CC -133 555073 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13214 2-ethyl-1-but C=C(CC)CC -132 12430 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13215 1-methyl-1-etCC1(CC)CC1 -130 84221 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13216 3,3-dimethyl- C=CC(C)(C)C -115 10737 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13217 isopropylcycl CC(C)C1CC1 -113 121640 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13218 trans-3-hexenCCC=CCC -113 553629 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13219 dichlorometh ClCCl -95 6104 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13220 2,3-dimethyl- C/C(C)=C(/C)C -74 10776 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13221 cyclopentano O=C1CCCC1 -51 8141 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13222 cyclohexane C1CCCCC1 7 7787 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13223 2-methylpent CC(C)CCC -154 7604 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13224 2,3-dimethylbCC(C)C(C)C -129 6340 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13225 2,2-dimethylbCC(C)(C)CC -100 6163 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13226 hexane CCCCCC -95 7767 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13227 vinyl_acetate CC(=O)OC=C -93 7616 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13228 3-methyl-2-b CC(C)C(C)=O -92 10777 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13229 pentanal CCCCC=O -91 7772 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13230 2-pentanone CC(=O)CCC -78 7607 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13231 methyl_acrylaC=CC(=O)OC -75 7022 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13232 3-pentanone CCC(=O)CC -39 7016 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13233 cyclopentanolOC1CCCC1 -19 7026 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13234 2,2-dimethylpCC(C)(C)C=O 6 11910 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13235 2-butyne-1,4-dOCC#CCO 57 7775 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13236 1-aminopentaCCCCCN -55 7769 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13237 n,n-dimethylaCN(C)C(C)=O -20 29107 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13238 butyramide CCCC(N)=O 116 10464 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13239 isobutyramideCC(C)C(N)=O 129 61707 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13240 ethyl_propyl_CCOCCC -127 11835 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13241 methyl_butyl_CCCCOC -115 11833 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13242 methyl_tert-bCC(C)(C)OC -109 14672 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13243 methyl_propi CCC(=O)OC -88 10653 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13244 ethyl_acetateCC(=O)OCC -84 8525 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13245 1-pentanol CCCCCO -78 6040 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13246 2-methylpropaCC(C)C(=O)O -46 6341 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13247 2-methyl-2-buCC(C)(O)CC -8 6165 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13248 butanoic_acidCCCC(=O)O -5 259 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13249 2,2-dimethyl- CC(C)(C)CO 50 6164 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13250 2-nitropropanCC(C)[N+]([O- -93 387 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13251 3-chloropropioClCCC#N -50 10498 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13252 d-alanine C[C@@H](N)C 291 64234 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13253 2-methyl-1-prCC(C)CS -145 10118 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13254 2-butanethiol CC(S)CC -140 10120 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13255 1-butanethiol CCCCS -116 7721 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13256 methyl_propylCCCSC -113 18607 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13257 diethyl_sulfid CCSCC -104 9233 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13258 methyl_isoproCC(C)SC -102 14512 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13259 2-ethoxyethanCCOCCO -90 13836591 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13260 1,2-dimethyloCOCCOC -58 13836589 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13261 2-methyl-2-prCC(C)(C)S 1 6147 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13262 dimethyl_car O=C(OC)OC 3 11526 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13263 1,4-butanedioOCCCCO 16 13835209 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13264 2,3-butanedioCC(O)C(C)O 25 21106093 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13265 2-chlorobutanCC(Cl)CC -131 6315 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13266 1-chloro-2-meCC(C)CCl -131 10114 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13267 1-chlorobutanCCCCCl -123 7714 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13268 toluene Cc1ccccc1 -95 1108 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13269 2-chloro-2-meCC(C)(C)Cl -25 10054 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13270 aniline Nc1ccccc1 -6 5889 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. I; Am
    13271 glutaronitrile N#CCCCC#N -29 21106442 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13272 phenol Oc1ccccc1 41 971 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. I; Am
    13273 3-heptyne CCCC#CCC -131 68268 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13274 1,6-heptadienC=CCCCC=C -129 16074 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13275 3-methylcycl CC1C=CCCC1 -124 11085 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13276 5-methyl-1-h CC(C)CCC#C -124 121154 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13277 1-methylcycl CC=1CCCCC=1 -120 11086 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13278 1,5-dimethylcCC1=CCCC1C -118 77595 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13279 1-ethylcyclop CCC1=CCCC1 -118 121113 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13280 2-methyl-3-h CCC#CC(C)C -117 454272 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13281 4-methylcycl CC1CC=CCC1 -115 11084 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13282 4-methyl-2-h CC#CC(C)CC -108 124055 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13283 5-methyl-2-h CC(C)CC#CC -93 126201 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13284 1,2-dimethylcCC=1CCCC=1C -90 63026 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13285 1-heptyne CCCCCC#C -81 11845 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13286 cis-1,2-dichlo ClC=C/Cl -80 558928 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13287 4,4-dimethyl- CC(C)(C)CC#C -75 452556 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13288 2-cyclohexeneO=C1C=CCCC1 -53 13005 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13289 trans-1,2-dic ClC=CCl -50 553742 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13290 pentyl_cyanidCCCCCC#N -80 11846 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13291 2-methyl-tranCCC=CC(C)C -142 4509420 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13292 4-methyl-1-h CC(CC)CC=C -141 18453 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13293 ethylcyclopenCCC1CCCC1 -138 14686 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13294 trans-3-hepteCCCC=CCC -137 4512648 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13295 4,4-dimethyl- CC(C)(C)CC=C -137 12444 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13296 4,4-dimethyl- CC=C/C(C)(C)C -135 4483635 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13297 trans-1,3-dim C[C@H]1CC[C -134 19954396 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13298 cis-1,3-dimet C[C@@H]1CC[ -134 16396 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13299 2,3-dimethyl- C=C(C)C(C)CC -134 17800 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13300 3,3-dimethyl- C=CC(C)(C)CC -134 17801 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13301 2-methyl-2-h C/C(C)=CCCC -130 16689 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13302 2-methyl-2-h C/C(C)=CCCC -130 16689 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13303 3-methyl-tranCC=C(/C)CCC -129 4509522 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13304 2,4-dimethyl- CC(C)=C/C(C)C -128 11757 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13305 methylcycloh CC1CCCCC1 -127 7674 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13306 3-ethyl-1-pen C=CC(CC)CC -127 18792 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13307 4-methyl-tranCC=CC(C)CC -126 4512638 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13308 2,4-dimethyl- C=C(C)CC(C)C -124 15794 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13309 5-methyl-tranCC(C)CC=CC -124 4512641 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13310 3,4-dimethyl- CC=C(/C)C(C)C -124 553631 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13311 3-methyl-cis- CC=C(C)CCC -119 4512637 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13312 1-heptene CCCCCC=C -119 11121 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13313 trans-1,2-dim C[C@H]1CCC -118 556885 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13314 2,3-dimethyl- C/C(C)=C(/C)C -118 23718 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13315 4,4-dimethyl- CC=CC(C)(C)C -115 4483636 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13316 3,4-dimethyl- CC=C(C)C(C)C -114 558882 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13317 2,3,3-trimeth C=C(C)C(C)(C) -110 11179 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13318 trans-2-hepteCC=CCCCC -109 555074 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13319 2-methyl-1-h C=C(C)CCCC -103 21073 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13320 1,1-dichloroe CC(Cl)Cl -97 6125 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13321 1,1-dimethylcCC1(C)CCCC1 -70 14679 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13322 cis-1,2-dimet C[C@@H]1CC -54 13842 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13323 mesityl_oxideCC(C)=C/C(C) -53 8526 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13324 cyclohexanonO=C1CCCCC1 -47 7679 http://www. Aldrich Chemix clearly out of range JCB
    13325 1,2-dichloroe ClCCCl -36 13837650 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13326 cycloheptane C1CCCCCC1 -8 8908 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13327 cyclohexylamiNC1CCCCC1 -17 7677 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13328 methyl_cyanoN#CCC(=O)OC -13 13867413 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13329 3,3-dimethylpCC(C)(CC)CC -134 10755 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13330 2,2-dimethylpCC(C)(C)CCC -124 11055 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13331 3-ethylpentanCCC(CC)CC -119 11551 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13332 2,4-dimethylpCC(C)CC(C)C -119 7619 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13333 2-methylhexaCC(C)CCCC -118 11094 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13334 butyl_vinyl_e C=COCCCC -92 7817 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13335 heptane CCCCCCC -91 8560 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13336 4-methyl-2-p CC(C)CC(C)=O -84 7621 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13337 ethyl_acrylateC=CC(=O)OCC -71 8490 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13338 hexanal CCCCCC=O -56 5949 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13339 2-hexanone CC(=O)CCCC -56 11095 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13340 2,3-pentaned CC(=O)C(=O)C -52 11254 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13341 3,3-dimethyl- CC(C)(C)C(C)= -52 6176 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13342 methyl_methaC=C(C)C(=O)O -48 6406 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13343 2,2,3-trimeth CC(C)C(C)(C)C -25 9649 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13344 2,4-pentaned CC(=O)CC(C)= -23 29001 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13345 cyclohexanol OC1CCCCC1 21 7678 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13346 1-methylcycloCC1(O)CCCC1 37 66464 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13347 triethylamine CCN(CC)CC -115 8158 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13348 dipropylamin CCCNCCC -63 8562 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13349 1-aminohexanCCCCCCN -23 7811 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13350 propyl_ether CCCOCCC -122 7823 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13351 ethyl_butyl_eCCOCCCC -103 11849 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13352 2-methyl-2-peCC(C)(O)CCC -102 11056 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13353 propyl_acetatCC(=O)OCCC -95 7706 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13354 ethyl_tert-butCC(C)(C)OCC -94 11996 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13355 diisopropyl_e CC(C)OC(C)C -86 7626 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13356 acetic_anhydrCC(=O)OC(C)= -73 7630 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13357 ethyl_propionCCC(=O)OCC -73 7463 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13358 1-hexanol CCCCCCO -45 7812 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13359 pentanoic_aciCCCCC(=O)O -34 7701 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13360 3-methylbutanCC(C)CC(=O)O -30 10001 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13361 3-methyl-3-peCC(O)(CC)CC -24 6248 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13362 2,3-dimethyl- CC(C)C(C)(C)O -10 11180 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13363 3,3-dimethyl- CC(C)(C)C(C)O 5 9650 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13364 2,2-dimethylpCC(C)(C)C(=O) 36 6177 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13365 benzonitrile N#Cc1ccccc1 -13 7224 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13366 5-amino-1-pe NCCCCCO 35 68156 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13367 3-thiahexane CCSCCC -117 18902 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13368 2-pentanethioCC(S)CCC -112 56209 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13369 3-pentanethioCCC(S)CC -111 62433 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13370 2-methyl-2-buCC(C)(S)CC -104 14758 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13371 2-thiahexane CCCCSC -98 11834 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13372 1-pentanethioCCCCCS -76 7776 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13373 2,2-dimethyl- CC(C)(C)CS -67 66901 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13374 styrene C=Cc1ccccc1 -31 7220 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13375 1,3,5,7-cyclooC1=CC=CC=CC -27 553448 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13376 2,2-dimethyl- CC(C)(CO)CO 126 13835293 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13377 2-chloropentaCC(Cl)CCC -137 11744 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13378 3-chloropentaCCC(Cl)CC -105 11521 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13379 1-chloropentaCCCCCCl -99 10512 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13380 ethylbenzene CCc1ccccc1 -95 7219 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13381 2-chloro-2-meCC(C)(Cl)CC -74 55090 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13382 m-xylene Cc1cccc(C)c1 -48 7641 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13383 benzaldehydeO=Cc1ccccc1 -26 235 http://www. Aldrich Chemix repeating value clearly out of range cc
    13384 o-xylene Cc1ccccc1C -25 6967 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13385 1-chloro-2,2- CC(C)(C)CCl -20 12416 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13386 p-xylene Cc1ccc(C)cc1 13 7521 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13387 n-methylanili CNc1ccccc1 -57 7234 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13388 m-toluidine Cc1cc(N)ccc1 -30 13860692 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. I; Am
    13389 o-toluidine Cc1ccccc1N -24 13854136 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. I; Am
    13390 benzylamine NCc1ccccc1 10 7223 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13391 p-toluidine Cc1ccc(N)cc1 44 13835151 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. I; Am
    13392 bromoethaneBrCC -119 6092 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13393 bromoethaneBrCC -119 6092 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13394 1,5-cycloocta C1=CCCC=CCC -69 74815 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13395 1,3-cycloocta C1C=CC=CCCC -53 264937 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    13396 anisole COc1ccccc1 -37 7238 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13397 benzyl_alcohoOCc1ccccc1 -15 13860335 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. I; Am
    13398 1,4-dicyanobuN#CCCCCC#N 2 13876621 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13399 m-cresol Cc1cc(O)ccc1 12 21105871 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. I; Am
    13400 o-cresol Cc1ccccc1O 31 13835772 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. I; Am
    13401 p-cresol Cc1ccc(O)cc1 35 13839082 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. I; Am
    13402 m-phenylenedNc1cccc(N)c1 65 13836283 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13403 o-phenylenedNc1ccccc1N 101 13837582 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13404 p-benzoquinoO=C1C=CC(=O 114 4489 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13405 1,4-phenylen Nc1ccc(N)cc1 142 13835179 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13406 cyclohexyl_cyN#CC1CCCCC1 11 63031 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13407 m-aminophenNc1cccc(O)c1 125 11080 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13408 o-aminophenoNc1ccccc1O 176 5596 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13409 p-aminophenoNc1ccc(O)cc1 189 392 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13410 1-ethylcycloh CCC=1CCCCC= -110 66568 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13411 3-octyne CCC#CCCCC -104 76541 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13412 4-octyne CCCC#CCCC -103 15221 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13413 1,2-dimethylcCC=1CCCCC=1 -84 14729 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13414 1-octyne C#CCCCCCC -79 11864 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13415 4,4-dimethylcCC1(C)CC=CCC -74 24634 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13416 cyclooctene C1CC=CCCCC1 -16 553642 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13417 2,5-dimethyl- C/C(C)=CC=C( 13 12451 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13418 catechol Oc1ccccc1O 105 13837760 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13419 resorcinol_(1 Oc1cccc(O)c1 110 4878 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13420 hydroquinoneOc1ccc(O)cc1 175 764 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13421 hexyl_cyanideCCCCCCC#N -63 11866 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13422 1-methyl-1-etCC1(CC)CCCC1 -144 26072 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13423 1,1,3-trimeth CC1CCC(C)(C) -142 19413 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13424 2,2-dimethyl- CCC=C/C(C)(C -137 4512649 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13425 cis-4-octene CCC/C=CCCC -119 4516599 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13426 propylcyclopeCCCC1CCCC1 -117 15438 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13427 2,3-dimethyl- C/C(C)=C(/C)C -115 21998 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13428 2,3,4-trimeth C/C(C)=C(/C)C -113 10796 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13429 isopropylcycl CC(C)C1CCCC1 -111 18604 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13430 ethylcyclohexCCC1CCCCC1 -111 14751 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13431 trans-3-octen CCC=CCCCC -110 553784 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13432 cis-1-methyl- C[C@H]1CCC[ -106 10179220 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13433 2,4,4-trimeth CC(C)=C/C(C)( -106 7581 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13434 1-octene C=CCCCCCC -102 7833 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13435 1,3-dichlorop ClCCCCl -100 8543 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13436 1,2-dichlorop CC(Cl)CCl -100 6316 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13437 cis-2-octene CCCCC/C=CC -100 4512361 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13438 trans-4-octen CCCC=CCCC -94 4512642 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13439 2,4,4-trimeth C=C(C)CC(C)(C -93 7580 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13440 trans-1,3-dim C[C@H]1CCC[ -90 221119 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13441 2-methyl-1-h C=C(C)CCCCC -90 25610 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13442 trans-1,2-dim C[C@H]1CCC -88 221117 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13443 trans-2-octen CCCCCC=CC -88 4516601 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13444 cis-1,4-dimet C[C@@H]1CC[ -87 10179173 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13445 cis-1,3-dimet C[C@@H]1CCC -76 221118 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13446 2,3,3-trimeth C=C(C)C(C)(C) -69 10743 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13447 cis-1,2-dimet C[C@@H]1CC -50 15765 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13448 chlorobenzen Clc1ccccc1 -46 7676 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. I; Am
    13449 trans-1,4-dim C[C@H]1CC[C -37 10265264 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13450 2,2-dichlorop CC(C)(Cl)Cl -34 11170 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13451 1,1-dimethylcCC1(C)CCCCC1 -33 11062 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13452 1,1,2-trimeth CC1CCCC1(C)C -22 32553 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13453 cyclooctane C1CCCCCCC1 15 8909 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13454 ethyl_cyanoacN#CCC(=O)OC -22 13856579 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13455 3,3-dimethyl CC(C)(CC)CCC -126 10759 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13456 3-methylhept CC(CC)CCCC -121 11035 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13457 4-methylhept CC(CCC)CCC -121 11028 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13458 2,2-dimethyl CC(C)(C)CCCC -121 11064 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13459 2-methyl-3-etCC(C)C(CC)CC -115 11370 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13460 2,2,3-trimeth CC(CC)C(C)(C) -112 10781 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13461 2-methylhept CC(C)CCCCC -109 11106 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13462 2,3,4-trimeth CC(C)C(C)C(C) -109 10795 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13463 2,2,4-trimeth CC(C)CC(C)(C) -107 10445 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13464 2,3,3-trimeth CC(C)C(C)(C)C -101 10742 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13465 2,5-dimethyl CC(C)CCC(C)C -91 11104 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13466 3-methyl-3-etCC(CC)(CC)CC -91 13400 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13467 2,4-dimethyl- CC(C)C(=O)C(C -69 10797 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13468 octane CCCCCCCC -57 349 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13469 heptanal CCCCCCC=O -43 7838 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13470 3-heptanone CCC(=O)CCCC -39 7514 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13471 2-heptanone CC(=O)CCCCC -35 7760 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13472 4-heptanone CCCC(=O)CCC -33 28986 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13473 trans-2-methyC[C@H]1CCC -21 557826 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13474 acetonylacetoCC(=O)CCC(C) -6 7744 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13475 cis-2-methylc C[C@@H]1CC 8 4483432 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13476 1-methylcycloCC1(O)CCCCC 26 11063 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13477 2,2,3,3-tetra CC(C)(C)C(C)(C 101 11185 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13478 methyl_hexyl CCCCCCNC -31 34025 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13479 1-aminoheptaCCCCCCCN -18 7835 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13480 sec-butyl_aceCC(=O)OC(C)C -99 7472 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13481 isoamyl_formCC(C)CCOC=O -93 7761 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    13482 ethyl_butyrat CCCC(=O)OCC -93 7475 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13483 methyl_acetoCC(=O)CC(=O) -80 13874867 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13484 butyl_acetateCC(=O)OCCCC -78 29012 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13485 3-heptanol CCC(O)CCCC -70 11036 http://www. Wilhoit R. C. Physical and Thermodynamic Properties of Aliphatic Alco
    13486 4,4-dimethyl- CC(C)(C)CC(C) -60 99440 http://www. Wilhoit R. C. Physical and Thermodynamic Properties of Aliphatic Alco
    13487 4-heptanol CCCC(O)CCC -42 11029 http://www. Wilhoit R. C. Physical and Thermodynamic Properties of Aliphatic Alco
    13488 1-heptanol CCCCCCCO -34 7837 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13489 2,4-dimethyl- CC(C)C(O)C(C) -8 11259 http://www. Wilhoit R. C. Physical and Thermodynamic Properties of Aliphatic Alco
    13490 hexanoic_acidCCCCCC(=O)O -3 8552 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13491 2,2-dimethyl- CC(C)(C)C(O)C 5 18717 http://www. Wilhoit R. C. Physical and Thermodynamic Properties of Aliphatic Alco
    13492 2,3,3-trimethyCC(C)(C)C(C)( 17 11186 http://www. Wilhoit R. C. Physical and Thermodynamic Properties of Aliphatic Alco
    13493 benzyl_cyanidN#CCc1ccccc1 -24 13839308 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13494 m-tolunitrile N#Cc1cccc(C) -23 11607 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13495 o-tolunitrile N#Cc1ccccc1C 13 21106523 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13496 p-tolunitrile N#Cc1ccc(C)c 28 21106167 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13497 6-amino-1-he NCCCCCCO 56 18801 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13498 4-thiaheptaneCCCSCCC -103 7827 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13499 3-thiaheptaneCCSCCCC -95 12011 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13500 2-thiaheptaneCCCCCSC -94 14860 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13501 m-methylstyr Cc1cccc(C=C)c -86 7248 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13502 1-hexanethiolCCCCCCS -80 7815 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13503 o-methylstyreCc1ccccc1C=C -69 11410 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13504 2-methoxyethCC(=O)OCCOC -65 13864773 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13505 trichloromethClC(Cl)Cl -63 5977 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13506 cis-1-phenyl- CC=C/c1ccccc -62 221081 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13507 cyclohexyl_chClC1CCCCC1 -44 10487 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13508 diethyl_carboO=C(OCC)OCC -43 7478 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13509 p-methylstyreCc1ccc(C=C)cc -34 11661 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13510 trans-1-phenyCC=Cc1ccccc1 -29 221082 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13511 2-phenyl-1-p C=C(C)c1ccccc -23 7129 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13512 pinacol CC(C)(O)C(C)( 43 21109330 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13513 2-ethyl-2-metCC(CC)(CO)CO 44 59556 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13514 1,6-hexanedioOCCCCCCO 45 13839416 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13515 2-aminobenzon
    N#Cc1ccccc1N 48 65745 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13516 dimethyl_oxalO=C(OC)C(=O 52 10649 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13517 3-aminobenzon
    N#Cc1cc(N)cc 52 21111842 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13518 4-aminobenzon
    N#Cc1ccc(N)c 84 12822 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13519 succinic_acid O=C(O)CCC(= 188 1078 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13520 p-vinylaniline C=Cc1ccc(N)c 26 66344 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    13521 3-cyanophenoN#Cc1cc(O)cc 82 12821 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13522 2-cyanophenoN#Cc1ccccc1O 94 11413 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13523 4-cyanophenoN#Cc1ccc(O)c 112 12478 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13524 cis-1-bromo-1BrC=C/C -113 558929 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13525 propylbenzenCCCc1ccccc1 -100 7385 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13526 isopropylbenzCC(C)c1ccccc1 -96 7128 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13527 1-methyl-3-etCc1cccc(CC)c1 -96 11603 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13528 1-chlorohexa CCCCCCCl -94 10526 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13529 1-methyl-2-etCc1ccccc1CC -81 11409 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13530 trans-1-brom BrC=CC -77 555072 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13531 1-methyl-4-etCc1ccc(CC)cc1 -62 11660 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13532 allyl_bromideBrCC=C -50 7553 http://www. Aldrich Chemix error from secondary database copying fr
    13533 1,3,5-trimeth Cc1cc(C)cc(C) -45 7659 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13534 1,2,4-trimeth Cc1cc(C)c(C)c -44 6977 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13535 1,2,3-trimeth Cc1cccc(C)c1C -25 10236 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13536 1,2,3-trimeth Cc1cccc(C)c1C -25 10236 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13537 2-chloro-2,3- CC(C)C(C)(C)Cl -10 120155 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13538 phenylacetal O=CCc1ccccc1 -10 13876539 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13539 2-chloro-3,3- CC(C)(C)C(C)Cl -1 455173 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13540 m-vinyl_phenC=Cc1cc(O)cc 1 2282486 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    13541 acetophenoneCC(=O)c1cccc 20 7132 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. I; Am
    13542 o-vinyl_phenoC=Cc1ccccc1O 29 119301 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    13543 p-vinylphenolC=Cc1ccc(O)c 73 56234 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    13544 n-ethylanilineCCNc1ccccc1 -63 7387 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13545 2-ethylanilineCCc1ccccc1N -44 13860641 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13546 3-ethylanilineCCc1cc(N)ccc1 -8 10991 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13547 4-ethylanilineCCc1ccc(N)cc1 -5 21106525 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. I; Am
    13548 2,3-dimethylan
    Cc1cccc(N)c1C 2 13840647 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13549 n,n-dimethylan
    CN(C)c1ccccc1 3 924 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13550 2,5-dimethylan
    Cc1cc(N)c(C)c 12 13869434 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13551 2,6-dimethylan
    Cc1cccc(C)c1N 12 6630 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13552 4-amino-1,3- Cc1ccc(N)c(C) 16 13869462 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. I; Am
    13553 m-aminobenzaO=Cc1cc(N)cc 30 66959 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    13554 2-aminobenzaO=Cc1ccccc1N 38 61553 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13555 3,4-dimethylan
    Cc1cc(N)ccc1C 51 13860491 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13556 benzamide NC(=O)c1cccc 129 2241 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13557 1-bromoprop BrCCC -110 7552 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13558 2-bromoprop BrC(C)C -89 6118 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13559 benzyl_methyCOCc1ccccc1 -52 21170543 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    13560 phenetole CCOc1ccccc1 -30 7391 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13561 2-ethylphenolCCc1ccccc1O -18 13865680 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. I; Am
    13562 3-ethylphenolCCc1cc(O)ccc -4 11604 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. I; Am
    13563 salicylaldehydO=Cc1ccccc1 2 13863618 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13564 2,4-dimethylpCc1ccc(O)c(C) 27 13839123 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. I; Am
    13565 2-methylbenzyCc1ccccc1CO 39 6728 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13566 4-ethylphenolCCc1ccc(O)cc 47 28982 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. I; Am
    13567 2,6-dimethylpCc1cccc(C)c1 49 13839174 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. I; Am
    13568 4-methylbenzyCc1ccc(CO)cc 61 11021 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13569 3,4-dimethylpCc1cc(O)ccc1 63 13839105 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. I; Am
    13570 2,5-dimethylpCc1cc(O)c(C)c 74 13839128 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. I; Am
    13571 2,3-dimethylpCc1cccc(O)c1 75 13839151 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. I; Am
    13572 3,4-diaminotoCc1cc(N)c(N)c 88 9908 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13573 2,4-diaminotoNc1cc(N)c(C)c 97 6991 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13574 2,6-diaminotoNc1cccc(N)c1 97 12650 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13575 3-hydroxybenO=Cc1cc(O)cc 105 21105795 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13576 benzoic_acid O=C(O)c1cccc 123 238 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13577 m-anisidine Nc1cccc(OC)c 0 13869480 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13578 nitrobenzene [O-][N+](=O)c 6 7138 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13579 o-anisidine Nc1ccccc1OC 6 13860775 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13580 p-anisidine Nc1ccc(OC)cc 59 13869414 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13581 p-amino_benzOCc1ccc(N)cc 75 62540 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    13582 o-amino_benzOCc1ccccc1N 83 20149 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13583 m-amino_benzOCc1cc(N)ccc 95 72534 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    13584 3,4-dichloro- C=CC(Cl)CCl -61 12431 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13585 1-nonyne CCCCCCCC#C -50 17880 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13586 cis-1,4-dichlo ClCC=C/CCl -48 4937374 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13587 trans-1,4-dic ClCC=CCCl 2 557415 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13588 2-methoxypheOc1ccccc1OC 28 447 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13589 1-ethynyl-1-c C#CC1(O)CCC 33 6277 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13590 4-methoxypheOc1ccc(OC)cc 56 8665 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13591 3-hydroxybenzOCc1cc(O)ccc 72 100 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13592 2-hydroxybenzOCc1ccccc1O 85 4962 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13593 4-hydroxybenzOCc1ccc(O)cc 112 122 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13594 2-methylresorOc1cccc(O)c1 118 11350 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13595 heptyl_cyanidCCCCCCCC#N -46 29026 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13596 2-aminothiop Nc1ccccc1S 19 21111815 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13597 trans-1-methyC[C@H]1CCC -123 20004138 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13598 cis-1,2-diethy CC[C@@H]1C -118 10179214 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13599 isobutylcyclo CC(C)CC1CCC -115 69826 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13600 butylcyclopenCCCCC1CCCC1 -108 15437 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13601 cis-1-methyl- C[C@H]1CCC[ -104 10179224 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13602 tert-butylcyc CC(C)(C)C1CC -96 454378 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13603 trans-1,2-die CC[C@H]1CC -95 20035478 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13604 propylcycloheCCCC1CCCCC1 -95 14752 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13605 1-nonene CCCCCCCC=C -81 29025 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13606 2,3-dichlorob CC(Cl)C(C)Cl -80 22655 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13607 2-methyl-1-ocC=C(C)CCCCCC -78 70705 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13608 m-chlorotolu Cc1cc(Cl)ccc1 -48 13875230 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13609 benzyl_chlori ClCc1ccccc1 -43 13840690 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13610 1,4-dichlorob ClCCCCCl -37 21106032 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13611 o-chlorotolue Cc1ccccc1Cl -35 13875281 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. I; Am
    13612 p-chlorotolue Cc1ccc(Cl)cc1 7 13875160 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13613 cyclononane C1CCCCCCCC1 11 119920 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13614 cyclooctanon O=C1CCCCCCC 40 9974 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13615 1,2,3-trihydr Oc1cccc(O)c1 134 13835557 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13616 m-chloroanili Nc1cc(Cl)ccc1 -10 13869451 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. I; Am
    13617 o-chloroanilinNc1ccccc1Cl -2 13854248 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. I; Am
    13618 p-chloroanilinNc1ccc(Cl)cc1 70 13869339 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13619 2,3,5-trimeth CC(C)CC(C)C(C -128 13426 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13620 2,4-dimethyl- CC(C)C(CC)C(C -122 13421 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13621 2,2,3,4-tetra CC(C)C(C)C(C) -121 13808 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13622 2,2,4-trimeth CC(CC)CC(C)(C -120 26064 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13623 2,3,3-trimeth CC(C)C(C)(C)C -117 26065 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13624 4-methylocta CC(CCC)CCCC -113 15802 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13625 2,2-dimethylhCC(C)(C)CCCC -113 13443 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13626 2,4,4-trimeth CC(C)CC(C)(C) -113 26066 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13627 3-methylocta CC(CC)CCCCC -108 15801 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13628 2,2,5-trimeth CC(C)CCC(C)(C -106 17976 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13629 2,6-dimethylhCC(C)CCCC(C) -103 13450 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13630 2,3,3,4-tetra CC(C)C(C)(C)C -102 26070 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13631 3,3,4-trimeth CC(CC)C(C)(C) -101 26067 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13632 2,2-dimethyl- CCC(CC)C(C)(C -99 26068 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13633 bromochloro BrCCl -88 6093 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13634 2-methylocta CC(C)CCCCCC -80 17558 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13635 2,2,4,4-tetra CC(C)(C)CC(C) -67 13439 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13636 nonane CCCCCCCCC -54 7849 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13637 3,3-diethylpe CCC(CC)(CC)C -33 13402 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13638 octanal CCCCCCCC=O -27 441 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13639 2-octanone CC(=O)CCCCC -21 7802 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13640 2,2,3,3-tetra CC(C)(C)C(C)( -10 83703 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13641 o-chlorophenoOc1ccccc1Cl 8 13837686 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13642 cyclooctanol OC1CCCCCCC1 15 12241 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13643 m-chlorophenOc1cc(Cl)ccc1 34 13875432 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13644 p-chlorophenoOc1ccc(Cl)cc1 44 13875219 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13645 naphthalene c1cccc2ccccc1 83 906 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13646 1,2-dicyanob N#Cc1ccccc1 140 6775 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13647 1,3-dicyanob N#Cc1cccc(C# 161 11773 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13648 1,4-dicyanob N#Cc1ccc(C#N 226 11672 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13649 dibutylamine CCCCNCCCC -62 7856 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13650 p-cyanostyrenC=Cc1ccc(C#N -15 69416 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    13651 1-aminooctanCCCCCCCCN 0 7851 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13652 4-methyl-3-heCC(CCC)C(O)C -123 25131 http://www. Wilhoit R. C. Physical and Thermodynamic Properties of Aliphatic Alco
    13653 5-methyl-2-heCC(CC)CCC(C) -120 37555 http://www. Wilhoit R. C. Physical and Thermodynamic Properties of Aliphatic Alco
    13654 3-methyl-2-heCC(CCCC)C(C) -114 32916 http://www. Wilhoit R. C. Physical and Thermodynamic Properties of Aliphatic Alco
    13655 2-methyl-1-heCC(CCCCC)CO -112 193321 http://www. Wilhoit R. C. Physical and Thermodynamic Properties of Aliphatic Alco
    13656 6-methyl-1-heCC(C)CCCCCO -106 14702 http://www. Wilhoit R. C. Physical and Thermodynamic Properties of Aliphatic Alco
    13657 6-methyl-2-heCC(C)CCCC(C) -105 87095 http://www. Wilhoit R. C. Physical and Thermodynamic Properties of Aliphatic Alco
    13658 5-methyl-1-heCC(CC)CCCCO -104 122558 http://www. Wilhoit R. C. Physical and Thermodynamic Properties of Aliphatic Alco
    13659 4-methyl-2-heCC(CCC)CC(C) -102 126460 http://www. Wilhoit R. C. Physical and Thermodynamic Properties of Aliphatic Alco
    13660 amyl_acetate CC(=O)OCCCC -100 11843 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13661 ethyl_isovalerCC(C)CC(=O)O -99 7657 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13662 butyl_ether CCCCOCCCC -98 8569 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13663 5-methyl-3-heCC(CC)CC(O)C -91 78280 http://www. Wilhoit R. C. Physical and Thermodynamic Properties of Aliphatic Alco
    13664 3-methyl-1-heCC(CCCC)CCO -90 451849 http://www. Wilhoit R. C. Physical and Thermodynamic Properties of Aliphatic Alco
    13665 2-methyl-3-heCC(C)C(O)CCC -85 78279 http://www. Wilhoit R. C. Physical and Thermodynamic Properties of Aliphatic Alco
    13666 3-methyl-3-heCC(O)(CC)CCC -83 11218 http://www. Wilhoit R. C. Physical and Thermodynamic Properties of Aliphatic Alco
    13667 4-methyl-4-heCC(O)(CCC)CC -82 120166 http://www. Wilhoit R. C. Physical and Thermodynamic Properties of Aliphatic Alco
    13668 2-methyl-4-heCC(C)CC(O)CC -81 80791 http://www. Wilhoit R. C. Physical and Thermodynamic Properties of Aliphatic Alco
    13669 isoamyl_acetaCC(=O)OCCC(C -78 29016 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13670 methyl_caproCCCCCC(=O)O -71 7536 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13671 2-ethyl-1-hex CCC(CCCC)CO -70 7434 http://www. Wilhoit R. C. Physical and Thermodynamic Properties of Aliphatic Alco
    13672 2,2,4-trimeth CC(C)CC(C)(C) -70 28998 http://www. Wilhoit R. C. Physical and Thermodynamic Properties of Aliphatic Alco
    13673 2-methyl-2-heCC(C)(O)CCCC -50 11741 http://www. Wilhoit R. C. Physical and Thermodynamic Properties of Aliphatic Alco
    13674 3-octanol CCC(O)CCCCC -45 11043 http://www. Wilhoit R. C. Physical and Thermodynamic Properties of Aliphatic Alco
    13675 ethyl_acetoacCC(=O)CC(=O -43 13865426 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13676 4-octanol CCCC(O)CCCC -41 11031 http://www. Wilhoit R. C. Physical and Thermodynamic Properties of Aliphatic Alco
    13677 2-octanol CC(O)CCCCCC -32 18920 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13678 1-octanol CCCCCCCCO -15 932 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13679 2,2,4-trimeth CC(C)C(O)C(C) -11 96641 http://www. Wilhoit R. C. Physical and Thermodynamic Properties of Aliphatic Alco
    13680 heptanoic_aciCCCCCCC(=O) -6 7803 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13681 2,2,3-trimeth CC(C)(C)C(C)( -6 22178 http://www. Wilhoit R. C. Physical and Thermodynamic Properties of Aliphatic Alco
    13682 2,3,3-trimeth CC(C)(CC)C(C) -1 124377 http://www. Wilhoit R. C. Physical and Thermodynamic Properties of Aliphatic Alco
    13683 3,4,4-trimeth CC(C)(C)C(C)C 27 16223805 http://www. Wilhoit R. C. Physical and Thermodynamic Properties of Aliphatic Alco
    13684 3-phenylpropio
    N#CCCc1ccccc -2 12061 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13685 p-methylbenzN#CCc1ccc(C) 18 21159744 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13686 3-cyanobenzaO=Cc1cccc(C# 77 21112367 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13687 4-cyanobenzaO=Cc1ccc(C#N 102 59433 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13688 o-cyanobenzaO=Cc1ccccc1 108 91446 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    13689 dimethyl_malO=C(OC)CC(= -62 21106102 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13690 2-ethoxyethylCC(=O)OCCOC -61 13839109 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13691 1-heptanethioCCCCCCCS -43 14680 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13692 1,1,2-trichlor ClCC(Cl)Cl -37 6326 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13693 1,2,3,4-tetrahc1ccc2CCCCc2 -35 8097 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13694 1,1,1-trichlor CC(Cl)(Cl)Cl -30 6042 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13695 2-chlorocyclo O=C1CCCCC1C 23 12648 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13696 4-aminobenzyNc1ccc(CC#N) 44 69446 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13697 4-aminobenzyNc1ccc(CC#N) 45 69446 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13698 2-methyl-2-prCC(CCC)(CO)C 55 59605 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13699 m-hydroxymeth
    OCc1cccc(C#N 28 2016421 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    13700 p-cyano_benzyOCc1ccc(C#N) 42 141080 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    13701 m-hydroxy_phe
    Oc1cc(CC#N)c 53 13400922 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    13702 4-methoxybenz
    COc1ccc(C#N) 59 21112332 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13703 p-hydroxy_pheOc1ccc(CC#N) 69 24729 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    13704 4-hydroxybenzOc1ccc(CC#N) 71 24729 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13705 o-hydroxy_pheOc1ccccc1CC 122 8758202 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    13706 2-bromo-1-buBrC(=C)CC -133 81237 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13707 2-bromo-tran BrC(C)=CC -115 4516544 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13708 2-bromo-cis-2Br/C(C)=CC -111 4481256 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13709 trans-1-brom BrC=CCC -100 4516556 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13710 butylbenzene CCCCc1ccccc1 -88 7419 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13711 1,3-dimethyl- Cc1cc(C)cc(CC -84 13038 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13712 m-diethylben CCc1cccc(CC)c -84 8531 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13713 sec-butylbenzCCC(C)c1ccccc -75 8356 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13714 1-methyl-2-is Cc1ccccc1C(C) -72 10253 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13715 1-chloroheptaCCCCCCCCl -70 11865 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13716 1-methyl-4-is Cc1ccc(cc1)C( -68 7183 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13717 1,2-dimethyl- Cc1ccc(CC)cc1 -67 13040 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13718 2-methoxyethCOCCOCCOC -64 13839575 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13719 1-methyl-4-p CCCc1ccc(C)cc -64 13473 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13720 1-methyl-3-is Cc1cccc(c1)C( -64 10355 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13721 1,3-dimethyl- Cc1cc(C)ccc1C -63 12829 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13722 1-methyl-2-p CCCc1ccccc1C -60 13471 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13723 tert-butylben CC(C)(C)c1ccc -58 7088 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13724 1,4-dimethyl- Cc1ccc(C)cc1C -54 14888 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13725 isobutylbenzeCC(C)Cc1ccccc -51 10410 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13726 1,2-dimethyl- CCc1cccc(C)c1 -50 13032 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13727 p-diethylbenzCCc1ccc(CC)cc -43 7448 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13728 o-diethylbenzCCc1ccccc1CC -31 8335 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13729 1,2,3,5-tetra Cc1cc(C)c(C)c( -24 10245 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13730 1,3-dimethyl- Cc1cccc(C)c1C -16 16887 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13731 m-methylacetCc1cccc(c1)C( -9 21168813 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13732 1,2,3,4-tetra Cc1ccc(C)c(C) -6 9844 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13733 propiophenonO=C(CC)c1ccc 19 6881 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. I; Am
    13734 p-methylacet Cc1ccc(cc1)C( 24 8186 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13735 cinnamyl_alcoOCC=Cc1ccccc 34 21105870 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13736 phthalaldehy O=Cc1ccccc1 56 4642 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13737 1,2,4,5-tetra Cc1cc(C)c(C)c 80 6999 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13738 isophthalalde O=Cc1cccc(C= 89 32002 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13739 terephthalald O=Cc1ccc(C=O 115 11673 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13740 terephthaldic O=Cc1ccc(C=O 116 11673 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13741 o-aminoacetoO=C(C)c1cccc 20 13859235 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    13742 m-toluamide Cc1cccc(c1)C( 96 62466 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13743 m-aminoacet O=C(C)c1cc(N) 97 21106518 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13744 p-aminoacetoO=C(C)c1ccc(N 106 21108576 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13745 acetanilide O=C(C)Nc1ccc 114 880 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13746 o-toluamide Cc1ccccc1C(= 142 10254 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13747 p-toluamide Cc1ccc(cc1)C( 163 62485 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13748 1-bromo-2-meCC(C)CBr -117 6307 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13749 1-bromobuta BrCCCC -112 7711 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13750 2-bromobuta BrC(C)CC -112 6306 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13751 a-pinene CC2(C)C1CC=C -62 6402 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13752 b-pinene CC2(C)C1CCC( -61 14198 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13753 phenyl_propylCCCOc1ccccc1 -28 11655 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    13754 3-phenyl-1-prOCCCc1ccccc1 -18 13871718 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13755 2-bromo-2-meBrC(C)(C)C -16 10053 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13756 methyl_benzoCOC(=O)c1ccc -12 6883 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. I; Am
    13757 1,6-dicyanoh N#CCCCCCCC -3 11879 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13758 p-anisaldehydCOc1ccc(C=O) -1 21105937 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13759 2-hydroxyace O=C(CO)c1ccc 6 61765 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13760 2-isopropylphCC(C)c1ccccc 16 6677 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13761 2-isopropylphCC(C)c1ccccc 16 6677 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13762 4-propylphenoOc1ccc(CCC)c 22 12060 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. I; Am
    13763 3-propylphenoOc1cc(CCC)cc 26 62513 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. I; Am
    13764 2,3-dimethylaCc1c(C)cccc1 29 21159742 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13765 2-phenyl-2-prCC(O)(C)c1ccc 34 11556 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13766 o-anisaldehydCOc1ccccc1C 38 21111781 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13767 p-hydroxymetOCc1ccc(C=O) 47 483654 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    13768 4-isopropylphCC(C)c1ccc(O) 60 7185 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13769 4-isopropylphCC(C)c1ccc(O) 61 7185 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13770 phenylacetic_OC(=O)Cc1ccc 79 10181341 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13771 3-hydroxyace O=C(C)c1cc(O) 89 8174 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13772 o-toluic_acid Cc1ccccc1C(O 105 8070 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13773 4-hydroxyace O=C(C)c1ccc(O 108 7189 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13774 anthranilamidO=C(N)c1cccc 108 10298355 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13775 m-toluic_acid Cc1cccc(c1)C( 110 7140 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13776 o-aminobenzaO=C(N)c1cccc 113 10298355 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13777 m-aminobenzO=C(N)c1cc(N 115 1583 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13778 p-toluic_acid Cc1ccc(cc1)C( 182 7190 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13779 p-aminobenzaO=C(N)c1ccc( 182 68568 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13780 pentaerythritoOCC(CO)(CO) 258 7984 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13781 adamantane C1C3CC2CC(C 268 8883 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13782 o-nitrotoluen Cc1ccccc1[N+] -4 21106144 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13783 p-ethoxyanili CCOc1ccc(N)c 4 21106155 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13784 m-nitrotoluenCc1cc(ccc1)[N 16 21106146 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13785 m-chlorobenzo
    N#Cc1cc(Cl)cc 41 12474 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13786 o-chlorobenzon
    N#Cc1ccccc1C 45 12818 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13787 p-nitrotoluen Cc1ccc(cc1)[N 54 13863774 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13788 p-chlorobenzon
    N#Cc1ccc(Cl)c 92 11663 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13789 o-hydroxybenO=C(N)c1cccc 142 4963 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13790 o-aminobenzoOC(=O)c1cccc 146 222 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13791 p-hydroxybenO=C(N)c1ccc( 161 58563 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13792 m-hydroxybenO=C(N)c1cc(O 170 303495 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    13793 m-aminobenzoOC(=O)c1cc(N 173 7141 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13794 p-aminobenzoOC(=O)c1ccc( 189 953 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13795 1-decyne CCCCCCCCC#C -44 12456 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13796 cis-decahydroC1CC[C@@H] -43 10179239 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13797 trans-decahy C1CC[C@H]2 -32 10265270 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13798 2-phenoxyethOCCOc1ccccc 13 13848467 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13799 o-dimethoxybCOc1ccccc1O 15 13861009 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13800 4-methoxybenCOc1ccc(CO)c 26 21105859 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13801 1,3-benzenedOCc1cccc(CO) 58 62582 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13802 p-dimethoxybCOc1ccc(OC)c 60 21105878 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13803 1,2-benzenedOCc1ccccc1C 64 62368 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13804 o-nitroaniline O=[N+]([O-])c 73 13853943 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13805 2,5-dihydroxyO=Cc1cc(O)cc 98 64111 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13806 m-nitroanilineO=[N+]([O-])c 114 7145 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13807 1,4-benzenedOCc1ccc(CO)c 118 11022 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13808 2,4-dihydroxyO=Cc1ccc(O)c 135 6943 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13809 p-nitroaniline O=[N+]([O-])c 150 13846959 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13810 3,4-dihydroxyOc1ccc(C=O)c 153 8438 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13811 salicylic_acid OC(=O)c1cccc 160 331 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13812 3-hydroxybenzOC(=O)c1cc(O 203 7142 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13813 4-hydroxybenzOC(=O)c1ccc( 217 132 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13814 octyl_cyanideCCCCCCCCC#N -34 15846 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13815 o-nitrophenolO=[N+]([O-])c 45 13837787 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    13816 m-nitrophenoO=[N+]([O-])c 98 10664 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13817 p-nitrophenolO=[N+]([O-])c 115 955 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13818 1-chloro-2-et CCc1ccccc1Cl -83 21111805 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. I; Am
    13819 pentylcyclopeCCCCCC1CCCC -83 18410 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13820 butylcyclohexCCCCC1CCCCC -75 14753 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13821 1,5-dichlorop ClCCCCCCl -73 21106526 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13822 1-decene CCCCCCCCC=C -66 12809 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13823 2-methyl-1-n CCCCCCCC(C) -64 121438 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13824 1-chloro-4-et CCc1ccc(Cl)cc -63 21242799 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. I; Am
    13825 1-chloro-3-et CCc1cc(Cl)ccc -55 23346259 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. I; Am
    13826 benzoyl_chlorClC(=O)c1cccc -1 7134 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13827 4-methyl_benzCc1ccc(CCl)cc 4 21111850 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13828 cyclodecane C1CCCCCCCCC 10 8910 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13829 o-chlorobenz O=Cc1ccccc1C 11 21106014 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13830 m-chlorobenzO=Cc1cc(Cl)cc 18 21111819 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13831 p-chlorobenz O=Cc1ccc(Cl)c 46 21106019 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13832 2-chloro-6-meCc1cccc(Cl)c1 2 6631 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13833 2-chloro-4-meCc1cc(Cl)c(N) 7 11512 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13834 2-chloro-5-meCc1ccc(Cl)c(N 31 60136 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13835 4-methylnonaCCCC(C)CCCC -99 26473 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13836 5-methylnonaCCCCC(C)CCC -88 25609 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13837 3-methylnonaCCC(C)CCCCC -85 20844 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13838 2,4-dimethyl- CC(C)C(C(C)C) -82 452568 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13839 2-methylnonaCC(C)CCCCCC -75 12807 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13840 iodomethane CI -66 6088 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13841 2,7-dimethyloCC(C)CCCCC(C -54 13451 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13842 2,2,3,3-tetra CC(C)(C)C(C)( -54 24271 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13843 5-nonanone CCCCC(=O)CC -50 9976 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13844 2,2,3,4,4-pen CC(C)(C)C(C)C( -39 452969 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13845 2,2,3,3,4-pen CC(C)(C)C(C)(C -36 452968 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13846 decane CCCCCCCCCC -30 14840 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13847 p-chloroanisoCOc1ccc(Cl)cc -18 11667 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13848 nonanal CCCCCCCCC= -18 29029 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13849 1-bromo-2-chBrCCCl -17 13854130 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13850 2,2,5,5-tetra CC(C)(C)CCC(C -13 13448 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13851 2-nonanone CCCCCCCC(C) -8 12632 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13852 2-chloro-5-meCc1ccc(Cl)c(O 47 11513 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13853 4-chloro-2-meCc1cc(Cl)ccc1 47 14165 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13854 4-chloro-3-meOc1ccc(Cl)c(C 67 21106018 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13855 2-chlorobenzyOCc1ccccc1Cl 70 26799 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13856 4-chlorobenzyOCc1ccc(Cl)cc 71 12823 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13857 o-cyano_pheny
    N#CCc1ccccc 80 69784 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    13858 m-cyano_pheny
    N#CCc1cccc(c 87 452948 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    13859 p-cyano_pheny
    N#CCc1ccc(cc 100 120449 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    13860 tripropylaminCCCN(CCC)CC -94 7334 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13861 methyl_octyl CNCCCCCCCC -11 68063 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13862 1-aminonona CCCCCCCCCN -1 15387 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13863 1-aminonaphtNc2cccc1cccc 48 8319 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13864 1-aminonaphtNc2cccc1cccc 49 8319 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13865 5-chloro-2-hy Nc1cc(Cl)ccc1 143 6995 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13866 hexyl_acetateO=C(C)OCCCC -80 8568 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13867 isobutyl_isob CC(C)C(=O)OC -80 7073 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    13868 2-nonanol CCCCCCCC(C) -35 11861 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13869 1-nonanol CCCCCCCCCO -5 8574 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13870 5-nonanol CCCCC(O)CCC 5 11702 http://www. Wilhoit R. C. Physical and Thermodynamic Properties of Aliphatic Alco
    13871 octanoic_acidO=C(O)CCCCC 17 370 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13872 3-nonanol CCCCCCC(O)C 22 11715 http://www. Wilhoit R. C. Physical and Thermodynamic Properties of Aliphatic Alco
    13873 2,2,4,4-tetra CC(C)(C)C(O)C 50 123282 http://www. Wilhoit R. C. Physical and Thermodynamic Properties of Aliphatic Alco
    13874 1-naphthol Oc2cccc1cccc 96 6739 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13875 dimethyl_fumCOC(=O)/C=C/ 104 553171 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13876 4-chlororesorcOc1ccc(Cl)c(O 106 1668 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13877 2-naphthol Oc1ccc2ccccc 123 8341 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13878 o-acetyl_benzo
    O=C(C)c1cccc 48 2044225 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    13879 4-acetylbenzon
    O=C(C)c1ccc( 58 66663 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13880 p-acetyl_benzo
    O=C(C)c1ccc( 59 66663 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    13881 m-acetyl_benzO=C(C)c1cccc 98 72466 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    13882 1,1,3-trichlo ClCCC(Cl)Cl -59 30645 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13883 1-octanethiol CCCCCCCCS -49 7852 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13884 diethyl oxalat CCOC(=O)C(= -41 6998 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13885 ethylene_glycCC(=O)OCCOC -41 21106536 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13886 m-dichlorobe Clc1cccc(Cl)c1 -25 13857694 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. I; Am
    13887 o-dichlorobenClc1ccccc1Cl -17 13837988 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. I; Am
    13888 1,2,3-trichlo ClCC(Cl)CCl -15 7013 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13889 dimethyl_succCOC(=O)CCC( 19 13848341 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13890 p-acetylstyre O=C(C)c1ccc(C 37 9084959 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    13891 trans-4-phenyCC(=O)/C=C/c 41 21106584 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13892 2-phenyl-3-buCC(O)(C#C)c1c 48 83147 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13893 p-dichlorobenClc1ccc(Cl)cc1 53 13866817 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. I; Am
    13894 adipic_acid OC(=O)CCCCC 153 191 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13895 o-cyanobenzaO=C(N)c1cccc 172 65715 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    13896 m-cyanobenz O=C(N)c1cccc 223 69423 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    13897 p-cyanobenzaO=C(N)c1ccc( 224 68899 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    13898 o-methoxy_phe
    COc1ccccc1C 66 73531 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13899 m-vinylbenza O=C(N)c1cccc 133 16161380 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    13900 o-vinylbenzamO=C(N)c1cccc 152 10487671 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    13901 p-vinylbenzamO=C(N)c1ccc( 170 251638 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    13902 4-cyanobenzoiOC(=O)c1ccc( 221 11590 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13903 3-cyanobenzoiOC(=O)c1cccc 223 15088 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13904 triethyl ortho CCOC(OCC)OC -76 28955 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13905 pentylbenzen CCCCCc1ccccc -75 10404 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13906 1-methyl-3,5-CCc1cc(C)cc(C -74 15468 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13907 1,3-dimethyl- CCCc1cc(C)cc( -59 454412 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13908 1-chlorooctanCCCCCCCCCl -58 7850 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13909 1-methyl-4-teCc1ccc(cc1)C( -53 7112 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13910 1-methyl-2-teCc1ccccc1C(C) -50 31083 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13911 1-methyl-3-teCc1cccc(c1)C( -41 31082 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13912 1,3,5-trimeth Cc1cc(C)cc(C) -16 454414 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13913 1,2,4-trimeth Cc1cc(C)c(C)c -14 26801 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13914 butyrophenonO=C(CCC)c1cc 12 9893 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13915 trans-anethol COc1ccc(/C=C 23 553166 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13916 p-acetylbenzaO=C(C)c1ccc( 33 4188938 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    13917 pentamethylbCc1cc(C)c(C)c 54 12259 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13918 m-vinylbenzoiOC(=O)c1cccc 96 3637837 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    13919 o-nitrobenzoniO=[N+]([O-])c 109 11428 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13920 m-nitrobenzonO=[N+]([O-])c 117 11582 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13921 trans-cinnamiO=C(O)/C=C/c 133 392447 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13922 p-vinylbenzoi OC(=O)c1ccc( 142 13476 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13923 p-nitrobenzoniO=[N+]([O-])c 149 11593 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13924 n,n-diethylaniCCN(CC)c1ccc -38 6794 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13925 p-butylanilineNc1ccc(CCCC) -14 21106519 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. I; Am
    13926 m-nitrostyrenO=[N+]([O-])c -5 61789 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13927 o-nitrostyreneO=[N+]([O-])c 13 488206 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    13928 4-tert-butylanCC(C)(C)c1ccc 15 63057 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13929 p-nitrostyreneO=[N+]([O-])c 29 7201 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    13930 p-dimethylamCN(C)c1ccc(C 75 7199 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13931 p-formyl_ben O=C(N)c1ccc( 75 9919494 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    13932 3-bromopent BrC(CC)CC -126 14966 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13933 1-bromo-3-meCC(C)CCBr -112 7603 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13934 2-bromopent BrC(C)CCC -96 7602 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13935 1-bromopent BrCCCCC -88 7766 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13936 benzyl_acetatCC(=O)OCc1cc -51 13850405 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13937 ethyl_benzoatO=C(OCC)c1cc -34 6897 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13938 2-butylphenolOc1ccccc1CCC -20 17487 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. I; Am
    13939 butyl_phenyl_CCCCOc1ccccc -19 13673 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13940 m-tolyl_acetaO=C(C)Oc1cc( 12 21159480 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    13941 4-ethoxybenz CCOc1ccc(cc1 14 21105889 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13942 phenyl_propi O=C(Oc1ccccc 20 11984 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    13943 4-butylphenolOc1ccc(CCCC) 22 14678 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. I; Am
    13944 methyl_4-metCOC(=O)c1ccc 37 7175 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13945 p-methoxyaceCOc1ccc(cc1) 38 13835344 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13946 3-tert-butylp CC(C)(C)c1cc( 41 10966 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. I; Am
    13947 3-phenylpropaO=C(O)CCc1cc 49 10181339 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13948 p-hydroxymetOCc1ccc(cc1) 54 508728 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    13949 o-formyl_benzOC(=O)c1cccc 97 8099 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13950 4-tert-butylp CC(C)(C)c1ccc 100 13846663 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. I; Am
    13951 m-formyl_benOC(=O)c1cccc 175 11580 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    13952 p-formyl_benzOC(=O)c1ccc( 247 11591 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13953 3-nitro-1,2-d Cc1c(C)cccc1[ 9 6483 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13954 2-nitro-1,3-d Cc1cccc(C)c1[ 16 6420 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13955 2-chlorobenzyClc1ccccc1CC 24 21111776 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13956 methyl_anthraNc1ccccc1C(= 24 13858096 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13957 4-chlorobenzyClc1ccc(CC#N) 31 211145 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13958 4-nitro-1,2-d Cc1ccc(cc1C)[ 31 7162 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13959 o-nitrobenzal O=[N+]([O-])c 46 10630 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13960 m-nitrobenza O=[N+]([O-])c 59 7169 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13961 5-nitro-1,3-d Cc1cc(C)cc(c1 74 7148 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13962 p-amino_phenO=C(C)Oc1ccc 74 75604 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    13963 (-)-2-amino-3 NC(Cc1ccccc1 92 69116 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13964 p-nitrobenzal O=[N+]([O-])c 108 526 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13965 m-methoxybeCOc1cc(ccc1) 133 88942 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13966 p-hydroxymetOCc1ccc(cc1) 135 508281 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    13967 3-acetamidopOc1cccc(NC(C 146 11626 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13968 o-hydroxymetOCc1ccccc1C( 150 89598 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    13969 p-methoxybe COc1ccc(cc1) 165 10256859 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13970 4-acetamidopOc1ccc(NC(C) 169 1906 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13971 2-acetamidopOc1ccccc1NC( 207 11477 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13972 1-undecyne C#CCCCCCCCC -25 67793 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    13973 tetrachlorom ClC(Cl)(Cl)Cl -23 5730 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13974 cinnamyl chloClCC=Cc1cccc -19 555070 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13975 methyl_salicyOc1ccccc1C(= -7 13848808 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13976 2,5-dimethoxyCc1cc(ccc1OC 15 81759 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    13977 2,6-dimethoxyCc1c(cccc1OC 40 72054 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13978 resorcinol_m O=C(C)Oc1ccc 55 4879 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    13979 catechol_monO=C(C)Oc1ccc 57 214817 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    13980 hydroquinoneO=C(C)Oc1ccc 62 86676 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    13981 methyl_3-hydOc1cc(ccc1)C 74 79453 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13982 o-anisic_acid COc1ccccc1C( 99 10892 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13983 phenoxyaceticO=C(O)COc1cc 100 18107 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13984 m-anisic_acidCOc1cc(ccc1) 103 10977 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13985 m-hydroxymetOCc1cccc(c1) 115 161377 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    13986 o-hydroxymetOCc1ccccc1C( 126 11426 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    13987 methyl_4-hydOc1ccc(cc1)C 128 7176 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13988 camphor CC2(C)C1CC(= 177 2441 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13989 p-hydroxymetOCc1ccc(cc1) 182 68837 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    13990 p-anisic_acid COc1ccc(cc1) 184 10181338 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13991 3,4-diaminobeNc1ccc(cc1N) 215 62475 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13992 3,5-diaminobeNc1cc(cc(N)c1 235 11565 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13993 nonyl_cyanid CCCCCCCCCC# -15 67360 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    13994 o-nitroanisoleCOc1ccccc1[N+ 10 6781 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13995 3-nitrobenzyl O=[N+]([O-])c 32 62479 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13996 m-nitroanisol COc1cccc(c1)[ 38 21170967 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13997 2-nitrobenzyl O=[N+]([O-])c 72 11429 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13998 4-nitrobenzyl O=[N+]([O-])c 94 62486 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    13999 o-chlorocumeCC(C)c1ccccc1 -74 15532 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. I; Am
    14000 hexylcyclopenCCCCCCC1CCC -73 121891 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14001 pentylcycloheCCCCCC1CCCC -58 19110 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14002 2-methyl-1-d CCCCCCCCC(= -51 452519 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14003 1-undecene C=CCCCCCCCC -49 12635 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14004 p-chlorocumeCC(C)c1ccc(Cl -12 21159680 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. I; Am
    14005 cycloundecanC1CCCCCCCCC -7 119921 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14006 p-chloroacet O=C(C)c1ccc(C 18 13835126 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. I; Am
    14007 cyclodecanonO=C1CCCCCCC 24 66551 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14008 3,5-dimethox COc1cc(O)cc( 47 9954 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14009 4-tert-butylc O=C1CCC(CC1) 49 7114 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14010 2,6-dimethox COc1cccc(OC) 55 6774 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14011 biphenyl c1cc(ccc1)c2c 69 6828 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14012 3,4-dimethox COc1cc(O)ccc 83 15420 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14013 2-amino-4-nitNc1cc(ccc1O)[ 143 2848685 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14014 2-amino-4-nitNc1cc(ccc1O)[ 144 2848685 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14015 2,5-dihydroxyOC(=O)c1cc(O 205 3350 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14016 borneol C[C@]12CC[C 207 5026296 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14017 isoborneol C[C@]12CC[C 214 4882019 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14018 2,4-dihydroxyOC(=O)c1ccc( 225 1446 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14019 m-chlorobenzO=C(N)c1cc(Cl 136 62467 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14020 o-chlorobenz O=C(N)c1cccc 143 62328 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14021 p-chlorobenz O=C(N)c1ccc(C 173 11587 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14022 iodoethane CCI -111 6100 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    14023 3-methyldecaCCCCCCCC(C) -76 83276 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14024 2-methyldecaCCCCCCCCC(C -49 21896 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14025 bromobenzenBrc1ccccc1 -31 7673 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. I; Am
    14026 undecane CCCCCCCCCCC -26 13619 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14027 decanal CCCCCCCCCC= -6 7883 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14028 2-decanone CC(=O)CCCCC 3 12218 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14029 b-chloropheneClCCOc1ccccc 28 21168833 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14030 1,3-phenyleneN#CCc1cccc(c 33 62583 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14031 menthol CC(C)C1CCC(C 45 1216 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14032 1,2-phenyleneN#CCc1ccccc 59 62395 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14033 2-chloro-4,5- Cc1cc(O)c(Cl) 71 63919 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14034 1,4-phenyleneN#CCc1ccc(cc 95 62536 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14035 4-chloro-3,5- Oc1cc(C)c(Cl)c 115 21106017 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14036 o-chlorobenzoOC(=O)c1cccc 139 8071 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14037 m-chlorobenzo
    OC(=O)c1cc(Cl 156 434 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14038 p-chlorobenzoOC(=O)c1ccc(C 240 6079 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14039 1-aminodecanCCCCCCCCCC 16 8576 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    14040 1-chloro-2-ni O=[N+]([O-])c 34 13853953 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14041 1-chloro-3-ni O=[N+]([O-])c 43 21106013 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14042 3-chloro-p-aniCOc1ccc(N)cc1 50 20151 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14043 4-chloro-o-aniNc1ccc(Cl)cc1 51 21159424 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14044 5-chloro-o-aniCOc1ccc(Cl)cc 83 60129 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14045 1-chloro-4-ni O=[N+]([O-])c 84 21106020 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14046 benzenesulfo O=S(=O)(N)c1 151 7092 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14047 pentyl_butyraO=C(CCC)OCC -73 10428 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14048 pentyl_ether CCCCCOCCCC -69 12220 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14049 ethyl_heptan O=C(CCCCCC) -66 7509 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14050 4-decanol CCCCCCC(O)C -11 15486 http://www. Wilhoit R. C. Physical and Thermodynamic Properties of Aliphatic Alco
    14051 3-decanol CCCCCCCC(O) -5 452840 http://www. Wilhoit R. C. Physical and Thermodynamic Properties of Aliphatic Alco
    14052 2-decanol CC(O)CCCCCC -2 13616 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14053 1-decanol CCCCCCCCCC 7 7882 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14054 5-decanol CCCCCC(O)CC 8 90233 http://www. Wilhoit R. C. Physical and Thermodynamic Properties of Aliphatic Alco
    14055 nonanoic_aci O=C(O)CCCCC 12 7866 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14056 p-chlorobenz SCc1ccc(Cl)cc 19 72625 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14057 p-diisopropenCC(=C)c1ccc(c 66 66759 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14058 diethyl_malonO=C(CC(=O)O -50 13863636 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14059 1-nonanethiolCCCCCCCCCS -20 14349 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14060 a,a-dichlorot ClC(Cl)c1ccccc -16 13882337 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14061 3,4-dichlorot Cc1cc(Cl)c(Cl) -15 21106517 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. I; Am
    14062 2,5-dichlorot Clc1ccc(Cl)c(C 5 27492 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14063 cyclohexylbenc1cc(ccc1)C2 5 12674 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14064 2,3-dichlorot Cc1cccc(Cl)c1C 6 31931 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14065 4-chlorobenzyClCc1ccc(Cl)cc 30 7437 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14066 2,3-dichloroanNc1cccc(Cl)c1 24 21111810 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14067 2,6-dichloroanClc1cccc(Cl)c 40 11353 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14068 2,5-dichloroanClc1ccc(Cl)c(N 50 13869655 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14069 methyl_2-cya COC(=O)c1ccc 50 506353 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14070 3,5-dichloroanNc1cc(Cl)cc(Cl 53 11778 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14071 p-acetoxybenzO=C(C)Oc1ccc 57 74934 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14072 m-acetoxybenz
    O=C(C)Oc1cc( 60 259822 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14073 2,4-dichloroanClc1cc(Cl)c(N) 61 13860817 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14074 methyl_4-cya COC(=O)c1ccc 62 63956 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14075 methyl_3-cya COC(=O)c1ccc 65 75386 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14076 3,4-dichloroanNc1cc(Cl)c(Cl) 72 13860720 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14077 o-cyanomethyN#CCc1ccccc1 115 73181 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14078 p-cyanomethyN#CCc1ccc(cc 192 238257 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14079 m-diisopropy CC(C)c1cccc(c -63 7170 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14080 hexylbenzeneCCCCCCc1cccc -61 13487 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14081 bromodichlor BrC(Cl)Cl -55 6119 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14082 1-chloronona CCCCCCCCCCl -39 16268 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    14083 1-chloronaphtClc2cccc1cccc -20 6737 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14084 p-acetoxystyr O=C(C)Oc1ccc 8 68330 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14085 methyl_cinna O=C(/C=C/c1c 36 21105944 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14086 methyl_p-vinyCOC(=O)c1ccc 36 506846 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14087 m-diacetylbe O=C(C)c1cccc( 36 21733 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14088 o-diacetylbenO=C(C)c1cccc 40 32616 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14089 2,4-dichlorop Clc1cc(Cl)c(O) 43 8140 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14090 2,5-dichlorop Clc1ccc(Cl)c(O 57 65 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14091 2,3-dichlorop Oc1cccc(Cl)c1 59 10857 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14092 benzoylaceto O=C(CC(C)=O) 59 6898 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14093 m-nitrophenylO=[N+]([O-])c 63 11627 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14094 2,6-dichlorop Clc1cccc(Cl)c 67 6633 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14095 3,4-dichlorop Oc1cc(Cl)c(Cl) 67 6988 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14096 3,5-dichlorop Oc1cc(Cl)cc(Cl 68 11083 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14097 o-nitrophenylaO=[N+]([O-]) 84 11395 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14098 p-diacetylbenO=C(C)c1ccc(c 112 13287 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14099 p-nitrophenylaO=[N+]([O-])c 116 61672 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14100 hexamethylbeCc1c(C)c(C)c(C 164 6642 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14101 o-acetylbenz O=C(N)c1cccc 122 11418392 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14102 4-acetamidobO=C(C)Nc1ccc 160 66572 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14103 2-bromo-4-meCC(C)CC(Br)C -94 108655 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    14104 1-bromohexa BrCCCCCC -85 7810 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    14105 4-phenyl-2-meCC(C)(O)CCc1c 32 7350 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14106 o-acetoxyben O=C(C)Oc1ccc 38 207119 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14107 p-ethoxyacet CCOc1ccc(cc1 39 65704 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14108 methyl_3-for COC(=O)c1ccc 58 554595 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14109 methyl_4-for COC(=O)c1ccc 60 14559 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14110 2-acetylbenzoOC(=O)c1cccc 116 61749 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14111 m-acetylbenzoOC(=O)c1cccc 172 191058 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14112 4-acetylbenzoOC(=O)c1ccc( 209 10986 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14113 phthalamide O=C(N)c1cccc 222 6690 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14114 isophthalamidO=C(N)c1cccc 280 67036 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14115 terephthalamO=C(N)c1ccc( 332 68857 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14116 ethyl_2-amin Nc1ccccc1C(= 14 21106112 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14117 o-nitroaceto O=[N+]([O-])c 30 10868 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14118 m-nitroaceto O=[N+]([O-])c 78 21106145 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14119 p-nitroaceto O=[N+]([O-])c 80 21106581 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14120 ethyl_4-amin Nc1ccc(cc1)C 89 13854242 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14121 phthalic_aci OC(=O)c1cccc 154 6691 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14122 isophthalic_ OC(=O)c1cccc 280 2282778 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14123 terephthalic OC(=O)c1ccc( 300 441895 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14124 1,1,1,2-tetra ClCC(Cl)(Cl)Cl -70 11911 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    14125 1,1,2,2-tetra ClC(Cl)C(Cl)Cl -44 6342 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    14126 1-dodecyne CCCCCCCCCCC -19 63019 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14127 cyclododeceneC1C=CCCCCCC 0 4517590 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14128 dicyclohexyl C1CC(CCC1)C 4 6827 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14129 4-methoxypheO=C(C)Oc1ccc 32 64148 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14130 o-diethoxybe CCOc1ccccc1 43 67466 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14131 3,4-dimethox COc1cc(ccc1O 44 21106008 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14132 3,5-dimethox COc1cc(cc(OC 47 73763 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14133 methyl_4-metCOc1ccc(cc1) 50 21108577 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14134 methyl_4-hydOCc1ccc(cc1) 51 73375 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14135 2,3-dimethox COc1cccc(C=O 52 59950 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14136 2,5-dimethox COc1ccc(cc1C 52 60092 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14137 4-butoxyphenOc1ccc(OCCCC 65 28973 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14138 2,4-dimethox COc1cc(ccc1C 72 62390 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14139 p-diethoxybe CCOc1ccc(cc1 72 21111774 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14140 fluorene c1cccc2Cc3cc 114 6592 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14141 m-nitrobenza O=[N+]([O-])c 143 11202219 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14142 o-nitrobenza O=[N+]([O-])c 176 11178542 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14143 p-nitrobenza O=[N+]([O-])c 201 11594 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14144 phthalic_acid OC(=O)c1cccc 210 992 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14145 terephthalic_ OC(=O)c1ccc( 300 7208 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14146 isophthalic_acOC(=O)c1cccc 342 8182 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14147 decyl_cyanideCCCCCCCCCCC -6 15853 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    14148 m-nitrobenzoiO=[N+]([O-])c 142 8183 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14149 o-nitrobenzoi O=[N+]([O-])c 148 10616 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14150 p-nitrobenzoi O=[N+]([O-])c 241 5882 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14151 3-iodo-1-propC=CCI -99 21171407 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    14152 heptylcyclopeCCCCCCCC1CC -53 122159 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14153 hexylcyclohexCCCCCCC1CCC -43 19109 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14154 2-methyl-1-u CC(=C)CCCCC -40 79109 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14155 1-dodecene CCCCCCCCCCC -35 7891 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14156 1-methyl-2-p Cc2ccccc2c1cc 0 12044 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14157 1-methyl-3-p Cc1cccc(c1)c2 5 12045 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14158 diphenylmethc1ccccc1Cc2cc 25 7299 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14159 1,2,3-trimeth COc1c(cccc1O 45 21111804 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14160 1-methyl-4-p Cc1ccc(cc1)c2 48 12047 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14161 1,3,5-trimeth COc1cc(cc(OC 53 21111723 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14162 cyclododecanC1CCCCCCCCC 61 8911 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14163 m-dinitroben O=[N+]([O-])c 89 7172 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14164 o-dinitrobenz O=[N+]([O-])c 118 10257 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14165 2,5-dihydroxyOc1ccc(O)cc1 127 759 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14166 p-dinitrobenz O=[N+]([O-])c 173 7211 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14167 3-aminobipheNc1cc(ccc1)c2 33 15848 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14168 2-aminobipheNc2ccccc2c1c 49 6748 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14169 4-aminobipheNc1ccc(cc1)c2 54 6835 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14170 p-chloroacetanClc1ccc(NC(C) 178 10411 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14171 1-iodopropan CCCI -101 31029 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    14172 2-iodopropan CC(C)I -90 6122 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14173 3-methylundeCCCCCCCCC(C -58 13245 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14174 2-methylundeCC(C)CCCCCC -47 21934 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14175 m-bromotolu Cc1cc(Br)ccc1 -40 13875392 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14176 o-bromotolueCc1ccccc1Br -28 13875320 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. I; Am
    14177 dodecane CCCCCCCCCCC -10 7890 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14178 benzyl_bromiBrCc1ccccc1 -2 13851576 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14179 undecanal CCCCCCCCCCC 0 7894 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14180 4-chlorophenyClc1ccc(OC(C) 9 12836 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14181 2-undecanoneCC(=O)CCCCC 13 7871 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14182 3-undecanoneCCC(=O)CCCC 13 67735 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14183 6-undecanoneCCCCCC(=O)C 15 12972 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14184 methyl_3-chl Clc1cc(ccc1)C 21 21106541 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14185 p-bromotolueCc1ccc(Br)cc1 25 13875258 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. I; Am
    14186 phenyl_ether c1ccccc1Oc2c 28 7302 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14187 methyl_4-chl Clc1ccc(cc1)C 44 13669 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14188 2'-acetonaph CC(=O)c1ccc2 53 6855 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14189 o-phenylphenOc2ccccc2c1c 60 13839012 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14190 m-phenylphenOc1cc(ccc1)c2 78 10903 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14191 m-chloropheny
    Clc1cc(CC(=O) 78 15092 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14192 2-chlorophenyClc1ccccc1CC 95 16208 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14193 4-chlorophenyClc1ccc(CC(=O 103 15093 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14194 p-phenylphenOc1ccc(cc1)c2 167 13846658 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14195 4-(chloromethClCc1ccc(cc1) 201 66841 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14196 4-chloro-3-ni O=[N+]([O-])c 7 6710 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14197 m-bromoanili Nc1cc(Br)ccc1 17 13860633 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14198 o-bromoanilinNc1ccccc1Br 30 21111816 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14199 2-chloro-6-ni Cc1c(cccc1Cl) 36 6484 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14200 4-chloro-2-ni Cc1ccc(Cl)cc1 39 6709 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14201 3-nitrobenzyl O=[N+]([O-])c 47 11581 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14202 2-nitrobenzyl O=[N+]([O-])c 48 11427 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14203 2-chloro-4-ni Cc1ccc(cc1Cl) 60 8178 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14204 p-bromoanilinNc1ccc(Br)cc1 63 7519 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14205 3,5-dichlorobeClc1cc(C#N)cc 64 73125 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14206 4-nitrobenzyl O=[N+]([O-])c 73 7202 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14207 p-toluenesulf Cc1ccc(cc1)S( 139 6033 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14208 2,6-dichlorobeN#Cc1c(Cl)ccc 143 2923 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14209 dibromomethBrCBr -53 2916 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    14210 ethyl_octanoaO=C(CCCCCCC -47 7511 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14211 diethyl_maleaO=C(C=C/C(= -10 4436353 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14212 2-undecanol CC(O)CCCCCC 0 14700 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14213 diethyl_fumarO=C(/C=C/C( 2 553702 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14214 o-bromophenoOc1ccccc1Br 5 6974 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14215 1-undecanol CCCCCCCCCC 16 7892 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14216 m-bromophenOc1cc(Br)ccc1 31 13875441 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14217 decanoic_acidO=C(O)CCCCC 32 2863 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14218 5-chloro-1,3- COc1cc(cc(Cl) 34 73537 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14219 p-bromophenoOc1ccc(Br)cc1 66 13842573 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14220 4-chloro-3-nitO=[N+]([O-])c 100 11967 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14221 2-chloro-4-nitNc1ccc(cc1Cl) 108 8179 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14222 2-chloro-5-nitNc1cc(ccc1Cl) 118 21272 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14223 4-chloro-2-nitNc1ccc(Cl)cc1 118 6713 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14224 5-chlorosalicyOc1ccc(Cl)cc1 171 9075 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14225 4-chlorosalicyOC(=O)c1ccc(C 210 71120 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14226 2-chloro-4-ni Oc1ccc(cc1Cl) 106 11577 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14227 1-decanethiolCCCCCCCCCCS -26 8577 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14228 diethyl_succi O=C(CCC(=O) -20 13865630 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14229 dimethyl_adipO=C(CCCCC(= 8 11824 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14230 a,a'-dichloro- ClCc1cccc(CCl 36 21168838 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14231 3,4-dichlorob Clc1ccc(C=O)c 44 21106577 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14232 a,a'-dichloro- ClCc1ccccc1CC 56 21111896 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14233 2,5-dichloro-pClc1cc(C)c(Cl) 68 13868642 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. I; Am
    14234 2,6-dichlorob O=Cc1c(Cl)ccc 71 6481 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14235 2,4-dichlorob O=Cc1ccc(Cl)c 73 12830 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14236 a,a'-dichloro- ClCc1ccc(CCl) 100 11671 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14237 suberic_acid O=C(O)CCCCC 144 10025 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14238 methyl_2-cya N#CCc1ccccc1 48 511839 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14239 4-cyclohexylanNc1ccc(cc1)C 53 72918 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14240 ethyl_4-cyan O=C(OCC)c1cc 54 73619 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14241 ethyl_p-cyan O=C(OCC)c1cc 54 73619 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14242 ethyl_m-cyan O=C(OCC)c1cc 56 11362492 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14243 methyl_p-cya N#CCc1ccc(cc 64 741427 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14244 ethyl_o-cyan O=C(OCC)c1cc 68 213259 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14245 cis-1-bromo-1CCCCC/C=CBr -98 18504110 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    14246 heptylbenzen CCCCCCCc1ccc -48 13492 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14247 1-chlorodeca CCCCCCCCCCC -31 13248 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    14248 ethyl_cinnam O=C(/C=C/c1c 7 553344 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14249 2,6-dichloroanCOc1c(Cl)cccc 10 15311 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14250 2,3-dichloroanClc1c(OC)cccc 31 15310 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14251 3,5-dichloroanClc1cc(OC)cc(C 40 33621 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14252 p-diethylami CCN(CC)c1ccc 40 60462 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14253 n-bromosucci O=C1CCC(=O) 180 60528 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14254 1-bromohept BrCCCCCCC -56 11863 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    14255 butyl_benzoa O=C(OCCCC)c1 -12 8374 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14256 3-acetoxy_ac O=C(C)Oc1cc( 44 68088 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14257 p-acetoxy_ac O=C(C)Oc1ccc 54 74935 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14258 diphenylacetyC(#Cc1ccccc1) 60 9961 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14259 2-acetoxy_ac O=C(COC(C)=O 89 21241193 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14260 methyl_4-acetCOC(=O)c1ccc 95 121635 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14261 4-butylbenzoiO=C(O)c1ccc( 100 79969 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14262 4-tert-butylbeCC(C)(C)c1ccc 165 7125 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14263 anthracene c1ccc2cc3cccc 216 8111 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14264 o-cyanobiphenN#Cc2ccccc2c 38 124512 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14265 m-cyanobipheN#Cc1cccc(c1) 49 31631 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14266 p-cyanobiphenN#Cc1ccc(cc1) 86 17025 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14267 phthalic_acid COC(=O)c1ccc 100 9140315 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14268 4-ethoxyacetaCCOc1ccc(cc1 135 4590 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14269 o-acetoxyben O=C(C)Oc1ccc 138 72046 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14270 m-acetoxybenO=C(C)Oc1cc( 140 242980 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14271 isophthalic_a COC(=O)c1ccc 148 160585 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14272 p-acetoxyben O=C(C)Oc1ccc 179 87953 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14273 n-acetylanthraO=C(C)Nc1ccc 184 6705 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14274 terephthalic aCOC(=O)c1ccc 206 518175 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14275 4-acetamidobeO=C(C)Nc1ccc 259 18177 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14276 1,1,1,2-tetra CC(Cl)C(Cl)(Cl) -65 12579 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    14277 1-tridecyne C#CCCCCCCCC -5 105232 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14278 ethyl_anisate COc1ccc(cc1) 7 21159425 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14279 1,1-diphenyleC=C(c1ccccc1) 8 10287 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14280 1,2,4-trichlo Clc1cc(Cl)c(Cl 17 13862559 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. I; Am
    14281 2,5-dimethox COc1ccc(cc1C 20 64152 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14282 3,5-dimethox COc1cc(cc(OC 34 86665 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14283 2,4-dimethox COc1cc(ccc1C 41 63208 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14284 3,4-dimethox COc1cc(ccc1O 51 21168556 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14285 1,2,3-trichlo Clc1cccc(Cl)c1 55 13864445 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14286 1,3,5-trichlo Clc1cc(Cl)cc(C 65 7662 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14287 mono-methyl_COC(=O)c1ccc 83 19207 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14288 fluorenone O=C2C=CC=C1 84 11310055 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14289 p-phenylstyreC=Cc1ccc(cc1) 119 15998 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14290 trans-stilbeneC(=C/c1ccccc1 124 553649 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14291 m-acetoxy_beO=C(C)Oc1cc( 133 208487 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14292 acetylsalicylic OC(=O)c1cccc 141 9074524 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14293 mono-methyl_COC(=O)c1ccc 166 523223 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14294 4-acetoxybenzO=C(C)Oc1ccc 194 15983 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14295 mono-methyl_COC(=O)c1ccc 221 14760 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14296 methyl_2-nitrO=[N+]([O-])c -13 62292 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14297 dicyclohexyla C1CCCCC1NC2 -2 7301 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14298 undecyl_cyanCCCCCCCCCCC 4 16177 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    14299 m-bromobenzo
    N#Cc1cc(Br)cc 39 21865 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14300 o-nitrophenyl O=C(C)Oc1cccc 40 11397 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14301 m-nitrophenylO=C(C)Oc1cccc 54 14473 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14302 o-bromobenzon
    N#Cc1ccccc1B 55 15440 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14303 p-nitrophenyl O=C(C)Oc1ccc( 78 12687 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14304 methyl_3-nitrO=[N+]([O-])c 80 62472 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14305 methyl_4-nitrO=[N+]([O-])c 96 11586 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14306 p-bromobenzon
    N#Cc1ccc(Br)c 111 11662 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14307 m-nitro_phenyO=[N+]([O-])c 119 15089 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14308 octylcyclopenCCCCCCCCC1C -44 120910 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14309 heptylcycloheCCCCCCCC1CC -31 20521 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14310 2-methyl-1-d CCCCCCCCCCC -31 452937 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14311 1-ethyl-3-phe CCc1cccc(c1)c -28 72051 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14312 3-methyldiph Cc2cccc(Cc1cc -28 120198 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14313 1-tridecene C=CCCCCCCCC -23 16180 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14314 1,1-diphenyleCC(c1ccccc1)c -18 11424 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14315 1-ethyl-2-phe CCc2ccccc2c1 -6 14969 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14316 4-methyldiph Cc2ccc(Cc1ccc 5 62501 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14317 b-bromostyreBrC=Cc1ccccc 7 7384 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14318 3,3'-dimethyl Cc1cccc(c1)c2 7 11437 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14319 2-methyldiph Cc2ccccc2Cc1 7 62938 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14320 2,2'-dimethyl Cc2ccccc2c1c 18 11304 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14321 cyclotridecan C1CCCCCCCCC 23 119922 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14322 1-ethyl-4-phe CCc1ccc(cc1)c 47 72080 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14323 benzophenonO=C(c1ccccc1) 48 2991 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. I; Am
    14324 1,2-diphenyleC(Cc1ccccc1)c 51 7364 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14325 3,4-dinitrotol O=[N+]([O-])c 56 11390 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14326 2,3-dinitrotol O=[N+]([O-])c 60 11268 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14327 cyclododecanO=C1CCCCCCC 60 12690 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14328 p-phenylbenz O=Cc1ccc(cc1) 60 69150 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14329 2,6-dinitrotol Cc1c(cccc1[N+ 65 11320 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14330 2,4-dinitrotol Cc1ccc(cc1[N+ 69 8150 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14331 azobenzene N(=N/c1ccccc1 69 2185 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14332 4,4'-dimethyl Cc1ccc(cc1)c2 121 11447 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14333 m-chlorocinnaClc1cc(/C=C/C 159 642441 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14334 o-chlorocinnam
    Clc1ccccc1/C 208 610596 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14335 p-chlorocinnaClc1ccc(/C=C/ 248 553383 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14336 aminodiphenyNC(c1ccccc1)c 12 6769 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14337 1,4-dimethoxyCOc1ccc(cc1[N 71 60006 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14338 2-chloro-4-d O=Cc1ccc(cc1C 80 66642 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14339 1,2-dimethoxyCOc1cc(ccc1OC 97 62928 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14340 2,6-dinitroani O=[N+]([O-])c 133 62291 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14341 3,5-dinitroani O=[N+]([O-])c 161 11571 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14342 2,4-dinitroani O=[N+]([O-])c 177 7045 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14343 2-iodobutane CC(I)CC -104 10119 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14344 1-iodobutane CCCCI -103 10497 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    14345 1-bromo-2-et CCc1ccccc1Br -68 21111882 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. I; Am
    14346 3-methyldodeCC(CCCCCCCC -53 26485 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14347 1-bromo-4-et CCc1ccc(Br)cc -43 21106562 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. I; Am
    14348 2-iodo-2-met CC(C)(C)I -38 10733 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14349 2-methyldodeCC(C)CCCCCC -26 14535 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14350 4-bromo-1,3- Cc1ccc(Br)c(C -17 13875259 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14351 2-bromo-m-xyCc1cccc(C)c1B -10 13875201 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14352 tridecane CCCCCCCCCCC -5 11882 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14353 2-bromo-p-xyCc1cc(Br)c(C) 10 21171515 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14354 dodecanal CCCCCCCCCCC 12 7902 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14355 2-dodecanoneCC(=O)CCCCC 21 21153 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14356 o-bromobenzaO=Cc1ccccc1B 22 21111817 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14357 2-methoxybipCOc2ccccc2c1 31 6574 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14358 4-biphenylmeOCc1ccc(cc1)c 46 18105 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14359 o-phenylbenzyOCc2ccccc2c1 50 68709 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14360 m-phenylbenzy
    OCc1cccc(c1)c 55 524672 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14361 p-bromobenzaO=Cc1ccc(Br)c 57 63906 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14362 diphenylmethOC(c1ccccc1)c 66 6770 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14363 cyclododecanoOC1CCCCCCCC 76 14836 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14364 4-methoxybipCOc1ccc(cc1)c 91 11449 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14365 p-phenylbenzyOCc1ccc(cc1)c 105 18105 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14366 2,4-dinitroph O=[N+]([O-])c 108 1448 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14367 tributylamine CCCCN(CCCC) -70 7340 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14368 2-bromo-4-met
    Cc1cc(Br)c(N) 14 10942 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14369 4-bromo-2-met
    Cc1cc(Br)ccc1 52 10943 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14370 4-bromo-3-met
    Nc1ccc(Br)c(C 79 21844 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14371 1,1-dibromoe BrC(Br)C -63 10728 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    14372 phenyl_sulfid Sc1ccccc1 -40 7681 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14373 o-bromoanisoCOc1ccccc1Br 2 13881329 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14374 1,2-dibromoe BrCCBr 10 7551 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    14375 p-bromoanisoCOc1ccc(Br)cc 10 13881571 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14376 2-dodecanol CC(O)CCCCCC 19 23408 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14377 1-dodecanol CCCCCCCCCC 24 7901 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14378 p-bromobenzyl
    OCc1ccc(Br)cc 76 63307 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14379 methyl_p-toluCOS(=O)(=O)c1 79 6393 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14380 o-bromobenzyl
    OCc1ccccc1Br 81 65682 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14381 2,2'-dihydrox Oc2ccccc2c1c 109 14959 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14382 4-chloro-2-meOC(=O)c1ccc( 146 84565 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14383 4,4'-dihydrox Oc1ccc(cc1)c2 278 6845 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14384 4-chloro-3-nitO=[N+]([O-])c 44 23485 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14385 2-chloro-6-nitCOc1c(cccc1Cl 58 477334 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14386 5-chloro-2-nitO=[N+]([O-])c 71 73177 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14387 2,5-dichloroa O=C(C)c1cc(Cl 12 68111 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14388 3-chlorobipheClc1cc(ccc1)c 18 15488 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14389 2,4-dichloroa O=C(C)c1ccc(C 34 21106529 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14390 2-chlorobipheClc2ccccc2c1c 34 218253 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14391 cyclohexyl_phO=C(c1ccccc1 55 12307 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14392 3,4-dichloroa Clc1ccc(cc1Cl 73 68350 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14393 4-chlorobipheClc1ccc(cc1)c 78 15489 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14394 2,6-dichlorob O=C(N)c1c(Cl) 198 15359 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14395 octylbenzene CCCCCCCCc1cc -36 15747 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14396 1-chlorounde CCCCCCCCCCC -17 16269 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    14397 p-bromochlorClc1ccc(Br)cc1 67 7518 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14398 p-toluenesulf Cc1ccc(cc1)S( 69 7119 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14399 p-di-tert-but CC(C)(C)c1ccc( 74 13293 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14400 2,6-dichlorob OC(=O)c1c(Cl) 144 5555 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14401 2,5-dichlorob OC(=O)c1cc(Cl 156 10801689 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14402 2,4-dichlorob OC(=O)c1ccc(C 159 5583 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14403 3,5-dichlorob Clc1cc(cc(Cl) 186 5606 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14404 3,4-dichlorob Clc1ccc(cc1Cl 208 5612 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14405 2,4-dichloron O=[N+]([O-])c1 31 21106035 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14406 3,4-dichloron Clc1ccc(cc1Cl) 41 21106095 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14407 2,5-dichloron O=[N+]([O-])c1 56 21111865 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14408 2,3-dichloron Clc1c(cccc1Cl) 62 21106574 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14409 4-chlorobenz O=S(N)(=O)c1c 145 60188 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14410 1-bromooctanBrCCCCCCCC -55 7848 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    14411 ethyl_p-acetyCC(=O)c1ccc( 55 522416 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14412 p-benzyl_benzN#Cc2ccc(Cc1c 51 124402 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14413 a,a,a-trichlor ClC(Cl)(Cl)c1c -8 13882366 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14414 2,4-dichlorob ClCc1ccc(Cl)cc -3 6942 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. I; Am
    14415 1-tetradecyneCCCCCCCCCCC 0 63021 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14416 dimethyl_phthCOC(=O)c1ccc 2 13837329 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14417 methyl_3-aceO=C(C)Oc1cc( 29 502413 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14418 1,1-diphenyl- CC=C(/c1ccccc 49 208033 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14419 methyl_2-aceO=C(C)Oc1ccc 52 61759 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14420 catechol diaceO=C(C)Oc1ccc 64 11969 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14421 isophthalic ac O=C(O)c1cccc 109 713524 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14422 hydroquinoneO=C(C)Oc1ccc 125 64166 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14423 dimethyl_tereCOC(=O)c1ccc 141 13863300 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14424 4-butoxybenzoO=C(O)c1ccc( 147 65785 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14425 o-bromophenyl
    Brc1ccccc1CC -1 27535 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14426 m-bromophenyl
    Brc1cc(CC#N) 28 33137 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14427 p-bromophenyl
    Brc1ccc(CC#N 48 25968 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14428 ethyl_4-nitro O=[N+]([O-])c 58 7177 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14429 nonylcyclope CCCCCCCCCC1 -29 121410 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14430 4-ethyldiphe CCc2ccc(Cc1cc -24 62502 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14431 2-methyl-1-tr CC(=C)CCCCC -22 123762 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14432 1,3-diphenylpC(CCc1ccccc1) -21 13502 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14433 octylcyclohex CCCCCCCCC1C -20 14941 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14434 1-tetradeceneCCCCCCCCCCC -13 13622 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14435 2-ethyldiphe CCc2ccccc2Cc -11 106985 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14436 3-ethyldiphe CCc2cccc(Cc1c -9 35880 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14437 1,2-diphenylpCC(Cc1ccccc1) 0 20737 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14438 1,1-diphenylpCCC(c1ccccc1) 14 66369 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14439 2,2-diphenylpCC(C)(c1ccccc 29 12521 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14440 4,4'-dimethyl Cc1ccc(cc1)Cc 29 19816 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14441 3-acetylbiphe O=C(C)c1cccc( 36 226898 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14442 2,3,4-trimeth COc1c(OC)c(c 40 67561 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14443 methyl_3,5-d COc1cc(cc(OC 43 21159597 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14444 cyclotetradec C1CCCCCCCCC 54 60847 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14445 2-acetylbiphe O=C(C)c2cccc 56 9335003 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14446 methyl_3,4-d COc1cc(ccc1O 60 21159598 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14447 2,4-dinitrobe O=[N+]([O-])c 66 61548 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14448 3,4,5-trimeth COc1c(cc(cc1 75 6597 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14449 2,4,5-trimeth COc1cc(OC)c( 114 19331 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14450 2,6-dinitrobe O=[N+]([O-])c 119 62293 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14451 2,4,6-trimeth COc1cc(cc(OC 120 63211 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14452 p-acetylbipheO=C(C)c1ccc(c 122 6846 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14453 benzanilide O=C(Nc1ccccc 163 6900 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14454 o-phenylbenz O=C(N)c2cccc 177 75119 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14455 p-phenylbenz O=C(N)c1ccc(c 223 523754 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14456 1-iodopentan CCCCCI -86 11830 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    14457 o-bromocumeCC(C)c1ccccc1 -59 21947 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. I; Am
    14458 3-methyltrideCC(CCCCCCCC -38 99494 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14459 2-methyltrideCC(C)CCCCCC -25 14534 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14460 p-bromocumeCC(C)c1ccc(Br -22 21171514 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. I; Am
    14461 2-bromomesitCc1cc(C)c(Br)c 2 21112244 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14462 benzyl_ether C(OCc1ccccc1) 3 21105876 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14463 tetradecane CCCCCCCCCCC 6 11883 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14464 tridecanal CCCCCCCCCCC 15 23643 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14465 p-bromoacet O=C(C)c1ccc(B 51 7186 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14466 phenyl_benzoO=C(Oc1ccccc 70 6901 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14467 5-bromo-1,2,4Cc1cc(C)c(Br) 71 13875161 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14468 2,4-dinitroani COc1ccc(cc1[N 88 8080 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14469 o-phenylbenzoOC(=O)c2cccc 115 63538 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14470 m-phenylbenzOC(=O)c1cccc( 167 12323 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14471 p-phenylbenzoOC(=O)c1ccc(c 227 60090 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14472 2-nitrobiphenO=[N+]([O-])c 37 21106576 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14473 4-bromo-n,n-dCN(C)c1ccc(Br 55 13873600 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14474 3-nitrobiphenO=[N+]([O-])c 62 15596 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14475 4-nitrobiphenO=[N+]([O-])c 114 21109008 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14476 m-bromobenzO=C(N)c1cc(Br 155 81061 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14477 o-bromobenz O=C(N)c1cccc 160 70021 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14478 p-bromobenz O=C(N)c1ccc(B 191 62884 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14479 1,2-dibromopBrC(C)CBr -55 6305 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    14480 1,3-dibromopBrCCCBr -34 7710 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    14481 diisopropyl_f CC(C)OC(=O)/ 2 4512524 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14482 p-bromopheneBrc1ccc(OCC) 4 21111894 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14483 ethyl_p-tolue O=S(=O)(OCC) 34 6386 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14484 1-tridecanol CCCCCCCCCC 34 7915 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14485 o-bromobenzoOC(=O)c1cccc 149 6674 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14486 m-bromobenzo
    OC(=O)c1cc(Br 157 10972 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14487 p-bromobenzoOC(=O)c1ccc(B 253 10980 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14488 o-bromonitro O=[N+]([O-])c 43 10864 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14489 m-bromonitroO=[N+]([O-])c 54 21111786 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14490 p-bromonitro O=[N+]([O-])c 126 21171513 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14491 2-chloro-4-ni OC(=O)c1ccc(c 139 7168 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14492 2-chloro-5-ni OC(=O)c1cc(cc 166 16359 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14493 2-chloro-3-ni O=[N+]([O-])c 181 18716 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14494 3-chloro-2-ni O=[N+]([O-])c 237 19663 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14495 diethyl_adipa O=C(CCCCC(= -18 13835108 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14496 chlorodiphen ClC(c1ccccc1) 16 6768 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14497 1-chloro-2,4- O=[N+]([O-])c 53 13868426 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14498 diphenyl_sulf O=S(c1ccccc1) 70 13090 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14499 sebacic_acid O=C(O)CCCCC 133 5004 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14500 iodobenzene Ic1ccccc1 -31 11087 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. I; Am
    14501 nonylbenzeneCCCCCCCCCc1c -24 13503 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14502 p,p'-dicyanob N#Cc1ccc(cc1) 237 14584 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14503 1-bromononaCCCCCCCCCBr -29 12219 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    14504 chlorodibrom BrC(Br)Cl -22 29036 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14505 1-bromonaphtBrc2cccc1cccc -1 6735 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14506 2-bromonaphtBrc1ccc2ccccc 54 10894 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14507 1,4-diphenyl- C(C=Cc1ccccc 152 12876 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14508 1,1-diphenyl- CCC=C(/c1cccc -1 453032 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14509 1-pentadecynC#CCCCCCCCC 10 63022 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14510 ethyl_p-acetoO=C(C)Oc1ccc 34 2033213 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14511 pentaerythrityClCC(CCl)(CCl) 95 69160 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14512 anthraquinon O=C2c1ccccc1 284 13835294 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14513 1,1-diphenylbCCCC(c1ccccc1 -25 62952 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14514 decylcyclopenCCCCCCCCCCC -22 120911 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14515 2-methyl-1-teCCCCCCCCCCC -15 454788 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14516 nonylcyclohe CCCCCCCCCC1 -10 16908 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14517 1-pentadecenC=CCCCCCCCC -4 24142 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14518 1,3-diphenylaO=C(Cc1ccccc 33 21105887 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14519 cyclopentade C1CCCCCCCCC 62 60848 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14520 benzil O=C(C(=O)c1cc 95 8329 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14521 1,2,4-benzentrOC(=O)c1cc(c 231 10258 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14522 p-phenyl-n-m O=C(NC)c1ccc( 86 2006927 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14523 o-benzylbenz NC(=O)c2cccc 165 403380 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14524 1-iodohexaneCCCCCCI -75 12010 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    14525 3-methyltetr CC(CCCCCCCC -32 78235 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14526 2-methyltetr CC(C)CCCCCC -8 14533 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14527 pentadecane CCCCCCCCCCC 10 11885 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14528 1-bromo-4-terCC(C)(C)c1ccc 16 21171393 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14529 benzyl_benzoO=C(OCc1cccc 19 13856959 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14530 tetradecyl_al CCCCCCCCCCC 24 29031 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14531 3-acetoxybiphO=C(C)Oc1cc(c 34 13543818 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14532 2-acetoxybiphO=C(C)Oc2ccc 65 202898 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14533 p-tolyl_benzoO=C(Oc1ccc(C) 70 11468 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14534 4-cumylphenoCC(C)(c1ccc(O 70 11249 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14535 1-chloroanthrClc2cccc1cc3c 77 36337 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14536 4-acetoxybiphO=C(C)Oc1ccc( 88 306959 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14537 o-phenyl_phen
    OC(=O)Cc2ccc 116 231364 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14538 methyl_4-pheCOC(=O)c1ccc( 118 62956 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14539 benzoin OC(C(=O)c1ccc 135 8093 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14540 p-bromoacetan
    Brc1ccc(NC(C) 166 7399 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14541 1,2-dibromobBrC(CC)CBr -65 21171408 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    14542 1,4-dibromobBrCCCCBr -17 7765 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    14543 4-bromophenyBrc1ccc(OC(C) 21 67299 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14544 methyl_3-broBrc1cc(ccc1)C 33 11573 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14545 2-tetradecanoCC(O)CCCCCC 34 19606 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14546 1-tetradecanoCCCCCCCCCC 40 7917 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14547 1,2,3,4-tetra Clc1ccc(Cl)c(C 47 21106540 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14548 benzyl_sulfideSCc1ccccc1 49 13851383 http://www. Aldrich Chemix clearly out of range JCB
    14549 1,2,3,5-tetra Clc1cc(Cl)c(Cl) 53 21106571 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14550 methyl_4-broBrc1ccc(cc1)C 81 11584 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14551 1,2-diphenox C(COc1ccccc1 95 7427 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14552 1,2,4,5-tetra Clc1cc(Cl)c(Cl 140 21106163 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14553 3-bromo-4-meCc1ccc(cc1Br) 200 74124 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14554 2-bromo-6-nitCc1c(cccc1Br) 40 110131 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14555 2-nitrobenzyl O=[N+]([O-])c 47 69974 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14556 3-nitrobenzyl O=[N+]([O-])c 59 69973 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14557 2-bromo-4-nitCc1ccc(cc1Br) 76 74171 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14558 2-bromo-5-nitCc1cc(ccc1Br) 78 220493 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14559 4-nitrobenzyl O=[N+]([O-])c 99 59402 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14560 1-bromo-2,4- COc1cc(ccc1B 26 78722 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14561 o-chlorobenz O=C(c1ccccc1C 46 71173 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14562 p-chlorobenz O=C(c1ccc(Cl) 76 8331 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14563 m-chlorobenzO=C(c1cc(Cl)c 82 59487 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14564 6-chloro-2,4-dNc1c(cc(cc1Cl 157 17987 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14565 decylbenzeneCCCCCCCCCCc -14 7430 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14566 1-chlorodode CCCCCCCCCCC -9 7900 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    14567 triacetin O=C(C)OC(COC 3 13835706 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14568 p-iodotolueneCc1ccc(I)cc1 43 11707 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14569 phenyl_sulfonO=S(=O)c1ccc 124 10650424 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14570 m-iodoanilineIc1cccc(N)c1 25 11768 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14571 o-iodoaniline Ic1ccccc1N 58 11500 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14572 p-iodoaniline Ic1ccc(N)cc1 63 10431 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14573 1-bromodeca BrCCCCCCCCC -29 7881 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    14574 o-iodophenol Ic1ccccc1O 42 10328 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14575 m-iodophenolIc1cccc(O)c1 43 11769 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14576 p-iodophenol Ic1ccc(O)cc1 94 10432 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14577 diethyl_phthaO=C(OCC)c1cc -3 13837303 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14578 1-hexadecyneCCCCCCCCCCC 15 11890 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14579 1-bromo-2-naOc2ccc1ccccc 75 10840 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14580 1,1-diphenylpCCCCC(c1ccccc -12 120876 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14581 2-methyl-1-p CC(=C)CCCCC -7 453987 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14582 decylcyclohexCCCCCCCCCCC -2 14942 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14583 1-hexadeceneCCCCCCCCCCC 4 11889 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14584 cyclohexadec C1CCCCCCCCC 61 60849 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14585 1-bromo-2,6- Clc1cccc(Cl)c1 66 27488 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14586 dibenzoylmet O=C(CC(=O)c1 78 8126 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14587 1-iodoheptan CCCCCCCI -48 19100 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    14588 3-methylpent CC(CCCCCCCC -22 16907 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14589 2-methylpent CC(C)CCCCCC -7 14532 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14590 hexadecane CCCCCCCCCCC 18 10540 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14591 benzoin_methCOC(C(=O)c1c 47 88569 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14592 ethyl_4-phenyO=C(OCC)c1cc 49 208027 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14593 methyl_3,4,5-COc1c(cc(cc1 84 15161 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14594 m-bromocinnaBrc1cc(/C=C/C 177 678734 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14595 4-bromocinnaBrc1ccc(/C=C/ 262 644222 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14596 1,2-dibromo- BrC(C)(CC)CBr -70 451813 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    14597 1,5-dibromopBrCCCCCBr -40 7809 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    14598 1,4-dibromopBrC(C)CCCBr -34 71414 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    14599 1,1-dibromo-2CC(C)(C)C(Br)B 14 10178955 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    14600 2,3-dibromo- BrC(C)(C)C(Br) 15 71392 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    14601 2-chlorobenzoClC(Cl)(Cl)c1c 29 15636 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. I; Am
    14602 1-pentadecanCCCCCCCCCCC 46 11891 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14603 m-iodobenzoniN#Cc1cc(I)ccc 40 127332 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14604 o-iodobenzonit
    N#Cc1ccccc1I 55 2040107 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14605 p-iodobenzonit
    N#Cc1ccc(I)cc 125 68939 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14606 dimethyl_seb O=C(CCCCCCC 30 7541 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14607 p-iodostyreneC=Cc1ccc(I)cc 44 9184941 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14608 o-terphenyl c1cc(ccc1)c3c 56 6508 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14609 m-terphenyl c1cc(ccc1)c2c 87 6809 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14610 benzyl_sulfox O=SCc1ccccc1 134 10677540 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14611 5-bromovanillOc1c(OC)cc(c 164 17096 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14612 p-terphenyl c1cc(ccc1)c2c 213 6848 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14613 undecylbenzeCCCCCCCCCCC -5 21703 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14614 2-bromobipheBrc2ccccc2c1c 2 15494 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14615 2-iodo-1,3-di Cc1cccc(C)c1I 11 62314 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14616 o-iodobenzal O=Cc1ccccc1I 37 558584 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14617 m-iodobenzalO=Cc1cc(I)ccc 58 221355 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14618 p-iodobenzal O=Cc1ccc(I)cc 78 87265 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14619 1-bromoundeBrCCCCCCCCC -10 12221 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    14620 m-dibromobeBrc1cccc(Br)c -7 13875356 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14621 o-dibromobenBrc1ccccc1Br 7 13875212 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. I; Am
    14622 p-iodoanisole Ic1ccc(OC)cc1 50 62877 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14623 p-iodobenzyl_OCc1ccc(I)cc1 73 26989 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14624 p-dibromobenBrc1ccc(Br)cc 88 13868640 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14625 o-iodobenzyl_OCc1ccccc1I 92 96816 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14626 5-bromo-2-chlClc1ccc(Br)cc 154 30620 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14627 diethyl_phenyO=C(OCC)C(C( 16 59885 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14628 1-heptadecynCCCCCCCCCCC 22 124616 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14629 1,1-diphenylhCCCCCC(c1ccc -12 120771 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14630 o-chloroiodo Ic1ccccc1Cl 1 21171406 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14631 2-methyl-1-h CCCCCCCCCCC 2 455345 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14632 1-heptadecenCCCCCCCCCCC 11 21723 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14633 p-chloroiodo Ic1ccc(Cl)cc1 54 13868660 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14634 1-iodooctane CCCCCCCCI -44 11874 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    14635 3-methylhexaCC(CCCCCCCC -15 83983 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14636 2-methylhexaCC(C)CCCCCC 4 14531 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14637 heptadecane CCCCCCCCCCC 22 11892 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14638 2-hexadecanoCC(O)CCCCCC 47 77368 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14639 1-hexadecanoCCCCCCCCCCC 56 2581 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14640 p-dicyclohexyc1cc(ccc1C2C 104 63830 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14641 p-iodophenylaIc1ccc(CC#N)c 48 126037 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14642 triphenylmet c1ccccc1C(c2c 94 10169 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14643 dodecylbenzeCCCCCCCCCCC 3 28977 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14644 bromodiphen BrC(c1ccccc1) 41 206530 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14645 1,3,5-tri-tert CC(C)(C)c1cc(c 71 14361 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14646 1,2,4,5-tetra CC(C)c1cc(c(c 119 62663 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14647 2-bromododeBrC(C)CCCCC -96 88763 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14648 1-bromododeBrCCCCCCCCC -10 8579 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    14649 2,5-dibromot Brc1ccc(Br)c(C 5 11511 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14650 o-iodobenzoicOC(=O)c1cccc 162 6675 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14651 m-iodobenzoiOC(=O)c1cc(I) 187 11563 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14652 p-iodobenzoicOC(=O)c1ccc(I 273 11588 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14653 1-iodo-3-nitr Ic1cccc(c1)[N+ 38 21106127 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14654 1-iodo-2-nitr Ic1ccccc1[N+] 51 62332 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14655 2,5-dibromoanBrc1ccc(Br)c( 51 69628 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14656 2,4-dibromoanBrc1cc(Br)c(N 78 11509 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14657 2,6-dibromoanBrc1cccc(Br)c 80 21169503 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14658 1-iodo-4-nitr Ic1ccc(cc1)[N+ 173 11982 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14659 3-octadecyne CCCCCCCCCCC 2 477642 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14660 bromoform BrC(Br)Br 8 13838404 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14661 1-octadecyne CCCCCCCCCCC 27 62633 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14662 2,4-dibromopBrc1cc(Br)c(O 40 11510 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14663 11-bromo-1-uBrCCCCCCCCC 46 66773 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14664 2-methyl-1-h C=C(C)CCCCC 9 459698 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14665 1-octadecene CCCCCCCCCCC 18 7925 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14666 1-iodononaneCCCCCCCCCI -20 19101 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    14667 3-methylhept CC(CCCCCCCC -6 85124 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14668 2-methylhept CC(C)CCCCCC 6 14530 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14669 octadecane CCCCCCCCCCC 28 11145 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14670 1-heptadecanCCCCCCCCCCC 58 14348 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14671 diethyl_sebacO=C(CCCCCCC 2 7758 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14672 bis-2-phenoxyC(COc1ccccc1 66 192450 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14673 tridecylbenze CCCCCCCCCCC 10 28978 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14674 p-bromobenz O=C(c1ccc(Br) 82 6763 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14675 triphenylmethOC(c1ccccc1)( 163 6215 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14676 4-iodophenyl_O=C(C)Oc1ccc( 32 125085 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14677 3-iodophenyl_O=C(C)Oc1cccc 38 11264788 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14678 methyl_3-iod Ic1cc(ccc1)C( 54 62471 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14679 methyl_4-iod Ic1ccc(cc1)C( 115 62484 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14680 1,1,2-tribrom BrC(Br)CBr -29 59607 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    14681 1-nonadecyneCCCCCCCCCCC 33 10179251 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14682 12-bromo-1-dBrCCCCCCCCC 34 121544 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14683 2-methyl-1-o CCCCCCCCCCC 14 455346 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14684 1-nonadeceneCCCCCCCCCCC 23 27049 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14685 1-iododecaneCCCCCCCCCCI -16 15480 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    14686 3-methylocta CC(CCCCCCCC 1 99551 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14687 diiodomethanICI 6 6106 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    14688 2-methylocta CC(C)CCCCCC 15 14529 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14689 nonadecane CCCCCCCCCCC 32 11895 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14690 1-octadecanolCCCCCCCCCCC 61 7928 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14691 1,4-dichloro- Clc1ccc(Cl)c(I) 21 21171496 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14692 1,2-dichloro- Ic1cccc(Cl)c1C 35 67989 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14693 1,3-dichloro- Ic1cc(Cl)cc(Cl) 56 68896 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14694 tetradecylbenCCCCCCCCCCC 16 14358 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14695 dibutyl_phthaO=C(OCCCC)c1 -35 13837319 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14696 1,2,3-tribrom BrC(CBr)CBr 16 7007 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    14697 1-eicosyne C#CCCCCCCCC 36 12460 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14698 2,5-dibromonO=[N+]([O-])c 82 69450 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14699 2-methyl-1-n C=C(C)CCCCC 20 459699 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14700 1-eicosene C=CCCCCCCCC 29 17879 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14701 4-iodobiphenyIc1ccc(cc1)c2 114 14585 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14702 m-bromoiodoIc1cccc(Br)c1 -9 11073 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14703 1-iodoundecaCCCCCCCCCCC 2 19102 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    14704 3-methylnonaCC(CCCCCCCC 8 85125 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14705 o-bromoiodobIc1ccccc1Br 10 10935 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14706 2-methylnonaCC(C)CCCCCC 18 120790 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14707 eicosane CCCCCCCCCCC 36 7929 http://www.aAmerican Petroleum Institute. Research Project 44; Selected Values o
    14708 1,2-diiodoeth ICCI 81 11723 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    14709 p-bromoiodobIc1ccc(Br)cc1 91 11038 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14710 1,2,3-tribrom BrC(C)C(Br)CB -19 92530 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    14711 1,2,4-tribrom BrC(CCBr)CBr -18 454348 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    14712 2,3,3-tribrom BrC(C)C(Br)(Br 2 100802 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    14713 1-iodododecaCCCCCCCCCCC 0 19108 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    14714 a,a,a,a',a',a' ClC(Cl)(Cl)c1cc 109 5997 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14715 p,p'-dibromobBrc1ccc(cc1)c 170 6843 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14716 1,2,4-tribrom Brc1cc(Br)c(Br 43 11507 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14717 1,3,5-tribrom Brc1cc(Br)cc(B 124 11776 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14718 bis-p-bromop Brc2ccc(Oc1cc 60 15471 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14719 2,4,6-tribrom Brc1cc(Br)cc( 89 1438 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14720 m-diiodobenzIc1cccc(I)c1 37 21168837 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14721 1,4-diiodobenIc1ccc(I)cc1 131 11708 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14722 p,p'-dibromo O=C(c1ccc(Br) 175 65700 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14723 1,1,2,2-tetra BrC(Br)C(Br)Br 0 6339 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    14724 1,2,2,3-tetra BrC(Br)(CBr)C 11 37466 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    14725 bis-2-ethylhe CCC(CCCC)COC -50 21106505 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14726 2,4,6-triiodopIc1cc(I)c(O)c(I 158 11369 http://www. Aldrich Chemical Company; Aldrich Catalog-Handbook of Fine Chemic
    14727 2-bromo-3,3- CC(C)(C)C(Br) 25 26000633 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    14728 p-acetoxy_pheO=C(C)Oc1ccc 50 26000634 http://de.wik Beilstein F. K.; Beilsteins Handbuch der Organischen Chemie. Springer
    14729 1,3-dibromo- BrCC(CBr)CBr -32 26000635 http://www.qu
    Dreisbach R. R. Physical Properties of Chemical Compounds; Vol. III; A
    14730 (~2~H_10_)Py[2H]c4c3c2c(c( 156 5288469 http://msds.c academic website
    14731 (~2~H_12_)Ch[2H]c4c3c(c([2 255 2340889 http://msds.c academic website
    14732 (~2~H_14_)-1,1
    [2H]c1c(c([2H] 213 109743 http://msds.c academic website
    14733 (~2~H_20_)N [2H]C([2H])(C( -53 17340739 http://msds.c academic website
    14734 (~2~H_22_)De[2H]C([2H])(C( -30 2014944 http://msds.c academic website
    14735 (~2~H_3_)Met[2H]C([2H])([ -48 106152 http://msds.c academic website
    14736 (~2~H_35_)Oct
    [2H]C([2H])(C( 67 21170759 http://msds.c academic website
    14737 (~2~H_4_)Acet[2H]C([2H])([ 15.5 2006083 http://msds.c academic website
    14738 (~2~H_4_)Me[2H]C([2H])([2 -183 109692 http://msds.c academic website
    14739 (~2~H_4_)Ure[2H]N([2H])C( 136 2006156 http://msds.c academic website
    14740 (~2~H_5_)Eth[2H]C([2H])([ -114 92272 http://msds.c academic website
    14741 (~2~H_5_)Prop
    [2H]C(O[2H])( 20 21106118 http://msds.c academic website
    14742 (~2~H_6_)Ben[2H]c1c([2H])c 6.8 64671 http://msds.c academic website
    14743 (~2~H_6_)Pro[2H]C([2H])([ -93 455535 http://msds.c academic website
    14744 (~2~H_8_)Nap[2H]c2c1c([2H] 82 83193 http://msds.c academic website
    14745 (~2~H_8_)Tet[2H]C1([2H])C -106 72531 http://msds.c academic website
    14746 (11beta)-11,1 OCC(=O)[C@@ 220 5551 http://msds.c academic website
    14747 (11beta)-11,1 CC(=O)OCC(= 238 5629 http://msds.c academic website
    14748 (13Z)-Docos- NC(=O)CCCCC 79 4517399 http://msds.c academic website
    14749 (17beta)-17-EtOc3cc4CC[C@ 144 5770 http://msds.c academic website
    14750 (17beta)-17-HO=C4CC[C@@] 155 5791 http://msds.c academic website
    14751 (17beta)-EstraOc3cc4CC[C@ 173 5554 http://msds.c academic website
    14752 (1E)-1-Benzyli[O-][N+](=O)c 240 7841082 http://msds.c academic website
    14753 (1E,6E)-1,7-B Oc1ccc(cc1OC 180 839564 http://msds.c academic website
    14754 (1-HydroxyethCC(O)(P(O)(= 199 3189 http://msds.c academic website
    14755 (1R,2R,3R,4R, Cl[C@H]1[C@H 159 10468511 http://msds.c academic website
    14756 (1R,2R,3R,6S, ClC3=C(Cl)[ 104 10292747 http://msds.c academic website
    14757 (1R,2R,8S,9S)-ClC1=C(Cl)[C 181 16736500 http://msds.c academic website
    14758 (1R,2S)-2-(MeO[C@@H]([C@ 36 8935 http://msds.c academic website
    14759 (1R,2S)-Cyclo O[C@@H]1CC 32.5 2015095 http://msds.c academic website
    14760 (1R,2S,3S,6R, ClC1=C(Cl)[ 176 10292746 http://msds.c academic website
    14761 (1R,2S,5R)-2- CC(C)[C@@H] 42 15803 http://msds.c academic website
    14762 (1R,7S)-1,3,4, ClC2=C(Cl)[C@ 106.5 10128316 http://msds.c academic website
    14763 (1S)-1,5-Anhy O[C@H]1[C@H 148 14269 http://msds.c academic website
    14764 (1S)-1,7,7-Tri CC2(C)C1CC(= 179 9655 http://msds.c academic website
    14765 (1S,2S)-CyclopO[C@H]1CCC 55 9575632 http://msds.c academic website
    14766 (1S,3R,5R,6S, O[C@@H]2[C@ 290 10469496 http://msds.c academic website
    14767 (1s,4s)-1,3,3- CC2(C)O[C@] 2 21111689 http://msds.c academic website
    14768 (1S,7aR)-7-[( CC(C)(O)[C@] 97 4445050 http://msds.c academic website
    14769 (1S,7R)-1,5,7, ClC2=C(Cl)[C@ 95.5 10128317 http://msds.c academic website
    14770 (1Z,3Z)-CyclooC1C=CC=CCCC -53 264937 http://msds.c academic website
    14771 (2,3,6-Trichlo Clc1c(CC(=O)O 156 6546 http://msds.c academic website
    14772 (2,4-DichloropClc1cc(Cl)ccc 138 1441 http://msds.c academic website
    14773 (2,4-Dinitrop NNc1ccc(cc1[N 201 3001507 http://msds.c academic website
    14774 (2-{(E)-2-[4- CN(C)c2ccc(/ 212 599702 http://msds.c academic website
    14775 (2alpha,5betaO=C(N[C@@H] 214.5 10368587 http://msds.c academic website
    14776 (2-Amino-5-c Nc2ccc(Cl)cc2 96 12339 http://msds.c academic website
    14777 (2'beta)-22-O O=C(OC)[C@@ 219 5758 http://msds.c academic website
    14778 (2-ChlorobenzClc1ccccc1/C 95 16644 http://msds.c academic website
    14779 (2E)-2-(Hydro OC(C(=NO)c1c 154 4510333 http://msds.c academic website
    14780 (2E)-2,3-Dibr Br/C(CO)=C(/ 113 556543 http://msds.c academic website
    14781 (2E)-2,3-DipheOC(=O)/C(=C/c 173 610577 http://msds.c academic website
    14782 (2E)-3-[4-(Di CN(C)c1ccc(/ 135 4447567 http://msds.c academic website
    14783 (2E)-3-Phenyl O=CC=Cc1cccc -7 553117 http://msds.c academic website
    14784 (2E)-3-PhenylaO=C(O)/C=C/c 133 392447 http://msds.c academic website
    14785 (2E)-3-Phenyl OCC=Cc1ccccc 30 21105870 http://msds.c academic website
    14786 (2E)-3-Phenyl Nc2ccccc2C(= 61 4447445 http://msds.c academic website
    14787 (2E)-But-2-enaCC=CC=O -76 394562 http://msds.c academic website
    14788 (2E)-But-2-en CC=CC -105 56442 http://msds.c academic website
    14789 (2E)-But-2-eneN#CC=CC#N 97 553503 http://msds.c academic website
    14790 (2E)-Pent-2-e CC=CCC -140 4483639 http://msds.c academic website
    14791 (2E,4E)-Hexa-2CC=CC=CC(=O 134 558605 http://msds.c academic website
    14792 (2-NitrophenylO=[N+]([O-]) 84 11395 http://msds.c academic website
    14793 (2R)-2,5,7,8-T CC(=O)Oc2c(C 28 77987 http://msds.c academic website
    14794 (2R)-2,5,7,8-T CC(C)CCC[C@@ 2 14265 http://msds.c academic website
    14795 (2R)-2-{(2R,5SO=C(O)[C@H] 113 2342058 http://msds.c academic website
    14796 (2R)-3-(Benzy OC[C@@H](O) 27.5 2006914 http://msds.c academic website
    14797 (2R)-Hydroxy(O[C@@H](C(= 132 11420 http://msds.c academic website
    14798 (2R,3R)-2,3-DiO=C(O)[C@H] 171 392277 http://msds.c academic website
    14799 (2R,3R)-Butane
    C[C@@H](O)[ 16 196452 http://msds.c academic website
    14800 (2R,3S)-ButaneOC[C@@H](O 122 192963 http://msds.c academic website
    14801 (2R,3S)-ButaneC[C@@H](O)[ 33 190756 http://msds.c academic website
    14802 (2R,3S,4R,5R, CN(C)[C@H]3 114 10482163 http://msds.c academic website
    14803 (2R,6aS,12aS)C=C(C)[C@@H 165.5 6500 http://msds.c academic website
    14804 (2S,3R,4S,6R) CCCCCCCCCCC 102 10482181 http://msds.c academic website
    14805 (2S,3S)-2,3-Di O=C(O)[C@@H 173 388726 http://msds.c academic website
    14806 (2Z)-4-Amino-NC(=O)/C=CC( 159.5 4444106 http://msds.c academic website
    14807 (2Z)-But-2-eneO=C(O)/C=CC 138 392248 http://msds.c academic website
    14808 (2Z)-Pent-2-e CC=C/CC -180 4483638 http://msds.c academic webx clearly out of range (7 NIST values) JCB
    14809 (2Z,3Z)-N,N'- CC(=NO)C(/C) 238 10466342 http://msds.c academic website
    14810 (2Z,5alpha,17 O=C3C[C@@H] 179 4444502 http://msds.c academic website
    14811 (3,4-DimethoxCOc1cc(ccc1O 98 6872 http://msds.c academic website
    14812 (3beta)-CholesCC(C)CCC[C@ 149 5775 http://msds.c academic website
    14813 (3beta,22E)-ErCC(C)[C@@H] 160 392539 http://msds.c academic website
    14814 (3-Chloropheny
    Clc1cc(CC#N)c 11.5 66365 http://msds.c academic website
    14815 (3E)-Hex-3-enCCC=CCCO -61.5 4447565 http://msds.c academic website
    14816 (3-PhenoxyphOCc2cc(Oc1cc 10 24499 http://msds.c academic website
    14817 (3Z)-3-(Hydro CC(=O)C(/C)= 75 4911379 http://msds.c academic website
    14818 (4-Aminopheny
    O=[As](O)(O)c 232 7111 http://msds.c academic webx metal
    14819 (4-AminophenOCc1ccc(N)cc 61 62540 http://msds.c academic website
    14820 (4-Chloro-2-n NNc1ccc(Cl)cc 134 2502246 http://msds.c academic website
    14821 (4-ChlorophenOCc1ccc(Cl)cc 71 12823 http://msds.c academic website
    14822 (4E)-4-[(2-Me [O-][N+](=O)c 335 5006103 http://msds.c academic website
    14823 (4-MethylpheCc1ccc(cc1)C( 57 8330 http://msds.c academic website
    14824 (4R,4aS,6R)-4 C=C(C)[C@@H 36 1064812 http://msds.c academic website
    14825 (5alpha,6alphCOc1ccc2C[C 155 4447447 http://msds.c academic website
    14826 (5S)-2-MethylCC1=CC[C@@H 89 15855 http://msds.c academic website
    14827 (6alpha)-6-MeCC(=O)[C@@] 208 6043 http://msds.c academic website
    14828 (6aR,11bS)-7, Oc2cc3C[C@]4 140 284102 http://msds.c academic website
    14829 (6aR,9aS)-4-MO=C2Oc1c4c( 268.5 162470 http://msds.c academic website
    14830 (6E)-N-(4-HydOc1ccc(cc1OC 66 1265957 http://msds.c academic website
    14831 (8alpha,9R)-C O[C@H](c2cc 200 91930 http://msds.c academic website
    14832 (8beta)-N,N-DCCN(CC)C(=O) 82.5 5558 http://msds.c academic website
    14833 (9S)-CinchonaO[C@@H](c2c 265 81667 http://msds.c academic website
    14834 (9Z,12Z)-Octa O=C(O)CCCCC -5 4444105 http://msds.c academic website
    14835 (BromomethylBrCc1ccccc1 -3 13851576 http://msds.c academic website
    14836 (DiphenylphosO=P(C(=O)c1c( 90 145710 http://msds.c academic website
    14837 (E)-1,2-Dichl ClC=CCl -50 553742 http://msds.c academic website
    14838 (E)-Diphenyld N(=N/c1ccccc1 68.5 2185 http://msds.c academic website
    14839 (E)-N',2-Diph S=C(NNc1cccc 168 571406 http://msds.c academic website
    14840 (E)-N-[(6-Chl Clc1ccc(CN(CC 72 2298774 http://msds.c academic website
    14841 (PentafluoropFc1c(c(F)c(F)c 37.5 66396 http://msds.c academic website
    14842 (TrichlorometClC(Cl)(Cl)c1c -5 13882366 http://msds.c academic website
    14843 (Trifluoromet FC(F)(F)c1cccc -27 7090 http://msds.c academic website
    14844 (TriphenylphoO=CC=P(c1cccc 186.5 67603 http://msds.c academic website
    14845 (Vinylsulfonyl C=CS(=O)(=O) -26 6251 http://msds.c academic website
    14846 (Z)-1,2-Dichl ClC=C/Cl -80 558928 http://msds.c academic website
    14847 [(E)-2-Nitrovi [O-][N+](=O)/ 58 4447524 http://msds.c academic website
    14848 [5-Chloro-2-( CNc1ccc(Cl)cc 94 13323 http://msds.c academic website
    14849 [Disulfanediyl CN(C)C(=S)SSC 155.5 5256 http://msds.c academic website
    14850 [Nitrilotris(m OP(=O)(O)CN( -14 15833 http://msds.c academic webx aqueous solution JCB
    14851 1-({5-[(3aS,4 O=C2N[C@@H] 212 5142865 http://msds.c academic website
    14852 1-(2-FluoropheOC(Cn1cncn1)( 130 82827 http://msds.c academic website
    14853 1-(2-Furyl)et CC(=O)c1ccco 29.5 13849 http://msds.c academic website
    14854 1-(2-NitropheO=[N+]([O-])c 23 10868 http://msds.c academic website
    14855 1-(3,5-Difluo Fc1cc(cc(F)c1 127 453123 http://msds.c academic website
    14856 1-(3-Hydroxy Oc1cc(ccc1OC 89.5 86383 http://msds.c academic website
    14857 1-(3-NitropheO=[N+]([O-])c 81 21106145 http://msds.c academic website
    14858 1-(4-tert-ButyO=[N+]([O-])c 135.5 6417 http://msds.c academic website
    14859 1-(ChloromethCc1ccccc1CCl -2 21106134 http://msds.c academic website
    14860 1-(ChloromethO=[N+]([O-])c 47 11427 http://msds.c academic website
    14861 1-(ChloromethO=[N+]([O-])c 71 7202 http://msds.c academic website
    14862 1-(Diethylami CCN(CC)C(C)O -70 10617374 http://msds.c academic website
    14863 1-(Morpholin-4
    OS(=O)(=O)C( 243 9666901 http://msds.c academic website
    14864 1-(Pentyloxy) CCCCCOCCCC -69 12220 http://msds.c academic website
    14865 1-(Pyridin-2-y Oc2ccc3ccccc 139.5 17967090 http://msds.c academic website
    14866 1-(Triphenylp CC(=O)C=P(c1c 204 14313 http://msds.c academic website
    14867 1,1'-(2,2,2-Tr Clc1ccc(cc1)C( 108.5 2928 http://msds.c academic website
    14868 1,1'-(2,2,2-Tr COc1ccc(cc1)C 87 3972 http://msds.c academic website
    14869 1,1'-(2,2-Dich Clc1ccc(cc1)C( 109 6057 http://msds.c academic website
    14870 1,1'-(Dioxydi CC(C)(OOC(C)( 40 6389 http://msds.c academic website
    14871 1,1'-(E)-EthenC(=C/c1ccccc1 123 553649 http://msds.c academic website
    14872 1,1',1''-(Bro BrC(c1ccccc1) 153 11200 http://msds.c academic website
    14873 1,1',1'',1'''-[ CCN(CC)C(=S) 70 3005 http://msds.c academic website
    14874 1,1,1,2,2,3,3, FC(F)(C(F)(F)CC 82.5 67448 http://msds.c academic website
    14875 1,1,1,2,2-Pen ClC(Cl)C(Cl)(Cl -29 6179 http://msds.c academic website
    14876 1,1,1,2,2-Pen FC(F)C(F)(F)F -103 9256 http://msds.c academic website
    14877 1,1,1,2,3,3,3 FC(F)(F)C(F)C( -131 61257 http://msds.c academic website
    14878 1,1,1,2-Tetra ClCC(Cl)(Cl)Cl -70 11911 http://msds.c academic website
    14879 1,1,1,2-Tetra FCC(F)(F)F -101 12577 http://msds.c academic website
    14880 1,1,1,3,3,3-H FC(F)(F)C(=O)C -129 13846015 http://msds.c academic website
    14881 1,1,1,3,3,3-H FC(F)(F)C(O)C( -3 12941 http://msds.c academic website
    14882 1,1,1,3,3,3-H FC(F)(F)CC(F)( -98 12199 http://msds.c academic website
    14883 1,1',1''-Methac1ccccc1C(c2c 94 10169 http://msds.c academic website
    14884 1,1',1''-Phosp S=P(N1CC1)( 51.5 5254 http://msds.c academic website
    14885 1,1,1-Trichlo CC(Cl)(Cl)Cl -33 6042 http://msds.c academic website
    14886 1,1,1-Trifluor CC(F)(F)F -111 9484 http://msds.c academic website
    14887 1,1,1-Trifluo O=S(=O)(NS(=O 51.5 138894 http://msds.c academic website
    14888 1,1,2,2,3,3,4, FC(F)(C(F)(F)C( -9 71326 http://msds.c academic website
    14889 1,1,2,2-Tetra BrC(Br)C(Br)Br 0 6339 http://msds.c academic website
    14890 1,1,2,2-Tetra ClC(Cl)C(Cl)Cl -43 6342 http://msds.c academic website
    14891 1,1,2,2-Tetra OC(c1ccccc1)( 171 85502 http://msds.c academic website
    14892 1,1,2,3,4,4-H Cl/C(Cl)=C(Cl) -21 6635 http://msds.c academic website
    14893 1,1,2-Trichlor ClC(F)(F)C(Cl)( -35 6188 http://msds.c academic website
    14894 1,1,2-Trichlo ClCC(Cl)Cl -35 6326 http://msds.c academic website
    14895 1,1,2-Trichlo ClC=C(/Cl)Cl -85 13837280 http://msds.c academic website
    14896 1,1':4',1''-Ter c1cc(ccc1)c2c 213 6848 http://msds.c academic website
    14897 1,1'-Bi(cycloh C1CC(CCC1)C 4 6827 http://msds.c academic website
    14898 1,1'-Buta-1,3-C(C=Cc1ccccc 152 12876 http://msds.c academic website
    14899 1,1-DiethoxyeCC(OCC)OCC -100 13835836 http://msds.c academic website
    14900 1,1-DiphenylgNC(=N)N(c1ccc 150 13990 http://msds.c academic website
    14901 1,1'-Ethyne-1 C(#Cc1ccccc1) 60 9961 http://msds.c academic website
    14902 1,1'-MethylenO=C=Nc1ccc(c 37.2 7289 http://msds.c academic website
    14903 1,2,3,4,5,5-H ClC=1C(Cl)=C(C -9 6233 http://msds.c academic website
    14904 1,2,3,4,5,6-H ClC1C(Cl)C(Cl) 113 707 http://msds.c academic website
    14905 1,2,3,4,5-Pe Brc1c(C)c(Br)c 288 6640 http://msds.c academic website
    14906 1,2,3,4,5-Pen Clc1c(c(Cl)c(C 141.5 6464 http://msds.c academic website
    14907 1,2,3,4,5-Pen Fc1cc(F)c(F)c( -48 13866746 http://msds.c academic website
    14908 1,2,3,4,6-Pen O=C(O[C@@H]9 210 17286569 http://msds.c academic website
    14909 1,2,3,4-Tetra Clc2c1ccccc1c( 182 27793 http://msds.c academic website
    14910 1,2,3,4-Tetra Fc1ccc(F)c(F)c -42 21106162 http://msds.c academic website
    14911 1,2,3,4-Tetra c1ccc2CCCCc2 -31 8097 http://msds.c academic website
    14912 1,2,3-TrimethCc1cccc(C)c1C -25 10236 http://msds.c academic website
    14913 1,2,4,5-Tetra Clc1cc(Cl)c(Cl 139 21106163 http://msds.c academic website
    14914 1,2,4-Trichlo Clc1cc(Cl)c(Cl 17 13862559 http://msds.c academic website
    14915 1,2,4-TrimethCc1cc(C)c(C)c -43.8 6977 http://msds.c academic website
    14916 1,2-Dibromo-4BrC1CCC(CC1B 70 17684 http://msds.c academic website
    14917 1,2-Dichloro- Clc1ccc(cc1Cl) 39 21106095 http://msds.c academic website
    14918 1,2-Difluorob Fc1ccccc1F -34 9325 http://msds.c academic website
    14919 1,2-DihydroacOC3Cc2cccc1c 147.5 21327 http://msds.c academic website
    14920 1,2-Dihydroa c1cc2cccc3CCc 95 6478 http://msds.c academic website
    14921 1,2-DihydroxyO=C3c1ccccc1 281 6056 http://msds.c academic website
    14922 1,2-DiiodoethICCI 80 11723 http://msds.c academic website
    14923 1,2-Dimethox COCCOC -58 13836589 http://msds.c academic website
    14924 1,2-Dimethyl-Cc2cc1ccccc1 56.5 12834 http://msds.c academic website
    14925 1,2-Dimethyl-Cc1ccc(cc1C)[ 30.5 7162 http://msds.c academic website
    14926 1,2-DimethylhCNNC -9 1282 http://msds.c academic website
    14927 1,2-DiphenylhN(Nc1ccccc1)c 125 28962 http://msds.c academic website
    14928 1,2-O-[(1R)-2,OC[C@@H](O) 187 5414376 http://msds.c academic website
    14929 1,2-Oxathiola O=S1(=O)CCC 32 13626 http://msds.c academic website
    14930 1,3,5-Triallyl- C=CCN1C(=O) 24 13329 http://msds.c academic website
    14931 1,3,5-Triazine Nc1nc(N)nc(N 345 7667 http://msds.c academic website
    14932 1,3,5-Trichlor ClN1C(=O)N(C 249 6643 http://msds.c academic website
    14933 1,3,5-Trichlo COc1c(Cl)cc(Cl 61 6620 http://msds.c academic website
    14934 1,3,5-Trichlo O=[N+]([O-])c1 72 27183 http://msds.c academic website
    14935 1,3,5-Trinitro O=[N+]([O-])N 205 8177 http://msds.c academic website
    14936 1,3,5-Tris(2-h OCCN1C(=O)N 138 12726 http://msds.c academic website
    14937 1,3,7-TrimethO=C2c1n(C)cn 237 2424 http://msds.c academic website
    14938 1,3-Benzothiac1cccc2scnc1 2 6952 http://msds.c academic website
    14939 1,3-BenzothiazSc1nc2ccccc2 179 608157 http://msds.c academic website
    14940 1,3-Dibromo- Brc1cc(OC)cc( 41.5 9196994 http://msds.c academic website
    14941 1,3-DibromopBrCCCBr -34 7710 http://msds.c academic website
    14942 1,3-Dichloro-1ClN1C(=O)NC( 225 15857 http://msds.c academic website
    14943 1,3-Dichloro- O=C1N(Cl)C(=O 135 8057 http://msds.c academic website
    14944 1,3-Dichlorob Clc1cccc(Cl)c1 -24.8 13857694 http://msds.c academic website
    14945 1,3-Difluoro- Fc1cc(F)cc(c1) 17 67815 http://msds.c academic website
    14946 1,3-DihydroxyOCC(=O)CO 75 650 http://msds.c academic website
    14947 1,3-Diisocyan O=C=N/c1cccc 20 6773 http://msds.c academic website
    14948 1,3-Dimethyl-Cc1cccc(C)c1[ 15 6420 http://msds.c academic website
    14949 1,3-Dimethyl-O=C2c1ncnc1N 273 2068 http://msds.c academic website
    14950 1,3-Dinitrobe O=[N+]([O-])c 89 7172 http://msds.c academic website
    14951 1,3-Dinitrona [O-][N+](=O)c 147 11325 http://msds.c academic website
    14952 1,3-Dioxane C1CCOCO1 -42 10018 http://msds.c academic website
    14953 1,3-DiphenylaO=C(Cc1ccccc 32 21105887 http://msds.c academic website
    14954 1,3-DiphenylpO=C(CC(=O)c1 77 8126 http://msds.c academic website
    14955 1,3-Diphenylt S=C(Nc1ccccc 154 610932 http://msds.c academic website
    14956 1,3-DiphenyluO=C(Nc1ccccc 238 7314 http://msds.c academic website
    14957 1,3-Thiazolidi O=C(O)C1CSC 195 9546 http://msds.c academic website
    14958 1,4,5,6,7,7-HeClC2(Cl)C1(Cl 240.5 7968 http://msds.c academic website
    14959 1,4,5,8-Tetra Nc3ccc(N)c2C( 332 16272 http://msds.c academic website
    14960 1,4-Anhydro-6O[C@H](COC( 57 16736467 http://msds.c academic website
    14961 1,4-Benzoqui O=C1C=CC(=O 114 4489 http://msds.c academic website
    14962 1,4-DibromobBrc1ccc(Br)cc 88 13868640 http://msds.c academic website
    14963 1,4-DibromobBrCCCCBr -20 7765 http://msds.c academic website
    14964 1,4-Dichloro- COc1cc(Cl)c(c 134 16623 http://msds.c academic website
    14965 1,4-Dichlorob Clc1ccc(Cl)cc1 53 13866817 http://msds.c academic website
    14966 1,4-Dichlorob ClCCCCCl -38 21106032 http://msds.c academic website
    14967 1,4-Diisocyan O=C=Nc1ccc(c 94 54970 http://msds.c academic website
    14968 1,4-Dimethox COc1ccc(OC)c 58 21105878 http://msds.c academic website
    14969 1,4-Dioxane C1COCCO1 11.8 29015 http://msds.c academic website
    14970 1,4-Dithiane C1CSCCS1 111 10020 http://msds.c academic website
    14971 1,4-NaphthoqO=C2C=CC(=O) 126.5 8215 http://msds.c academic website
    14972 1,5-Dimethyl-O=C2C=C(C)N( 110 2121 http://msds.c academic website
    14973 1,5-DiphenylpO=C(C=Cc1ccc 111 86113 http://msds.c academic website
    14974 1,6-DibromohBrCCCCCCBr 2 11862 http://msds.c academic website
    14975 1,6-Diisocyan O=C=NCCCCC -55 12637 http://msds.c academic website
    14976 1,6-DiphenylhO=C(CCCCC(=O 107 69354 http://msds.c academic website
    14977 1,7,7-TrimethCC2(C)C1CC(= 177 2441 http://msds.c academic website
    14978 1,8-DibromooBrCCCCCCCCB 15.5 70682 http://msds.c academic website
    14979 1,8-Dihydroxy[O-][N+](=O)c 225 2623724 http://msds.c academic website
    14980 1,8-DihydroxyOc2cccc1Cc3c 181 2117 http://msds.c academic website
    14981 1,8-Dinitrona [O-][N+](=O)c 171.5 11271 http://msds.c academic website
    14982 1-[(2S)-2-MethOC(=O)[C@@H 106 40130 http://msds.c academic website
    14983 1-[(4-Methyl- [O-][N+](=O) 271 21106027 http://msds.c academic website
    14984 1-[(E)-(4-Nitr [O-][N+](=O)c 250 13544963 http://msds.c academic website
    14985 1-[(E)-{2-MethCc4ccccc4/N= 199 11252033 http://msds.c academic website
    14986 1-[(E)-{4-[(Z) Oc4ccc1ccccc 199 16736189 http://msds.c academic website
    14987 1-[(E)-PhenyldOc3ccc1ccccc 132 10296256 http://msds.c academic website
    14988 1-[2-(Ethylsul O=S(=O)(CCn1c 127.5 5279 http://msds.c academic website
    14989 1-{[2-(4-Etho CCOc1ccc(cc1) 36 64377 http://msds.c academic website
    14990 1-{[3-(2-Chlor Fc1ccc(cc1)C4 125 2564795 http://msds.c academic website
    14991 10-PhenyldecaOCCCCCCCCCC 36 494547 http://msds.c academic website
    14992 12-Hydroxydod
    O=C(O)CCCCC 86.5 71366 http://msds.c academic website
    14993 12-HydroxyoctO=C(O)CCCCC 80.5 7501 http://msds.c academic website
    14994 1-Allylthioure NC(=S)NCC=C 71 1266393 http://msds.c academic website
    14995 1-Amino-2,4- O=C2c1ccccc1C 226 6429 http://msds.c academic website
    14996 1-Amino-2-meO=C3c1ccccc1 205 6447 http://msds.c academic website
    14997 1-Amino-3-phNCC(O)COc1cc 146 2007180 http://msds.c academic website
    14998 1-Amino-9,10O=C3c1ccccc1 250 6454 http://msds.c academic website
    14999 1-AminopropaCC(O)CN -2 3 http://msds.c academic website
    15000 1-Bromo-4-meCc1ccc(Br)cc1 28.5 13875258 http://msds.c academic website
    15001 1-Chloro-1,1- CC(Cl)(F)F -131 6148 http://msds.c academic website
    15002 1-Chloro-1-fl C=C(Cl)F -169 67881 http://msds.c academic website
    15003 1-Chloro-2-(2 ClCCOCCCl -47 21106016 http://msds.c academic website
    15004 1-Chloro-2-(t FC(F)(F)c1cccc -7.4 6655 http://msds.c academic website
    15005 1-Chloro-2,4- O=[N+]([O-])c 53 13868426 http://msds.c academic website
    15006 1-Chloro-2-is ClCCN=C=O 135 15227 http://msds.c academic website
    15007 1-Chloro-2-ni O=[N+]([O-])c 32 13853953 http://msds.c academic website
    15008 1-Chloro-3-m Cc1cc(Cl)ccc1 -48 13875230 http://msds.c academic website
    15009 1-Chloro-3-ni O=[N+]([O-])c 45 21106013 http://msds.c academic website
    15010 1-Chloro-4-(t FC(F)(F)c1ccc( -36 7116 http://msds.c academic website
    15011 1-Chloro-4-m COc1ccc(Cl)cc -18 11667 http://msds.c academic website
    15012 1-Chloro-4-m Cc1ccc(Cl)cc1 7.5 13875160 http://msds.c academic website
    15013 1-Chloro-4-ni O=[N+]([O-])c 83.6 21106020 http://msds.c academic website
    15014 1-Chloroacet CC(=O)CCl -44.5 6323 http://msds.c academic website
    15015 1-Chlorobut-2CC=CCCl -65 11101 http://msds.c academic website
    15016 1-Chlorobuta CCCCCl -123 7714 http://msds.c academic website
    15017 1-Chlorohexa CCCCCCCl -94 10526 http://msds.c academic website
    15018 1-ChloronaphClc2cccc1cccc -21.5 6737 http://msds.c academic website
    15019 1-Chloroprop CCCCl -122 10437 http://msds.c academic website
    15020 1-CyanoguaniN=C(N)NC#N 208 9611 http://msds.c academic website
    15021 1-Ethoxy-2-(2 CCOCCOCCOC -44 21106583 http://msds.c academic website
    15022 1-Ethoxy-4-ni CCOc1ccc(cc1) 58 7214 http://msds.c academic website
    15023 1-Ethoxybuta CCOCCCC -103 11849 http://msds.c academic website
    15024 1-Ethyl-1H-pyO=C1C=CC(=O 44 4209 http://msds.c academic website
    15025 1-Ethyl-7-methO=C(O)C2=CN( 229.5 4268 http://msds.c academic website
    15026 1-Fluoro-2,4- Fc1ccc(cc1[N+ 27 21106037 http://msds.c academic website
    15027 1-Fluoro-4-ni Fc1ccc(cc1)[N 21 13856885 http://msds.c academic website
    15028 1-FluoronaphtFc2cccc1ccccc -13 9078 http://msds.c academic website
    15029 1H-1,2,3-Triazc1cnnn1 167 60839 http://msds.c academic webx clearly out of range JCB
    15030 1H-1,2,4-Tria Nc1ncnn1 159 1577 http://msds.c academic website
    15031 1H-Benzimidac1cccc2ncnc1 171 5593 http://msds.c academic website
    15032 1H-BenzimidazSc1nc2ccccc2 303 616466 http://msds.c academic website
    15033 1H-BenzotriazOn2nnc1ccccc 159 68282 http://msds.c academic website
    15034 1H-Benzotriazc1cccc2nnnc1 97 6950 http://msds.c academic website
    15035 1H-Imidazole c1cncn1 90 773 http://msds.c academic website
    15036 1H-Indole c1cccc2nccc1 52 776 http://msds.c academic website
    15037 1H-Indole-2,3O=C1c2ccccc 200 6787 http://msds.c academic website
    15038 1H-Phenalen- O=C3C=Cc2ccc 154.5 10582 http://msds.c academic website
    15039 1H-Pyrrole c1cccn1 -23 7736 http://msds.c academic website
    15040 1-HydroxyaceCC(=O)CO -17 21106125 http://msds.c academic website
    15041 1-HydroxypropCC(=C)C(=O)O -58 11274048 http://msds.c academic website
    15042 1-HydroxypyrrO=C1CCC(=O) 96.5 72416 http://msds.c academic website
    15043 1-Iodo-2-nitr Ic1ccccc1[N+] 50 62332 http://msds.c academic website
    15044 1-Iodo-3-nitr Ic1cccc(c1)[N+ 37 21106127 http://msds.c academic website
    15045 1-Iodo-4-nitr Ic1ccc(cc1)[N+ 176 11982 http://msds.c academic website
    15046 1-Iodobutane CCCCI -103 10497 http://msds.c academic website
    15047 1-IodohexadeCCCCCCCCCCC 22 10541 http://msds.c academic website
    15048 1-IodopropanCCCI -101 31029 http://msds.c academic website
    15049 1-Isobutyl-1H CC(C)Cn3cnc2 293 51809 http://msds.c academic website
    15050 1-IsocyanatonO=C=Nc2cccc1 4 59958 http://msds.c academic website
    15051 1-Isopropyl-4 Cc1ccc(cc1)C( -68 7183 http://msds.c academic website
    15052 1-Isothiocyan S=C=Nc2cccc1 58 10609 http://msds.c academic website
    15053 1-Methoxy-2-COc1ccccc1[N+ 9.4 6781 http://msds.c academic website
    15054 1-Methoxy-4-[COc1ccc(/C=C 21 553166 http://msds.c academic website
    15055 1-Methoxy-4-COc1ccc(cc1)[ 48 21106148 http://msds.c academic website
    15056 1-MethoxyproCC(O)COC -97 7612 http://msds.c academic website
    15057 1-Methyl-1H-iCn1ccnc1 -60 1348 http://msds.c academic webx other methyl and dimethylimidazole isom
    15058 1-Methyl-1-niNC(=O)N(C)N 121 12177 http://msds.c academic website
    15059 1-Methyl-2,4-Cc1ccc(cc1[N+ 68.5 8150 http://msds.c academic website
    15060 1-Methyl-2-niCc1ccccc1[N+] -10 21106144 http://msds.c academic website
    15061 1-Methyl-2-niCc1ccccc1N=O 73.5 11415 http://msds.c academic website
    15062 1-Methyl-3-niCc1cc(ccc1)[N 15.5 21106146 http://msds.c academic website
    15063 1-Methyl-4-niCc1ccc(cc1)[N 51 13863774 http://msds.c academic website
    15064 1-Methyl-4-phCN1CC=C(CC1) 38.5 1346 http://msds.c academic website
    15065 1-Methyl-4-vi Cc1ccc(C=C)cc -72.5 11661 http://msds.c academic website
    15066 1-Methylcycl CC=1CCCCC=1 0 11086 http://msds.c academic webx clearly out of range JCB
    15067 1-MethylnaphCc2cccc1cccc -22 6736 http://msds.c academic website
    15068 1-MethylpyrroO=C1CCCN1C -23 12814 http://msds.c academic website
    15069 1-Naphthoic aO=C(O)c2cccc 162 6586 http://msds.c academic website
    15070 1-Naphthol Oc2cccc1cccc 95 6739 http://msds.c academic website
    15071 1-Naphthoyl cClC(=O)c2cccc 26 63334 http://msds.c academic website
    15072 1-Naphthyl mCNC(=O)Oc2cc 142 5899 http://msds.c academic website
    15073 1-Nitro-3-vin O=[N+]([O-])c -5 61789 http://msds.c academic website
    15074 1-Nitro-4-(tr O=[N+]([O-])c1 39 9438 http://msds.c academic website
    15075 1-Nitronaphth[O-][N+](=O)c 61.5 6588 http://msds.c academic website
    15076 1-PhenylethanCC(O)c1ccccc 20 7131 http://msds.c academic website
    15077 1-Phenyletha CC(=O)c1cccc 19 7132 http://msds.c academic website
    15078 1-PhenylmethNCc1ccccc1 -46 7223 http://msds.c academic website
    15079 1-PhenylpyrazO=C1CCN(N1)c 122 6823 http://msds.c academic website
    15080 1-PhenylthiouS=C(N)Nc1ccc 149 589165 http://msds.c academic website
    15081 1-tert-Butyl- Cc1ccc(cc1)C( -52 7112 http://msds.c academic website
    15082 1-VinylazepanC=CN1CCCCC 34 67772 http://msds.c academic website
    15083 2-(1,3-Thiazoln1c3ccccc3nc 304.5 5237 http://msds.c academic website
    15084 2-(1-NaphthylO=C(O)c1cccc 203 8275 http://msds.c academic website
    15085 2-(2,4,5,7-Te O=C(O)c4cccc 300 10581 http://msds.c academic website
    15086 2-(2,4,5-Tric Clc1cc(OC(C)C 176 6891 http://msds.c academic website
    15087 2-(2,4-Dinitro [O-][N+](=O)c 92 64018 http://msds.c academic website
    15088 2-(2,6-DioxopiO=C1NC(=O)C 270 5233 http://msds.c academic website
    15089 2-(2-ButoxyetCCCCOCCOCC -68 13839549 http://msds.c academic website
    15090 2-(2-ButoxyetCCCCOCCOCCO -32 29028 http://msds.c academic website
    15091 2-(2-Ethoxyet OCCOCCOCC -76 13839107 http://msds.c academic website
    15092 2-(2-EthylbenzNc2ccccc2Cc1 35 16309679 http://msds.c academic website
    15093 2-(2-MethoxyOCCOCCOC -70 13839440 http://msds.c academic website
    15094 2-(2-MethoxypCC(OC)COC(C -83 23783 http://msds.c academic website
    15095 2-(2-Methyl-5-Cc1ncc([N+]( 160 4029 http://msds.c academic website
    15096 2-(2-NitropheO=[N+]([O-]) 2 25177 http://msds.c academic website
    15097 2-(4-Isobutyl CC(C(=O)O)c1c 77.5 3544 http://msds.c academic website
    15098 2-(4-IsopropylCC1(N=C(NC1= 171.5 49445 http://msds.c academic website
    15099 2-(4-NitropheO=[N+]([O-])c 63 7213 http://msds.c academic website
    15100 2-(BromomethBrCC1CO1 -40 17406 http://msds.c academic website
    15101 2-(ChloromethClCC1CO1 -26 13837112 http://msds.c academic webx unlikely to be higher mp than bromo anal
    15102 2-(DimethylamCN(C)CCO -70 13854944 http://msds.c academic website
    15103 2-(HydroxymetOCc2ccccc2O 199 388601 http://msds.c academic website
    15104 2-(MethylaminOC(CNC)c1ccc 75 889 http://msds.c academic website
    15105 2-(MethylaminOC(C(C)NC)c1 36 4856 http://msds.c academic website
    15106 2-(Methylami CNCCO -4.5 13836021 http://msds.c academic website
    15107 2-(Trifluorom FC(F)(F)c1ccc 45.5 61273 http://msds.c academic website
    15108 2,2'-(1,4-Phe Cc2nc(oc2c1cc 232 68961 http://msds.c academic website
    15109 2,2'-(Methyli OCCN(C)CCO -21 7479 http://msds.c academic website
    15110 2,2',2'',2'''- O=C(O)CN(CC( 210 65838 http://msds.c academic website
    15111 2,2',2''-Nitril OCCN(CCO)CC 19.5 13835630 http://msds.c academic website
    15112 2,2,2-Trichlor OC(c1ccc(Cl)cc 78.5 7970 http://msds.c academic website
    15113 2,2,2-Trichlor ClC(Cl)(Cl)C( 87.5 6741 http://msds.c academic website
    15114 2,2,2-Trichlo ClC(Cl)(Cl)C(N 142 55091 http://msds.c academic website
    15115 2,2,2-Trichlor ClC(Cl)(Cl)C(O 57 2606 http://msds.c academic website
    15116 2,2,2-Trifluor FC(F)(F)CO -43.5 21106169 http://msds.c academic website
    15117 2,2,3,3-Tetraf FC(F)C(F)(F)C -15 21106164 http://msds.c academic website
    15118 2,2,4,4,6,6,8 C[Si]1(C)O[Si] -44 10451 http://msds.c academic website
    15119 2,2,4,4,6,6,8, C[Si]1(C)O[Si] 17.5 10696 http://msds.c academic website
    15120 2,2,4,4,6,6-HeC[Si]1(C)O[Si] 60 10452 http://msds.c academic website
    15121 2,2,4-TrimethCC(C)CC(C)(C) -107 10445 http://msds.c academic website
    15122 2,2'-[Ethane-1OCCOCCOCCO -4 13835895 http://msds.c academic website
    15123 2,2'-[Oxybis(eOCCOCCOCCO -6 7908 http://msds.c academic website
    15124 2,2-Dibromo- BrC(Br)(C#N) 123.5 23422 http://msds.c academic website
    15125 2,2-Dichloro-1ClC(Cl)C(F)(F) -35 3973 http://msds.c academic website
    15126 2,2-DimethoxyCOC(OC)(C(=O) 66 81777 http://msds.c academic website
    15127 2,2-Dimethox CC(C)(OC)OC -47 21106033 http://msds.c academic website
    15128 2,2-Dimethyl-CC2(C)C(=C)C 50 6364 http://msds.c academic website
    15129 2,2-Dimethyl CC(C)(C)CC -100 6163 http://msds.c academic website
    15130 2,2-DimethylpCC(C)(CO)CO 125 13835293 http://msds.c academic website
    15131 2,2-DiphenyleOCC(c1ccccc1) 54.5 67237 http://msds.c academic website
    15132 2,2'-Iminodie OCCNCCO 28 13835604 http://msds.c academic website
    15133 2,2'-Methylene
    Clc2c(Cc1c(O)c 164 3472 http://msds.c academic website
    15134 2,2'-MethylenOc2ccc(Cl)cc2 170 2929 http://msds.c academic website
    15135 2,2'-SulfanediOCCSCCO -10 13881956 http://msds.c academic website
    15136 2,2'-Thiene-2,CC(C)(C)c1cc2 199 258050 http://msds.c academic website
    15137 2,3,4,5-Tetra O=C2C(=C(C(=C 218 61382 http://msds.c academic website
    15138 2,3,4,6-Tetra Clc1cc(Cl)c(Cl 70 5806 http://msds.c academic website
    15139 2,3,5,6-Tetra Oc1c(Cl)c(Cl)c 239 59970 http://msds.c academic website
    15140 2,3,5,6-Tetra FC=1C(=O)C(F 179 61540 http://msds.c academic website
    15141 2,3,5,6-Tetra Fc1cc(F)c(F)c( 38 63054 http://msds.c academic website
    15142 2,3,5-TrimethOc1cc(C)c(O)c 173 12260 http://msds.c academic website
    15143 2,3,6-Trichlo Oc1c(Cl)ccc(Cl 56 13029 http://msds.c academic website
    15144 2,3-Dichlorop Oc1cccc(Cl)c1 56 10857 http://msds.c academic website
    15145 2,3-Dichloroq Clc1nc2ccccc2 152 15796 http://msds.c academic website
    15146 2,3-Dimethox COC1=C(OC)C( 58.5 62289 http://msds.c academic website
    15147 2,3-DimethoxyCOc1cccc(C#N 44.5 20548 http://msds.c academic website
    15148 2,3-DimethoxyCOc1cc2c(cc 177 390579 http://msds.c academic website
    15149 2,3-DimethylbCc1c(O)ccc(O) 224 62317 http://msds.c academic website
    15150 2,3-Dimethyl CC(C)C(C)C -128 6340 http://msds.c academic website
    15151 2,3-Diphenylqc1cccc2nc(c(n 126.5 66909 http://msds.c academic website
    15152 2,3-DisulfanylO=C(O)C(S)C( 197 8988 http://msds.c academic website
    15153 2,4,4-TrimethC=C(C)CC(C)(C -94 7580 http://msds.c academic website
    15154 2,4,5,6-Tetraf Fc1c(C#N)c(F) 79 528656 http://msds.c academic website
    15155 2,4,5-Trichlor Clc1cc(c(Cl)cc 69 25665 http://msds.c academic website
    15156 2,4,6-TribromBrc1cc(Br)cc( 121 21106171 http://msds.c academic website
    15157 2,4,6-Trichlor Clc1nc(Cl)nc(C 146.5 7666 http://msds.c academic website
    15158 2,4,6-Trichlor Clc1cc(Cl)cc(C 74 11961 http://msds.c academic website
    15159 2,4,6-Trichlo Clc1cc(Cl)cc(C 69 21106172 http://msds.c academic website
    15160 2,4,6-TrimethyCC1OC(C)OC( 12 21106173 http://msds.c academic website
    15161 2,4,6-TrimethNc1c(C)cc(C)c 90 69014 http://msds.c academic website
    15162 2,4,6-TrimethyCc1cc(C)cc(C) -46 21106174 http://msds.c academic website
    15163 2,4,6-Trinitro O=[N+]([O-])c 122 6688 http://msds.c academic website
    15164 2,4,6-Tris(ally C=CCOc1nc(n 26 7274 http://msds.c academic website
    15165 2,4-Dichloro- Clc2cc(Cl)ccc 70.5 15010 http://msds.c academic website
    15166 2,4-Dichloro- O=[N+]([O-])c1 30.5 21106035 http://msds.c academic website
    15167 2,4-Difluoro- Fc1cc(F)ccc1[ 9 21106036 http://msds.c academic website
    15168 2,4-DifluoroanFc1ccc(N)c(F) -7.5 9328 http://msds.c academic website
    15169 2,4-Dihydrox O=Cc1ccc(O)c 136 6943 http://msds.c academic website
    15170 2,4-Diisocyan O=C=N/c1cc(c 20.5 13835351 http://msds.c academic website
    15171 2,4-DimethoxyNc1ccc(cc1OC 33.5 16685 http://msds.c academic website
    15172 2,4-Dimethyl-Cc1cc(C)ccc1[ 7 6725 http://msds.c academic website
    15173 2,4-DimethylaCc1ccc(N)c(C) 16 13869462 http://msds.c academic website
    15174 2,4-Dinitro-1- [O-][N+](=O)c 131.5 11309 http://msds.c academic website
    15175 2,4-DinitroaniO=[N+]([O-])c 176.5 7045 http://msds.c academic website
    15176 2,4-Dinitro-N-[O-][N+](=O)c 160 13153 http://msds.c academic website
    15177 2,4-Dinitroph O=[N+]([O-])c 108 1448 http://msds.c academic website
    15178 2,4-Di-tert-buCC(C)(C)c1cc( 54.5 7037 http://msds.c academic website
    15179 2,5-Dichloro- O=C1C=C(Cl)C 161.5 11516 http://msds.c academic website
    15180 2,5-Dichloro- OC=1C(=O)C(C 283 59971 http://msds.c academic website
    15181 2,5-DichloroanClc1ccc(Cl)c(N 48 13869655 http://msds.c academic website
    15182 2,5-DichlorobeOC(=O)c1cc(Cl 152.5 10801689 http://msds.c academic website
    15183 2,5-DihydrothO=S1(=O)CC= 64.5 6253 http://msds.c academic website
    15184 2,5-DihydroxyOC(=O)c1cc(O 205.5 3350 http://msds.c academic website
    15185 2,5-Dioxotetr O=C(C)OC1CC 55 469794 http://msds.c academic website
    15186 2,5-Di-tert-buCC(C)(C)c1cc( 218 2283 http://msds.c academic website
    15187 2,6,10,15,19, CC(C)CCCC(C) -38 7798 http://msds.c academic website
    15188 2,6,6-TrimethyCC2(C)C1CC=C -55 6402 http://msds.c academic website
    15189 2,6-Diamino-9Nc2ccc3C(=O) 325 8239 http://msds.c academic website
    15190 2,6-Dibromo-4Brc1cc(cc(Br) 207 12676 http://msds.c academic website
    15191 2,6-Dichloro- ClC1=CC(=NCl 67 7275 http://msds.c academic website
    15192 2,6-Dichlorob O=Cc1c(Cl)ccc 70.5 6481 http://msds.c academic website
    15193 2,6-Dichlorob Clc1cc(N)cc(C 125 11367 http://msds.c academic website
    15194 2,6-DichlorobeOC(=O)c1c(Cl) 144 5555 http://msds.c academic website
    15195 2,6-DichlorobeN#Cc1c(Cl)ccc 144 2923 http://msds.c academic website
    15196 2,6-Dichlorop Clc1cccc(Cl)c 68.5 6633 http://msds.c academic website
    15197 2,6-Diiodo-4- Ic1cc(cc(I)c1O 157 9002 http://msds.c academic website
    15198 2,6-Dimethox COC1=CC(=O) 253 61560 http://msds.c academic website
    15199 2,6-Dimethyl-O=C1C=C(C)C( 70 61542 http://msds.c academic website
    15200 2,6-DimethylaCc1cccc(C)c1N 8 6630 http://msds.c academic website
    15201 2,6-Dimethyl CC1CNCC(C)O -85 99508 http://msds.c academic website
    15202 2,6-DimethylpCc1cccc(C)c1 49 13839174 http://msds.c academic website
    15203 2,6-DimethylpCc1cccc(C)n1 -6 13842613 http://msds.c academic website
    15204 2,6-Di-tert-b CC(C)(C)C1=C 219 10430059 http://msds.c academic website
    15205 2,6-Di-tert-b CC(C)(C)c1cc( 71 13835296 http://msds.c academic website
    15206 2,6-Di-tert-buCC(C)(C)c1ccc 36.5 29135 http://msds.c academic website
    15207 2,6-Di-tert-buCC(C)(C)c1ccc 2 61785 http://msds.c academic website
    15208 2,7-Dichloroo Clc1ccc2Oc3cc 201.5 33642 http://msds.c academic website
    15209 2-[(2,4-Dinit Oc2ccccc2Nc1c 197.5 2355767 http://msds.c academic website
    15210 2-[(2E,6E,10E COC1=C(OC)C( 49 4445197 http://msds.c academic website
    15211 2-[(3s,5s,7s) OCC[C@@]13C 74 21171383 http://msds.c academic website
    15212 2-[(4-Amino-2[O-][N+](=O) 127.5 2707452 http://msds.c academic website
    15213 2-[(4-HydroxyOc2ccc(N=Nc1 205 21106123 http://msds.c academic website
    15214 2-[(CarbamoylO=C(N)OCC(C) 105 3924 http://msds.c academic website
    15215 2-[4-(2-Hydro[O-]S(=O)(=O 236 22278 http://msds.c academic website
    15216 2-{(E)-[4-(Di CN(C)c2ccc(/ 180.5 9881 http://msds.c academic website
    15217 2-{[2-Methyl-3FC(F)(F)c2ccc 227 34911 http://msds.c academic website
    15218 2-Acetamido-6O=C(C)Nc1ccc 184 128624 http://msds.c academic website
    15219 2-AcetoxybenzO=C(C)Oc1ccc 139 2157 http://msds.c academic website
    15220 2-Amino-1-phOC(CN)c1cccc 57 975 http://msds.c academic website
    15221 2-Amino-2-(hyOCC(N)(CO)C 172 6257 http://msds.c academic website
    15222 2-Amino-2-meCC(C)(N)CO 30 13835861 http://msds.c academic website
    15223 2-Amino-2-met
    CC(N)(CO)CO 111 1477 http://msds.c academic website
    15224 2-Amino-4,6-dNc1cc(cc([N+] 169 4103087 http://msds.c academic website
    15225 2-Amino-9,10Nc2ccc3C(=O) 295 8038 http://msds.c academic website
    15226 2-Aminoethane
    NCCS(=O)(=O) 300 1091 http://msds.c academic website
    15227 2-AminoethanNCCS 96 5834 http://msds.c academic website
    15228 2-AminoethanNCCO 11 13835336 http://msds.c academic website
    15229 2-Bromo-1-(4 O=C(CBr)c1ccc 109 7174 http://msds.c academic website
    15230 2-ButoxyethanCCCCOCCO -75 13836399 http://msds.c academic website
    15231 2-ButoxyethylO=C(C)OCCOC -63 7868 http://msds.c academic website
    15232 2-Chloro-1,3-dO=[N+]([O-])c1 57 9426 http://msds.c academic website
    15233 2-Chloro-1-phO=C(CCl)c1ccc 55 10303 http://msds.c academic website
    15234 2-Chloro-2-meCC(C)(Cl)CC -73 55090 http://msds.c academic website
    15235 2-Chloro-2-m CC(C)(C)Cl -26 10054 http://msds.c academic website
    15236 2-Chloro-4-nitNc1ccc(cc1Cl) 108 8179 http://msds.c academic website
    15237 2-Chlorobenz O=Cc1ccccc1C 9 21106014 http://msds.c academic website
    15238 2-ChlorobenzoOC(=O)c1cccc 142 8071 http://msds.c academic website
    15239 2-ChloroethanClCCO -89 21106015 http://msds.c academic webx clearly out of range (4 NIST values) JCB
    15240 2-ChlorophenoOc1ccccc1Cl 7 13837686 http://msds.c academic website
    15241 2-Chloroprop CC(C)Cl -118 6121 http://msds.c academic website
    15242 2-ChloropropaCC(Cl)C(=O)O -13 11241 http://msds.c academic website
    15243 2'-Deoxy-5-fl FC1=CN(C(=O 150.5 5586 http://msds.c academic website
    15244 2-DodecylbenzOS(=O)(=O)c1 10 23761 http://msds.c academic website
    15245 2-Ethoxy-2-m CC(C)(C)OCC -94 11996 http://msds.c academic website
    15246 2-EthoxyethanCCOCCO -90 13836591 http://msds.c academic website
    15247 2-EthoxyethylCC(=O)OCCOC -62 13839109 http://msds.c academic website
    15248 2-Ethyl-9,10- CCc2ccc3C(=O 109 6514 http://msds.c academic website
    15249 2-Ethylhexan-CCC(CCCC)CN -76 7433 http://msds.c academic website
    15250 2-Ethylhexan-CCC(CCCC)CO -76 7434 http://msds.c academic website
    15251 2-EthylhexanoCCCCC(CC)C(= -59 8373 http://msds.c academic website
    15252 2-Ethylhexyl aO=C(C=C)OCC -90 7354 http://msds.c academic website
    15253 2-Ethylhexyl nO=[N+]([O-]) 75 56557 http://msds.c academic website
    15254 2-EthylnaphthCCc1ccc2cccc -70 13063 http://msds.c academic webx clearly out of range JCB
    15255 2-Ethyloxiran CCC1CO1 -60 7546 http://msds.c academic website
    15256 2-EthylphenolCCc1ccccc1O -28 13865680 http://msds.c academic website
    15257 2-Fluoroacet FCC(N)=O 108 12025 http://msds.c academic website
    15258 2-FluorobipheFc2ccccc2c1cc 73.5 60900 http://msds.c academic website
    15259 2-FluorophenoFc1ccccc1O 15 9326 http://msds.c academic website
    15260 2-Furaldehyd O=Cc1ccco1 -36 13863629 http://msds.c academic website
    15261 2-HexadecyloxCCCCCCCCCCC 26 22319 http://msds.c academic website
    15262 2-Hydroxy-1,2OC(C(=O)c1ccc 135 8093 http://msds.c academic website
    15263 2-Hydroxy-1, O=C2C=C(O)C( 192 10430995 http://msds.c academic website
    15264 2-Hydroxy-3,5O=[N+]([O-])c 170.5 11380 http://msds.c academic website
    15265 2-Hydroxy-3- Oc1c(cccc1OC 41 21105848 http://msds.c academic website
    15266 2-Iodo-1-methIc1cc(ccc1C)[ 61 74170 http://msds.c academic website
    15267 2-Iodo-2-met CC(C)(C)I -38 10733 http://msds.c academic website
    15268 2-IodoacetamICC(N)=O 94 3596 http://msds.c academic website
    15269 2-IodobenzoicOC(=O)c1cccc 162.5 6675 http://msds.c academic website
    15270 2-Iodobutane CC(I)CC -104 10119 http://msds.c academic website
    15271 2-Iodophenol Ic1ccccc1O 38.5 10328 http://msds.c academic website
    15272 2-IodopropanCC(C)I -90 6122 http://msds.c academic website
    15273 2-Isopropyl-5 CC(C)C1CCC(C 34.5 1216 http://msds.c academic website
    15274 2-Methoxy-2-CC(C)(C)OC -109 14672 http://msds.c academic website
    15275 2-Methoxy-5-nNc1cc(ccc1OC) 118 7167 http://msds.c academic website
    15276 2-MethoxyanilNc1ccccc1OC 5 13860775 http://msds.c academic website
    15277 2-MethoxyethOCCOC -85 7728 http://msds.c academic website
    15278 2-MethoxynapCOc1ccc2cccc 74 6852 http://msds.c academic website
    15279 2-MethoxypheOc1ccccc1OC 28 447 http://msds.c academic website
    15280 2-Methyl-1,3,Cc1c(cc(cc1[N 80 8073 http://msds.c academic website
    15281 2-Methyl-1,3-Cc1c(cccc1[N+ 65 11320 http://msds.c academic website
    15282 2-Methyl-1,4 O=C2C=C(C)C( 102 3915 http://msds.c academic website
    15283 2-Methyl-2-p CCC(C)(C(N)=O 101 205720 http://msds.c academic website
    15284 2-Methyl-4-ni[O-][N+](=O)c 253 12236 http://msds.c academic website
    15285 2-Methyl-5-nitCc1ccc(cc1N)[ 107.5 7166 http://msds.c academic website
    15286 2-Methylaziri CC1CN1 -65 6137 http://msds.c academic website
    15287 2-MethylbenzNc1cccc(N)c1 106 12650 http://msds.c academic website
    15288 2-Methylbenze
    Oc1ccc(O)c(C) 129 6983 http://msds.c academic website
    15289 2-Methylbenzo
    Cc1ccccc1C(O 105 8070 http://msds.c academic website
    15290 2-Methylbut- C=C(C)CC -137 10766 http://msds.c academic website
    15291 2-Methylbut- CC=C(/C)C -134 10113 http://msds.c academic website
    15292 2-Methylbut-3C#CC(C)(C)O 2.6 21106133 http://msds.c academic website
    15293 2-Methylfura Cc1ccco1 -89 10340 http://msds.c academic website
    15294 2-Methylisopht
    N#Cc1cccc(C# 136 511478 http://msds.c academic website
    15295 2-Methylocta CC(C)CCCCCC -80 17558 http://msds.c academic website
    15296 2-MethyloxiraCC1CO1 -112 6138 http://msds.c academic website
    15297 2-MethylpentC/C(C)=CCC -135 11742 http://msds.c academic website
    15298 2-MethylpentCC(C)CCCCCC -7 14532 http://msds.c academic website
    15299 2-MethylpentCC(C)CCC -154 7604 http://msds.c academic website
    15300 2-MethylpentaCC(O)CC(C)(C -40 13884973 http://msds.c academic website
    15301 2-MethylpropC=C(C)C -140 7957 http://msds.c academic website
    15302 2-MethylpropaCC(C)CO -108 6312 http://msds.c academic website
    15303 2-MethylpropCC(C)(C)N -67 6145 http://msds.c academic website
    15304 2-MethylpropaCC(C)(C)O 25 6146 http://msds.c academic website
    15305 2-MethylpropCC(C)C=O -65 6313 http://msds.c academic website
    15306 2-MethylpropaCC(CO)CO -91 67654 http://msds.c academic website
    15307 2-MethylpropaCC(C)C#N -72 6311 http://msds.c academic website
    15308 2-MethylpyridCc1ccccn1 -70 13839199 http://msds.c academic website
    15309 2-MethylsucciO=C(O)CC(C)C 111 9922 http://msds.c academic website
    15310 2-Naphthol Oc1ccc2ccccc 122 8341 http://msds.c academic website
    15311 2-Nitro-9H-fl [O-][N+](=O)c 156 11338 http://msds.c academic website
    15312 2-NitroanilineO=[N+]([O-])c 72 13853943 http://msds.c academic website
    15313 2-NitrobenzenO=[N+]([O-])c 138.5 3542441 http://msds.c academic website
    15314 2-NitrobenzoicO=[N+]([O-])c 147 10616 http://msds.c academic website
    15315 2-Nitrobutan-[O-][N+](=O)C -47 11371 http://msds.c academic website
    15316 2-Nitrofuran [O-][N+](=O)c 31 11372 http://msds.c academic website
    15317 2-Nitro-N-pheO=C(Nc1ccccc1 93 11279086 http://msds.c academic website
    15318 2-NitrophenolO=[N+]([O-])c 44 13837787 http://msds.c academic website
    15319 2-NitropropanCC(C)[N+]([O- -93 387 http://msds.c academic website
    15320 2-O-Acetyl-3- Br[C@H]1O[C 89.5 91958 http://msds.c academic website
    15321 2-Oxo-1,2-dipCC(=O)OC(C(= 82 86112 http://msds.c academic website
    15322 2-Oxo-2-phenyO=C(OCC(=O)c 119 105964 http://msds.c academic website
    15323 2-OxopropanoiCC(=O)C(=O)O 12 1031 http://msds.c academic website
    15324 2-Oxosuccinic O=C(O)C(=O)C 161 945 http://msds.c academic website
    15325 2-PhenoxyethOCCOc1ccccc 12 13848467 http://msds.c academic website
    15326 2-Phenyl-4H- O=C2C=C(Oc1c 153 11297 http://msds.c academic website
    15327 2-PhenylethanOCCc1ccccc1 -27 5830 http://msds.c academic website
    15328 2-Phenyloxirac1ccccc1C2CO -37 7005 http://msds.c academic website
    15329 2-PhenylpropaOOC(C)(C)c1c -9 6377 http://msds.c academic website
    15330 2-Propoxyeth CCCOCCO -75 16778 http://msds.c academic website
    15331 2-sec-Butyl-4,O=[N+]([O-])c 55 6684 http://msds.c academic website
    15332 2-sec-Butyl-4-CC(CC)N1N=CN 166.2 49927 http://msds.c academic website
    15333 2-sec-ButylphOc1ccccc1C(C 12 6718 http://msds.c academic website
    15334 2-tert-ButylbeCC(C)(C)c1cc( 128 15235 http://msds.c academic website
    15335 2-ThioxodihydO=C1CC(=O)N 234 2005830 http://msds.c academic website
    15336 3-(1H-ImidazoO=CC=Cn1ccn 118.5 21106126 http://msds.c academic website
    15337 3-(1-NitrosopyO=NN2CCCC2c 47 25973 http://msds.c academic website
    15338 3-(Bromomethy
    CC1=C(C)C(=O 152 102775 http://msds.c academic website
    15339 3-(ChloroperoClOOc1cc(ccc 92 10608768 http://msds.c academic website
    15340 3-(Dimethyla CN(C)c1cccc(O 83 7143 http://msds.c academic website
    15341 3-(Morpholin-4
    O=S(=O)(O)C 277 63972 http://msds.c academic website
    15342 3-(Oxiran-2-ylO1CC1C2CC3O -109 7545 http://msds.c academic website
    15343 3,3-Bis(4-hyd CC(C)c1cc(c(C 250 29054 http://msds.c academic website
    15344 3,3-DimethylbC#CC(C)(C)C -78 12924 http://msds.c academic website
    15345 3,3-DimethylbCC(C)(C)C(C)= -52.5 6176 http://msds.c academic website
    15346 3,4,5,6-TetracClc1c(c(c(Cl)c 98 11935 http://msds.c academic website
    15347 3,4,5-Trichlo Oc1cc(Cl)c(Cl) 101 11366 http://msds.c academic website
    15348 3,4-DichloroanNc1cc(Cl)c(Cl) 72 13860720 http://msds.c academic website
    15349 3,4-Dichlorop Oc1cc(Cl)c(Cl) 67 6988 http://msds.c academic website
    15350 3,4-Dihydrox Oc1ccc(C=O)c 154 8438 http://msds.c academic website
    15351 3,4-DihydroxyOc1ccc(cc1O) 201 71 http://msds.c academic website
    15352 3,4-DimethoxyCOc1cc(ccc1O 180 6854 http://msds.c academic website
    15353 3,5,5-TrimethO=C1C=C(C)CC -8 6296 http://msds.c academic website
    15354 3,5,5-TrimethCC(CC(C)(C)C) -70 82141 http://msds.c academic website
    15355 3,5-Dichlorob Oc1cc(Cl)cc(C 82.5 24384 http://msds.c academic website
    15356 3,5-DinitrobenO=[N+]([O-])c 206 7155 http://msds.c academic website
    15357 3,5-DinitrobenO=[N+]([O-])c 69 7154 http://msds.c academic website
    15358 3,5-Di-tert-b O=C1C(=CC(=C 113.5 69366 http://msds.c academic website
    15359 3,5-Di-tert-buOc1c(cc(cc1O) 96 59488 http://msds.c academic website
    15360 3,5-Di-tert-buCC(C)(C)c1cc(c 88 63989 http://msds.c academic website
    15361 3,6,9,12,15,1 OCCOCCOCCO 32.5 71168 http://msds.c academic website
    15362 3,6,9,12,15,1 OCCOCCOCCO 27 17269 http://msds.c academic website
    15363 3,6,9,12,15-P OCCOCCOCCO 6 16521 http://msds.c academic website
    15364 3,6-Dibromo-9Brc1cc2c3cc(B 212 241837 http://msds.c academic website
    15365 3,7-Dinitroso-O=NN1CN2CN( 207 7268 http://msds.c academic website
    15366 3-[4-(4-Chlor Clc2ccc(Oc1cc 151 15299 http://msds.c academic website
    15367 3-{[1,3-Dihyd O=S(=O)(O)CC 230 108495 http://msds.c academic website
    15368 3-AminophenoNc1cccc(O)c1 125 11080 http://msds.c academic website
    15369 3-AnilinophenOc2cccc(Nc1cc 81.5 21106124 http://msds.c academic website
    15370 3-Chloro-1-phO=C(CCCl)c1c 48.5 63478 http://msds.c academic website
    15371 3-Chloro-4-fluNc1cc(Cl)c(F)c 45.5 9327 http://msds.c academic website
    15372 3-Chloro-4-meNc1cc(Cl)c(C) 26 6985 http://msds.c academic website
    15373 3-ChlorophenoOc1cc(Cl)ccc1 33 13875432 http://msds.c academic website
    15374 3-Chloroprop-C=CCCl -134 13836674 http://msds.c academic website
    15375 3-ChloropropaOCC(O)CCl -40 7018 http://msds.c academic website
    15376 3-Fluoro-L-tyrFc1cc(C[C@H] 260.5 558483 http://msds.c academic website
    15377 3-FluorophenoFc1cccc(O)c1 10 9360 http://msds.c academic website
    15378 3-Hydroxy-4-[Cc3cc(/N=N/c2 300 10467539 http://msds.c academic website
    15379 3-HydroxypropN#CCCO -46 7720 http://msds.c academic website
    15380 3-Iodoprop-1-ICC#COC(=O) 66 8097426 http://msds.c academic website
    15381 3-Isothiocyan C=CCN=C=S -80 21105854 http://msds.c academic website
    15382 3-Methyl-1,2-Cc2ccc3cc1c5 179.5 1611 http://msds.c academic website
    15383 3-Methyl-1H-iCc2cnc1ccccc 95 6480 http://msds.c academic website
    15384 3-Methyl-1-phCN(C)C(=O)Oc 50 6623 http://msds.c academic website
    15385 3-Methyl-2-niO=[N+]([O-])c 221 20277 http://msds.c academic website
    15386 3-Methylbenzo
    Cc1cccc(c1)C( 112 7140 http://msds.c academic website
    15387 3-MethylbutanCC(C)CCO -117 29000 http://msds.c academic website
    15388 3-MethylbutylCC(=O)OCCC(C -100 29016 http://msds.c academic website
    15389 3-MethylpentCC(CC)CC 63 7010 http://msds.c academic webx took bp instead of mp JCB
    15390 3-NitrobenzoicO=[N+]([O-])c 142 8183 http://msds.c academic website
    15391 3-NitrophenolO=[N+]([O-])c 97 10664 http://msds.c academic website
    15392 3-NitrophthaliO=[N+]([O-])c 210 62265 http://msds.c academic website
    15393 3-Nitropropan[O-][N+](=O) 64 1615 http://msds.c academic website
    15394 3-Oxo-N-phenO=C(Nc1ccccc 86 7311 http://msds.c academic website
    15395 3-Phenoxybenz
    Cl/C(Cl)=C/C3 34 36845 http://msds.c academic website
    15396 3-tert-Butyl- COc1ccc(O)cc1 48 6666 http://msds.c academic website
    15397 4-(2,2-DimethO=C(NN(C)C)C 154.5 14593 http://msds.c academic website
    15398 4-(2-AminoproCC1(N)CCC(CC -45 6398 http://msds.c academic website
    15399 4-(2-MethylbuOc1ccc(cc1)C( 95 21106091 http://msds.c academic website
    15400 4-(2-PhenylprCC(C)(c1ccc(O 71.5 11249 http://msds.c academic website
    15401 4-(Dichlorosu O=S(=O)(N(Cl) 213 3431 http://msds.c academic website
    15402 4-(DimethylamCN(C)C=2C(=O 108 5787 http://msds.c academic website
    15403 4-(Dimethyla CN(C)c1ccc(C 74 7199 http://msds.c academic website
    15404 4-(DimethylamCN(C)c1ccc(cc 243 11595 http://msds.c academic website
    15405 4-(Dipropylsu O=S(=O)(N(CC 195 4742 http://msds.c academic website
    15406 4-(HydroxymeOc1ccc(cc1OC 114 56139 http://msds.c academic website
    15407 4-(PhenyldiazeNc2ccc(N=Nc1 124 10447135 http://msds.c academic website
    15408 4,4'-(1,1-Dio Brc1cc(c(C)c( 225 6209 http://msds.c academic website
    15409 4,4'-(1,1-Diox Brc1cc(cc(Br) 204 7973 http://msds.c academic website
    15410 4,4'-(1,1-Dio CC(C)c1cc(c(C 200 6208 http://msds.c academic website
    15411 4,4'-(1,1-Dio Cc1cc(cc(Br)c 241 7974 http://msds.c academic website
    15412 4,4'-(3E)-Hex-Oc1ccc(cc1)C( 170.5 395306 http://msds.c academic website
    15413 4,4'-(OxydicarOC(=O)c2cc(c 165 13697977 http://msds.c academic website
    15414 4,4',4''-MethaCN(C)c1ccc(cc 179.5 62270 http://msds.c academic website
    15415 4,4'-[Hydroxy Oc2ccc(c1cccc 232.5 73430 http://msds.c academic website
    15416 4,4'-DisulfaneNc2ccc(SSc1cc 77 12344 http://msds.c academic website
    15417 4,4'-MethylenCC=4N(C)N(c1 155 86870 http://msds.c academic website
    15418 4,5,6,7-Tetra O=C1OC(=O)c2c 255.5 8023 http://msds.c academic website
    15419 4,5-Bis(hydro Oc1c(CO)c(cn 160.5 1025 http://msds.c academic website
    15420 4,6-Dichloro-NClc2nc(Nc1ccc 159.5 7260 http://msds.c academic website
    15421 4,7-DimethyldCC(O)(C#CC(C 68.5 119747 http://msds.c academic website
    15422 4,7-Diphenyl- c2cc1c(ccnc1c 218 65648 http://msds.c academic website
    15423 4-[(2R,3S)-4- Oc2ccc(C[C@@ 180 64490 http://msds.c academic website
    15424 4-[(4-Nitrophe[O-][N+](=O)c 275 21106147 http://msds.c academic website
    15425 4-[(4-NitropheOc2cc(O)ccc2N 200 16736227 http://msds.c academic website
    15426 4-[Methyl(nit O=C(CCCN(C)N 72 43038 http://msds.c academic website
    15427 4-{(2R)-2-[(1S O=C2CC(C[C@ 120 5962 http://msds.c academic website
    15428 4-{4-[Bis(2-ch O=C(O)CCCc1c 64 2607 http://msds.c academic website
    15429 4-Acetamidobe
    O=C(C)Nc1ccc 256 18177 http://msds.c academic website
    15430 4-Allyl-1,2-d COc1cc(ccc1O -4 21106140 http://msds.c academic website
    15431 4-Allyl-2-met Oc1ccc(cc1OC -9 13876103 http://msds.c academic website
    15432 4-Amino-1,5-dO=C2C(N)=C(C 107 2066 http://msds.c academic website
    15433 4-Amino-2,5- Nc1cc(C)c(O)c 242.5 69011 http://msds.c academic website
    15434 4-Amino-2,6-dClc1cc(N)cc(C 168.5 72291 http://msds.c academic website
    15435 4-Amino-2-chNc1cc(Cl)c(O) 151.5 69983 http://msds.c academic website
    15436 4-AminobenzeNc1ccc(cc1)S( 165 5142 http://msds.c academic website
    15437 4-Aminobenzoi
    OC(=O)c1ccc( 188.5 953 http://msds.c academic website
    15438 4-Amino-N-(1,O=S(=O)(Nc1nc 202 5148 http://msds.c academic website
    15439 4-Amino-N-(3,Cc2c(NS(=O)(= 196.5 5151 http://msds.c academic website
    15440 4-Amino-N-(pyO=S(=O)(Nc1cc 191.5 5145 http://msds.c academic website
    15441 4-AminophenoNc1ccc(O)cc1 189 392 http://msds.c academic website
    15442 4-BenzoylbenzOC(=O)c1ccc(c 198 62362 http://msds.c academic website
    15443 4-BromoanilinNc1ccc(Br)cc1 64 7519 http://msds.c academic website
    15444 4-Bromo-N,N-b
    Brc1ccc(cc1)N 142 226401 http://msds.c academic website
    15445 4-Chloro-2-is Oc1cc(C)c(Cl) 59 6716 http://msds.c academic website
    15446 4-Chloro-2-nitNc1ccc(Cl)cc1 116.5 6713 http://msds.c academic website
    15447 4-Chloro-3,5- Oc1cc(C)c(Cl)c 115 21106017 http://msds.c academic website
    15448 4-Chloro-3-meOc1ccc(Cl)c(C 67 21106018 http://msds.c academic website
    15449 4-Chloro-3-nitO=[N+]([O-])c 53.5 110073 http://msds.c academic website
    15450 4-ChloroanilinNc1ccc(Cl)cc1 72.5 13869339 http://msds.c academic website
    15451 4-Chlorobenz O=Cc1ccc(Cl)c 46 21106019 http://msds.c academic website
    15452 4-ChlorobenzeNc1cc(Cl)ccc1 68.5 6993 http://msds.c academic website
    15453 4-ChlorobenzeOc1ccc(Cl)c(O 107 1668 http://msds.c academic website
    15454 4-ChlorobenzoOC(=O)c1ccc(C 243 6079 http://msds.c academic website
    15455 4-ChlorobenzoO=C(Cl)c1ccc( 13 8187 http://msds.c academic website
    15456 4-Chloro-N-(pO=S(=O)(NC(= 128 2626 http://msds.c academic website
    15457 4-ChlorophenoOc1ccc(Cl)cc1 44 13875219 http://msds.c academic website
    15458 4-Ethoxyanili CCOc1ccc(N)c 3 21106155 http://msds.c academic website
    15459 4-EthylmorphoCCN1CCOCC1 -63 7244 http://msds.c academic website
    15460 4-EthylphenolCCc1ccc(O)cc 43.5 28982 http://msds.c academic website
    15461 4-FluorophenoFc1ccc(O)cc1 45.5 9350 http://msds.c academic website
    15462 4H-Cyclopent c1cc2cccc3Cc 116 8793 http://msds.c academic website
    15463 4-HexylbenzenOc1cc(O)ccc1 65 21106121 http://msds.c academic website
    15464 4-HydrazinobeNNc1ccc(cc1) 205 11592 http://msds.c academic website
    15465 4-Hydroxy-3-(CC(=O)CC(C1= 161.5 10442445 http://msds.c academic website
    15466 4-Hydroxy-3,5COc1cc(cc(OC 205 10289 http://msds.c academic website
    15467 4-Hydroxy-3- Oc1ccc(cc1OC 82 13860434 http://msds.c academic website
    15468 4-Hydroxy-3-mOc1ccc(cc1OC 211.5 8155 http://msds.c academic website
    15469 4-Hydroxy-4- CC(=O)CC(C)( -50 13838151 http://msds.c academic website
    15470 4-HydroxybenzN#Cc1ccc(O)c 111.5 12478 http://msds.c academic website
    15471 4-Iodoaniline Ic1ccc(N)cc1 61 10431 http://msds.c academic website
    15472 4-Iodophenol Ic1ccc(O)cc1 92 10432 http://msds.c academic website
    15473 4-Isopropoxy-CC(C)Oc1ccc(c 79 7293 http://msds.c academic website
    15474 4-Isopropyl-1 CC(C)C=2C(=O 103 3646 http://msds.c academic website
    15475 4-Methoxy-2-m
    Nc1ccc(OC)cc 13.5 21106028 http://msds.c academic website
    15476 4-Methoxy-4-oO=C(O)CCC(= 57.5 69896 http://msds.c academic website
    15477 4-MethoxyanilNc1ccc(OC)cc 57 13869414 http://msds.c academic website
    15478 4-Methoxybenz
    COc1ccc(cc1) 183.5 10181338 http://msds.c academic website
    15479 4-Methoxybenz
    COc1ccc(cc1)C 22 21106136 http://msds.c academic website
    15480 4-MethoxypheOc1ccc(OC)cc 56 8665 http://msds.c academic website
    15481 4-Methyl-1,3-O=C1OCC(C)O -55 7636 http://msds.c academic website
    15482 4-Methyl-2-nitO=[N+]([O-])c 117 6712 http://msds.c academic website
    15483 4-MethylbenzCc1cc(N)c(N)c 89.5 9908 http://msds.c academic website
    15484 4-Methylbenze
    Cc1cc(S)c(S)cc 31 9910 http://msds.c academic website
    15485 4-Methylbenze
    Cc1ccc(cc1)S( 68 7119 http://msds.c academic website
    15486 4-Methylbenzo
    Cc1ccc(cc1)C( 180 7190 http://msds.c academic website
    15487 4-Methylbenzo
    N#Cc1ccc(C)c 29 21106167 http://msds.c academic website
    15488 4-Methyloxet O=C1CC(C)O1 -43.5 17288 http://msds.c academic website
    15489 4-MethylpentaCC(C)CC(C)O -90 7622 http://msds.c academic website
    15490 4-MethylpentCC(C)CC(C)=O -80 7621 http://msds.c academic website
    15491 4-NitroanilineO=[N+]([O-])c 148 13846959 http://msds.c academic website
    15492 4-Nitrobenza O=[N+]([O-])c 202.5 11594 http://msds.c academic website
    15493 4-NitrobenzenNc1ccc(cc1N)[ 199 4286892 http://msds.c academic website
    15494 4-NitrobenzoicO=[N+]([O-])c 237 5882 http://msds.c academic website
    15495 4-NitrobenzoylO=[N+]([O-])c 75 8188 http://msds.c academic website
    15496 4-Nitrobenzyl O=[N+]([O-])c 33 70581 http://msds.c academic website
    15497 4-NitrophenylO=C(C)Oc1ccc( 78 12687 http://msds.c academic website
    15498 4-NitrophenylO=C(Cl)Oc1ccc 78 74123 http://msds.c academic website
    15499 4-Nitroquinoli[O-][N+](=O)c 154 5740 http://msds.c academic website
    15500 4-NitrosomorpO=NN1CCOCC 29 5823 http://msds.c academic website
    15501 4-PhenoxypheOc2ccc(Oc1cc 80 12696 http://msds.c academic website
    15502 4'-Phenyl-3H,3O=C4OC1(OC=C 155 34768 http://msds.c academic website
    15503 4'-PropylbipheCCCc1ccc(cc1) 226 456119 http://msds.c academic website
    15504 4-SulfanylpheOc1ccc(S)cc1 34 209796 http://msds.c academic website
    15505 4-Vinylcycloh C=CC1CC=CCC -101 7218 http://msds.c academic website
    15506 5-(3,4,5-Trim Nc2nc(N)ncc2 201 5376 http://msds.c academic website
    15507 5-(4-ChlorophCCc1nc(N)nc(N 233 4819 http://msds.c academic website
    15508 5,5-DimethylcO=C1CC(=O)CC 148.5 29091 http://msds.c academic website
    15509 5,6-Diphenyl-3c1cc(ccc1)c2n 191 63757 http://msds.c academic website
    15510 5-[(3R)-1,2-Di O=C(O)CCCC[ 60 5886 http://msds.c academic website
    15511 5'-Amino-1,1':Oc2c(cc(N)cc2 149 540097 http://msds.c academic website
    15512 5-Amino-1-[2,6
    FC(F)(F)S(=O)c 199 3235 http://msds.c academic website
    15513 5-Amino-2,3-dNc2cccc1c2C 319 10192 http://msds.c academic website
    15514 5-Chloro-1-{1 Clc4cc5NC(=O 237.5 3039 http://msds.c academic website
    15515 5-Chloro-2-(2 Clc2cc(Cl)ccc 57 5363 http://msds.c academic website
    15516 5-Chloro-2-meClC1=CC(=O)N 52 30800 http://msds.c academic website
    15517 5-Chloro-2-meClc1cc2nc(C)n 197 68555 http://msds.c academic website
    15518 5-Chloro-N-(2Clc2cc(ccc2NC 223 4322 http://msds.c academic website
    15519 5-Ethyl-2-metCCc1cnc(C)cc1 -71 21105900 http://msds.c academic website
    15520 5-Isopropyl-2 Cc1ccc(cc1O)C 2 21105867 http://msds.c academic website
    15521 5-Methyl-1H-bCc1cc2nnnc2c 81.5 8381 http://msds.c academic website
    15522 5-Methyl-2-niO=[N+]([O-])c 135 17349 http://msds.c academic website
    15523 5-Methyl-2-thCC1=CNC(=S) 266 628889 http://msds.c academic website
    15524 5-Nitro-1,2-d [O-][N+](=O)c 103.5 11276 http://msds.c academic website
    15525 5-Nitro-1H-is [O-][N+](=O) 181 6703 http://msds.c academic website
    15526 5-Oxo-L-proli O=C(O)[C@@H 161.5 7127 http://msds.c academic website
    15527 6,6,9-TrimethCc2cc3c1c(cc( 76.5 2447 http://msds.c academic website
    15528 6,7,8,9-Tetra C1CCCc2nnnn 57.5 5704 http://msds.c academic website
    15529 6-AminohexanNCCCCCCO 56 18801 http://msds.c academic website
    15530 6-Chloro-3,4- NS(=O)(=O)c2 274 3513 http://msds.c academic website
    15531 6-Ethoxy-1,3- CCOc1ccc2nc( 162 6924 http://msds.c academic website
    15532 6-Methoxy-1,3COc1ccc2nc(N 166 14869 http://msds.c academic website
    15533 6-MethoxyquiNc1cc(cc2ccc 52 6756 http://msds.c academic website
    15534 6-Nitro-1H-be[O-][N+](=O)c 208 6927 http://msds.c academic website
    15535 6-Propyl-2-sulSc1nc(CCC)cc( 220 571424 http://msds.c academic website
    15536 7-(Diethylami CCN(CC)c1ccc 70 6783 http://msds.c academic website
    15537 7-Chloro-1-meClc1ccc2c(c1) 125 2908 http://msds.c academic website
    15538 7H-Benzo[de]O=C3c4ccccc4 170 6442 http://msds.c academic website
    15539 7-Hydroxy-2-oO=C2C=Cc3cc 205 4444765 http://msds.c academic website
    15540 7-Hydroxy-4- Oc1ccc2c(c1) 191 4444190 http://msds.c academic website
    15541 7-Isopropyl-1 CC(C)c2cc3ccc 99 9805 http://msds.c academic website
    15542 7-MethylquinoCc1cc2ncccc2 36.5 11433 http://msds.c academic website
    15543 7-Oxabicyclo[ C1CCCC2OC12 -40 8890 http://msds.c academic website
    15544 9,10-Dihydroac1ccc2Cc3ccc 109 11446 http://msds.c academic website
    15545 9,10-Diphenylc1cccc4c1c(c2 249 14430 http://msds.c academic website
    15546 9-Anthrylmet OCc2c3ccccc3 163 66482 http://msds.c academic website
    15547 9-ChloroanthrClc2c3ccccc3c 104 62944 http://msds.c academic website
    15548 9-Ethyl-9H-ca CCn3c1ccccc1 69 6575 http://msds.c academic website
    15549 9H-Carbazole c1cccc2nc3cc 245.5 6593 http://msds.c academic website
    15550 9H-Fluoren-9-OC3c1ccccc1c 153.5 66916 http://msds.c academic website
    15551 9H-Fluoren-9-O=C3c1ccccc1 83 9824 http://msds.c academic website
    15552 9H-Fluorene c1cccc2Cc3cc 116 6592 http://msds.c academic website
    15553 9H-Pyrido[3',2O=C2c1ncccc1 229 633891 http://msds.c academic website
    15554 9H-Thioxanth O=C1c3ccccc3 209 9873 http://msds.c academic website
    15555 9H-Xanthen-9-OC1c3ccccc3O 123 65693 http://msds.c academic website
    15556 9H-Xanthen-9O=C1c3ccccc3 175 6753 http://msds.c academic website
    15557 9H-Xanthene c1ccc2Oc3ccc 101 6840 http://msds.c academic website
    15558 9-IodophenanIc2cc3ccccc3c 92 227590 http://msds.c academic website
    15559 9-Methyl-9H-cCn3c1ccccc1c 91 14413 http://msds.c academic website
    15560 9-Methyl-9H-fCC3c1ccccc1c 46.5 16369 http://msds.c academic website
    15561 9-MethylanthCc2c3ccccc3c 78 12524 http://msds.c academic website
    15562 9-Vinyl-9H-ca C=Cn3c1ccccc 63 14414 http://msds.c academic website
    15563 Abieta-7,13-diCC(C)C=3CC[ 173 10127 http://msds.c academic website
    15564 Acenaphthylec1cc2cccc3C=C 91 8807 http://msds.c academic website
    15565 AcetaldehydeCC=O -124 172 http://msds.c academic website
    15566 Acetamide CC(N)=O 81 173 http://msds.c academic website
    15567 Acetic acid CC(=O)O 16.7 171 http://msds.c academic website
    15568 Acetic anhydrCC(=O)OC(C)= -73 7630 http://msds.c academic website
    15569 Acetonitrile CC#N -46 6102 http://msds.c academic website
    15570 Acetyl chloridCC(Cl)=O -112 6127 http://msds.c academic website
    15571 Acetylene C#C -80.8 6086 http://msds.c academic website
    15572 Acridin-9-ami Nc1c3ccccc3n 241 6752 http://msds.c academic website
    15573 AcrylaldehydeC=CC=O -87 7559 http://msds.c academic website
    15574 Adamantane C1[C@H]3C[C 269 16743817 http://msds.c academic website
    15575 Adamantyl iodI[C@@]13C[C 75.5 120376 http://msds.c academic website
    15576 Adenosine Nc3ncnc2c3n 234 54923 http://msds.c academic website
    15577 Adipamide O=C(N)CCCCC 220 11858 http://msds.c academic website
    15578 Adipic acid OC(=O)CCCCC 152 191 http://msds.c academic website
    15579 Alanine CC(N)C(=O)O 264 582 http://msds.c academic website
    15580 Allylbenzene C=CCc1ccccc1 -40 8950 http://msds.c academic website
    15581 alpha-D-Gluc O[C@H]1[C@H 154.5 71358 http://msds.c academic website
    15582 alpha-D-GlucoO[C@@H]3[C@ 133 388669 http://msds.c academic website
    15583 Aniline Nc1ccccc1 -6 5889 http://msds.c academic website
    15584 Anisole COc1ccccc1 -37 7238 http://msds.c academic website
    15585 Anthracen-2- Nc1ccc2cc3cc 235 11443 http://msds.c academic website
    15586 Anthracen-9( O=C1c3ccccc3 156.5 6751 http://msds.c academic website
    15587 Anthracene-1,8
    Oc2c3c(cc1ccc 178.5 9775 http://msds.c academic website
    15588 Anthracene-9 O=Cc2c3ccccc 105 62710 http://msds.c academic website
    15589 Anthracene-9-N#Cc2c3ccccc 175 13924 http://msds.c academic website
    15590 Anthracene-9-O=C(O)c2c3cc 213 2116 http://msds.c academic website
    15591 Azepan-2-oneO=C1CCCCCN 69 7480 http://msds.c academic website
    15592 Azulene c1cccc2cccc2c 99.5 8876 http://msds.c academic website
    15593 BenzaldehydeO=Cc1ccccc1 -56 235 http://msds.c academic website
    15594 Benzamide NC(=O)c1cccc 127 2241 http://msds.c academic website
    15595 Benzene c1ccccc1 5.5 236 http://msds.c academic website
    15596 Benzene-1,2,3-Oc1cccc(O)c1 132 13835557 http://msds.c academic website
    15597 Benzene-1,2,4,N#Cc1cc(C#N) 265 12308 http://msds.c academic website
    15598 Benzene-1,2,4,OC(=O)c1cc(c 282.5 6695 http://msds.c academic website
    15599 Benzene-1,2- Nc1ccccc1N 101.5 13837582 http://msds.c academic website
    15600 Benzene-1,4- Nc1ccc(N)cc1 140 13835179 http://msds.c academic website
    15601 BenzenesulfonO=S(O)(=O)c1 43.5 7093 http://msds.c academic website
    15602 BenzenesulfonO=S(=O)(Cl)c1 15 7091 http://msds.c academic website
    15603 Benzil O=C(C(=O)c1cc 94.5 8329 http://msds.c academic website
    15604 Benzo[e]acep c1cccc5c1cc4 164 8799 http://msds.c academic website
    15605 Benzo[ghi]perc3cc2ccc1ccc 278 8763 http://msds.c academic website
    15606 Benzo[j]fluor c1cc5ccccc5c 166 8798 http://msds.c academic website
    15607 Benzo[k]fluor c3c5c1cccc2cc 216 8804 http://msds.c academic website
    15608 Benzo[k]tetrac1c4c5ccccc5c 266.5 5678 http://msds.c academic website
    15609 Benzo[pqr]te c1cc2c3ccc4cc 176 2246 http://msds.c academic website
    15610 Benzoic acid O=C(O)c1cccc 122 238 http://msds.c academic website
    15611 Benzonitrile N#Cc1ccccc1 -13 7224 http://msds.c academic website
    15612 BenzophenonO=C(c1ccccc1) 48 2991 http://msds.c academic website
    15613 Benzoyl chlor ClC(=O)c1cccc -1 7134 http://msds.c academic website
    15614 Benzyl benzoaO=C(OCc1cccc 18 13856959 http://msds.c academic website
    15615 Benzyl butyl pO=C(OCc1cccc 230 2257 http://msds.c academic website
    15616 beta,beta-CarCC=2CCC[C@]( 178 4444129 http://msds.c academic website
    15617 beta-Alanine NCCC(=O)O 196 234 http://msds.c academic website
    15618 Biacetyl CC(=O)C(C)=O -3 630 http://msds.c academic website
    15619 Biphenyl-2-amNc2ccccc2c1c 51.5 6748 http://msds.c academic website
    15620 Biphenyl-2-ol Oc2ccccc2c1c 57 13839012 http://msds.c academic website
    15621 Biphenyl-4,4' Nc1ccc(cc1)c2 128 6844 http://msds.c academic website
    15622 Biphenyl-4-amNc1ccc(cc1)c2 53 6835 http://msds.c academic website
    15623 Biphenyl-4-ol Oc1ccc(cc1)c2 167 13846658 http://msds.c academic website
    15624 Bis(8-methylnCC(C)CCCCCCC -50 30996 http://msds.c academic website
    15625 Bis(pentaflu Fc1c(c(F)c(F)c 93 63257 http://msds.c academic website
    15626 Bis[(~2~H_3_)[2H]C([2H])([2 18.4 67699 http://msds.c academic website
    15627 Bis[(~2~H_5_ [2H]c1c(c([2H] 50 2299463 http://msds.c academic website
    15628 Bromine BrBr -7.2 22817 http://msds.c academic website
    15629 Bromo(chloroBrCCl -88 6093 http://msds.c academic website
    15630 BromobenzenBrc1ccccc1 -31 7673 http://msds.c academic website
    15631 BromoethaneBrCC -119 6092 http://msds.c academic website
    15632 BromoetheneBrC=C -139 11151 http://msds.c academic website
    15633 Bromoform BrC(Br)Br 9 13838404 http://msds.c academic website
    15634 BromomethanBrC -93.7 6083 http://msds.c academic website
    15635 But-1-ene C=CCC -185 7556 http://msds.c academic website
    15636 But-2-yn-1-ol CC#CCO -2.2 12450 http://msds.c academic website
    15637 But-2-yne-1,4-OCC#CCO 57 7775 http://msds.c academic website
    15638 But-3-yn-1-ol C#CCCO -63.6 12977 http://msds.c academic website
    15639 Buta-1,3-dien C=CC=C -113 7557 http://msds.c academic website
    15640 Butan-1-aminCCCCN -49 7716 http://msds.c academic website
    15641 Butan-1-ol CCCCO -89 258 http://msds.c academic website
    15642 Butan-2-aminCC(N)CC -72 23255 http://msds.c academic webx this is probably misinterpreted as Less Th
    15643 Butan-2-ol CC(O)CC -115 6320 http://msds.c academic website
    15644 Butan-2-one CC(=O)CC -87 6321 http://msds.c academic website
    15645 Butane-1,4-di NCCCCN 27.5 13837702 http://msds.c academic website
    15646 Butane-1,4-di OCCCCO 18 13835209 http://msds.c academic website
    15647 Butane-1-thioCCCCS -116 7721 http://msds.c academic website
    15648 Butane-2,3-di CC(O)C(C)O 25 21106093 http://msds.c academic website
    15649 Butyl (2R)-2-( O=C(OCCCC)[C 5 2298297 http://msds.c academic website
    15650 Butyl 4-hydro Oc1ccc(cc1)C 68.5 6916 http://msds.c academic website
    15651 Butyl methacrCC(=C)C(=O)O -50 7076 http://msds.c academic website
    15652 ButylbenzeneCCCCc1ccccc1 -88 7419 http://msds.c academic website
    15653 ButylcyclohexCCCCC1CCCCC -75 14753 http://msds.c academic website
    15654 Butyraldehyd CCCC=O -96 256 http://msds.c academic website
    15655 Butyric acid CCCC(=O)O -5 259 http://msds.c academic website
    15656 Caesium [Cs] 28.5 19975975 http://msds.c academic webx metal - AL
    15657 Carbon monoo[O+]#[C-] -205 275 http://msds.c academic website
    15658 CarbonohydraNNC(=O)NN 157.5 66578 http://msds.c academic website
    15659 Chloro(difluo ClC(F)F -146 6132 http://msds.c academic website
    15660 Chloro(trimethC[Si](C)(C)Cl -58 6157 http://msds.c academic website
    15661 Chloroacetic aClCC(=O)O 63 10772140 http://msds.c academic website
    15662 Chloroacetyl cClCC(Cl)=O -22 13856283 http://msds.c academic website
    15663 ChlorobenzenClc1ccccc1 -45 7676 http://msds.c academic website
    15664 Chloroethane CCCl -139 6097 http://msds.c academic website
    15665 ChloroetheneC=CCl -153.7 6098 http://msds.c academic website
    15666 Chloroform ClC(Cl)Cl -63 5977 http://msds.c academic website
    15667 ChloromethanCCl -97 6087 http://msds.c academic website
    15668 Chrysene c1cc4ccccc4c2 253 8817 http://msds.c academic website
    15669 cis-Decahydr C1CC[C@@H] -43 10179239 http://msds.c academic website
    15670 Citric acid OC(=O)CC(O)( 153 305 http://msds.c academic website
    15671 Cobalt(3+) tri C/C(=C/C(C)= 211.5 4589065 http://msds.c academic website
    15672 Cubane C12C3C4C1C5 125.5 119867 http://msds.c academic website
    15673 Cyanamide N#CN 44 9480 http://msds.c academic website
    15674 Cyanic bromidBrC#N 52 10044 http://msds.c academic website
    15675 Cyanic iodide IC#N 146 10046 http://msds.c academic website
    15676 Cyano(3-pheno
    ClC(Cl)=C/[C 79 45196 http://msds.c academic website
    15677 Cyano(3-pheno
    Cl/C(Cl)=C/C3 68.5 2809 http://msds.c academic website
    15678 CyclododecanC1CCCCCCCCC 61 8911 http://msds.c academic website
    15679 Cyclohex-3-enO=C(O)C1CC= 17 19664 http://msds.c academic website
    15680 CyclohexanamNC1CCCCC1 -18 7677 http://msds.c academic website
    15681 Cyclohexane C1CCCCC1 7 7787 http://msds.c academic website
    15682 Cyclohexane-1O=C1CCC(=O) 78 11995 http://msds.c academic website
    15683 Cyclohexanol OC1CCCCC1 21 7678 http://msds.c academic website
    15684 CyclohexanonO=C1CCCCC1 -32 7679 http://msds.c academic website
    15685 Cyclohexene C1C=CCCC1 -104 7788 http://msds.c academic website
    15686 Cyclohexyl is [C-]#[N+]C1C 6 71460 http://msds.c academic website
    15687 Cyclohexylbe c1cc(ccc1)C2 5 12674 http://msds.c academic website
    15688 Cycloocta-1,3,C1=CC=CC=CC -27 553448 http://msds.c academic website
    15689 Cyclopent-2-en
    O=C(O)CC1C= 19 86857 http://msds.c academic website
    15690 Cyclopenta-1,C1=CC=CC1 -97.2 7330 http://msds.c academic website
    15691 Cyclopentane C1CCCC1 -94 8896 http://msds.c academic website
    15692 CyclopentanolOC1CCCC1 -19 7026 http://msds.c academic website
    15693 CyclopentanoO=C1CCCC1 -51 8141 http://msds.c academic website
    15694 CyclopenteneC1C=CCC1 -135 8544 http://msds.c academic website
    15695 Cytidine NC1=NC(=O)N 210 5940 http://msds.c academic website
    15696 Dec-1-ene CCCCCCCCC=C -66 12809 http://msds.c academic website
    15697 Dec-1-yne CCCCCCCCC#C -44 12456 http://msds.c academic website
    15698 Dec-9-en-1-olC=CCCCCCCCC -13 23877 http://msds.c academic website
    15699 DecafluorobipFc1c(c(F)c(F)c 67 61266 http://msds.c academic website
    15700 Decan-1-aminCCCCCCCCCC 13 8576 http://msds.c academic website
    15701 Decan-1-ol CCCCCCCCCC 7 7882 http://msds.c academic website
    15702 Decane CCCCCCCCCC -30 14840 http://msds.c academic website
    15703 Decane-1,10-dOCCCCCCCCC 72 34095 http://msds.c academic website
    15704 Decanoic acidO=C(O)CCCCC 31 2863 http://msds.c academic website
    15705 DecylbenzeneCCCCCCCCCCc -14 7430 http://msds.c academic website
    15706 Diallyl oxydie C=CCOC(=O)O -4 8541 http://msds.c academic website
    15707 DibromomethBrCBr -52 2916 http://msds.c academic website
    15708 Dibutyl ether CCCCOCCCC -97.9 8569 http://msds.c academic website
    15709 Dibutyl phthalO=C(OCCCC)c1 -35 13837319 http://msds.c academic website
    15710 Dibutyl sulfid CCCCSCCCC -80 10536 http://msds.c academic website
    15711 Dichloro(difl ClC(Cl)(F)F -158 6151 http://msds.c academic website
    15712 Dichloro(dipheCl[Si](Cl)(c1c -22 6375 http://msds.c academic website
    15713 DichloroaceticClC(Cl)C(=O)O 9.7 10771217 http://msds.c academic website
    15714 DichloromethClCCl -97 6104 http://msds.c academic website
    15715 DicyclopentadC=1CC3C(C=1 32.5 6247 http://msds.c academic website
    15716 Diethyl (2E)-bO=C(/C=C/C( 1 553702 http://msds.c academic website
    15717 Diethyl (2Z)-b O=C(C=C/C(= -10 4436353 http://msds.c academic website
    15718 Diethyl carbo O=C(OCC)OCC -43 7478 http://msds.c academic website
    15719 Diethyl ether CCOCC -116 3168 http://msds.c academic website
    15720 Diethyl malonO=C(CC(=O)O -50 13863636 http://msds.c academic website
    15721 Diethyl oxalatCCOC(=O)C(= -41 6998 http://msds.c academic website
    15722 Diethyl perox CCOOCC -70 55121 http://msds.c academic website
    15723 Diethyl phthalO=C(OCC)c1cc -3 13837303 http://msds.c academic website
    15724 Diethyl sulfat O=S(=O)(OCC -24 5931 http://msds.c academic website
    15725 Dihydrofuran-O=C1CCC(=O) 119.5 7634 http://msds.c academic website
    15726 DiiodomethanICI 5 6106 http://msds.c academic website
    15727 Diisopropyl p FP(=O)(OC(C) -82 5723 http://msds.c academic website
    15728 Diisopropyl suCC(C)SC(C)C -106 11761 http://msds.c academic website
    15729 DimethoxymeCOCOC -105 13837190 http://msds.c academic website
    15730 Dimethyl (2,2 OC(C(Cl)(Cl)C 83 5644 http://msds.c academic website
    15731 Dimethyl (2E) COC(=O)/C=C/ 104 553171 http://msds.c academic website
    15732 Dimethyl adipO=C(CCCCC(= 8 11824 http://msds.c academic website
    15733 Dimethyl carbO=C(OC)OC 1 11526 http://msds.c academic website
    15734 Dimethyl disulCSSC -85 11731 http://msds.c academic website
    15735 Dimethyl etheCOC -138 7956 http://msds.c academic website
    15736 Dimethyl mal O=C(OC)CC(= -62 21106102 http://msds.c academic website
    15737 Dimethyl oxalO=C(OC)C(=O -54 10649 http://msds.c academic webx inverted sign JCB
    15738 Dimethyl phthCOC(=O)c1ccc 2 13837329 http://msds.c academic website
    15739 Dimethyl sebaO=C(CCCCCCC 26.5 7541 http://msds.c academic website
    15740 Dimethyl succCOC(=O)CCC( 19.5 13848341 http://msds.c academic website
    15741 Dimethyl sulfaO=S(=O)(OC)O -32 6252 http://msds.c academic website
    15742 Dimethyl sulfiCSC -98 1039 http://msds.c academic website
    15743 Dimethyl sulf CS(C)(=O)=O 109 5978 http://msds.c academic website
    15744 Dimethyl sulf CS(C)=O 18.4 659 http://msds.c academic website
    15745 Dimethyl tereCOC(=O)c1ccc 141 13863300 http://msds.c academic website
    15746 DimethylarsiniC[As](C)(O)=O 195 2418 http://msds.c academic webx metal
    15747 DimethylperoCC(=O)OOC(C 30 7749 http://msds.c academic website
    15748 Dioctyl ether CCCCCCCCOCC -7.6 11893 http://msds.c academic website
    15749 Dioctyl phthalO=C(OCCCCCC -52 8043 http://msds.c academic website
    15750 Dioctyl sebacaCCCCCCCCOC( -67 68042 http://msds.c academic website
    15751 Diphenyl carbO=C(Oc1ccccc 79 7315 http://msds.c academic website
    15752 Diphenyl ethec1ccccc1Oc2c 27 7302 http://msds.c academic website
    15753 DiphenylmethOC(c1ccccc1)c 66 6770 http://msds.c academic website
    15754 DiphenylsilaneO[Si](O)(c1cc 201.5 13100 http://msds.c academic website
    15755 Disilane [SiH3][SiH3] -132.6 66736 http://msds.c academic website
    15756 Di-tert-butyl CC(C)(C)OC(= 23 81704 http://msds.c academic website
    15757 Di-tert-butyl CC(C)(C)OOC(C -40 7742 http://msds.c academic website
    15758 Di-tert-butyl( CC(C)(C)[SiH]( 39 475084 http://msds.c academic website
    15759 Diundecylper O=C(CCCCCCC 56 7485 http://msds.c academic website
    15760 D-Mannitol O[C@H]([C@H 167 6015 http://msds.c academic website
    15761 Docosan-1-ol CCCCCCCCCCC 70 12100 http://msds.c academic website
    15762 Docosane CCCCCCCCCCC 42 11899 http://msds.c academic website
    15763 Docosanoic acO=C(O)CCCCC 76 7923 http://msds.c academic website
    15764 Dodec-1-ene CCCCCCCCCCC -35 7891 http://msds.c academic website
    15765 Dodecan-1-amCCCCCCCCCCC 29 12994 http://msds.c academic website
    15766 Dodecan-1-ol CCCCCCCCCC 24 7901 http://msds.c academic website
    15767 Dodecane CCCCCCCCCCC -9.6 7890 http://msds.c academic website
    15768 DodecanedioicO=C(O)CCCCC 129 12213 http://msds.c academic website
    15769 Dodecyl 4-O-aO[C@@H]2[C 150 102836 http://msds.c academic website
    15770 Dodecyl methaC=C(C)C(=O) -7 8566 http://msds.c academic website
    15771 Dodecyl(dimetC[N+]([O-])( 132.5 14688 http://msds.c academic website
    15772 DodecylbenzeCCCCCCCCCCC -7 28977 http://msds.c academic website
    15773 D-PhenylalaniN[C@H](Cc1cc 274.5 64639 http://msds.c academic website
    15774 D-Ribitol O[C@@H](CO) 102 10254628 http://msds.c academic website
    15775 D-Ribose O[C@@H](C=O 82 4470639 http://msds.c academic website
    15776 D-Sorbose O[C@@H](C(= 95 96680 http://msds.c academic website
    15777 Ethanamine CCN -81 6101 http://msds.c academic website
    15778 Ethane CC -172 6084 http://msds.c academic webx clearly out of range JCB
    15779 Ethane-1,2-di NCCN 8.5 13835550 http://msds.c academic website
    15780 Ethane-1,2-ditSCCS -41 13865015 http://msds.c academic website
    15781 Ethanebis(thi NC(=S)C(N)=S 170 2058248 http://msds.c academic website
    15782 Ethanedioyl diClC(=O)C(Cl)= -9 59021 http://msds.c academic website
    15783 EthaneperoxoiCC(=O)OO 0.1 6336 http://msds.c academic website
    15784 EthanethioamCC(N)=S 115 2006126 http://msds.c academic website
    15785 Ethanethiol CCS -148 6103 http://msds.c academic website
    15786 Ethanol CCO -144 682 http://msds.c academic webx clearly out of range JCB
    15787 Ethenimine C=C=N -78 121763 http://msds.c academic website
    15788 EthoxyetheneC=COCC -115 7732 http://msds.c academic website
    15789 Ethyl (2E)-3-p O=C(/C=C/c1c 7 553344 http://msds.c academic website
    15790 Ethyl 2-aminoNc1ccccc1C(= 13 21106112 http://msds.c academic website
    15791 Ethyl 2-cyanoaN#CC(=C)C(=O -22 73564 http://msds.c academic website
    15792 Ethyl 2-hydro CC(O)C(=O)OC -26 13837423 http://msds.c academic website
    15793 Ethyl 3-oxobuCC(=O)CC(=O -43 13865426 http://msds.c academic website
    15794 Ethyl 4-(dime CN(C)c1ccc(c 63.5 23472 http://msds.c academic website
    15795 Ethyl 4-aminoNc1ccc(cc1)C 88 13854242 http://msds.c academic website
    15796 Ethyl 4-hydro Oc1ccc(cc1)C 117 13846749 http://msds.c academic website
    15797 Ethyl acetate CC(=O)OCC -84 8525 http://msds.c academic website
    15798 Ethyl acrylate C=CC(=O)OCC -71 8490 http://msds.c academic website
    15799 Ethyl benzoat O=C(OCC)c1cc -34 6897 http://msds.c academic website
    15800 Ethyl bis(4-ch OC(c1ccc(Cl)c 36 10085 http://msds.c academic website
    15801 Ethyl butyrateCCCC(=O)OCC -93 7475 http://msds.c academic website
    15802 Ethyl carbamaNC(=O)OCC 48 5439 http://msds.c academic website
    15803 Ethyl chloroacClCC(=O)OCC -26 7465 http://msds.c academic website
    15804 Ethyl formate O=COCC -81 7734 http://msds.c academic website
    15805 Ethyl methacrC=C(C)C(=O)O -75 7066 http://msds.c academic website
    15806 Ethylene C=C -169 6085 http://msds.c academic website
    15807 Ethylene glycoOCCO -13 13835235 http://msds.c academic website
    15808 EthylphosphonCCP(=O)(O)O 61.5 177126 http://msds.c academic website
    15809 Fluoranthene c1cccc4c1c2c 107.5 8800 http://msds.c academic website
    15810 FluorobenzenFc1ccccc1 -40 9614 http://msds.c academic website
    15811 Fluoroform FC(F)F -160 21106179 http://msds.c academic website
    15812 FluoromethanCF -115 11148 http://msds.c academic webx clearly out of range and analog trend JCB
    15813 Formamide NC=O 2 693 http://msds.c academic website
    15814 Furan c1ccco1 -85.6 7738 http://msds.c academic website
    15815 Furan-2,5-dio O=C1C=CC(=O 53 7635 http://msds.c academic website
    15816 GlutaraldehydO=CCCCC=O -6 3365 http://msds.c academic website
    15817 Glutaric acid O=C(O)CCCC( 96.5 723 http://msds.c academic website
    15818 Glycerol OCC(O)CO 17.8 733 http://msds.c academic website
    15819 Glycol acid O=C(O)CO 80 737 http://msds.c academic website
    15820 Glycylglycine NCC(=O)NCC( 257.5 10690 http://msds.c academic website
    15821 Henicosane CCCCCCCCCCC 39 11897 http://msds.c academic website
    15822 HeptadecafluoFC(F)(C(F)(F)C 66.5 61138 http://msds.c academic website
    15823 Heptadecan-1CCCCCCCCCCC 57 14348 http://msds.c academic website
    15824 Heptadecane CCCCCCCCCCC 21 11892 http://msds.c academic website
    15825 HeptadecanoicO=C(O)CCCCC 60 10033 http://msds.c academic website
    15826 Heptan-1-ol CCCCCCCO -36 7837 http://msds.c academic website
    15827 Heptan-2-oneCC(=O)CCCCC -35 7760 http://msds.c academic website
    15828 Heptan-3-oneCCC(=O)CCCC -39 7514 http://msds.c academic website
    15829 Heptan-4-oneCCCC(=O)CCC -33 28986 http://msds.c academic website
    15830 Heptanal CCCCCCC=O -43 7838 http://msds.c academic website
    15831 Heptane CCCCCCC -91 8560 http://msds.c academic website
    15832 Heptanoic aci CCCCCCC(=O) -9 7803 http://msds.c academic website
    15833 Heptyl hydrogOS(=O)(=O)O 200.5 158845 http://msds.c academic website
    15834 Hex-1-ene C=CCCCC -140 11109 http://msds.c academic website
    15835 HexabromobeBrc1c(Br)c(Br) 327 6639 http://msds.c academic website
    15836 HexachlorobeClc1c(Cl)c(Cl)c 228 8067 http://msds.c academic website
    15837 Hexadecan-1-CCCCCCCCCCC 50 2581 http://msds.c academic website
    15838 Hexadecane CCCCCCCCCCC 18 10540 http://msds.c academic website
    15839 Hexadecanedio
    O=C(O)CCCCC 125 10027 http://msds.c academic website
    15840 Hexafluorobe Fc1c(F)c(F)c(F 3.9 13836549 http://msds.c academic website
    15841 Hexafluoroet FC(F)(F)C(F)(F -100 6191 http://msds.c academic website
    15842 HexamethyldisC[Si](C)(C)O[Si -59 23150 http://msds.c academic website
    15843 Hexan-1-aminCCCCCCN -23 7811 http://msds.c academic website
    15844 Hexan-1-ol CCCCCCO -52 7812 http://msds.c academic website
    15845 Hexan-2-one CC(=O)CCCC -57 11095 http://msds.c academic website
    15846 Hexanamide CCCCCC(N)=O 101 11827 http://msds.c academic website
    15847 Hexane CCCCCC -95 7767 http://msds.c academic website
    15848 Hexane-1,6-d NCCCCCCN 39 13835579 http://msds.c academic website
    15849 Hexane-2,5-d CC(=O)CCC(C) -7 7744 http://msds.c academic website
    15850 Hexanoic acidCCCCCC(=O)O -3 8552 http://msds.c academic website
    15851 HexylbenzeneCCCCCCc1cccc -61 13487 http://msds.c academic website
    15852 Hydrazinecar NC(=S)NN 183 2005980 http://msds.c academic website
    15853 Hydrogen broBr -87 255 http://msds.c academic website
    15854 Hydrogen broBr -86 255 http://msds.c academic website
    15855 Hydrogen chloCl -114.2 307 http://msds.c academic webx inorganic JCB
    15856 Hydrogen chloCl -25 307 http://msds.c academic webx inorganic JCB
    15857 Hydrogen perOO -40 763 http://msds.c academic website
    15858 Hydroxy(dipheOC(C(=O)O)(c1 151.5 6220 http://msds.c academic website
    15859 Icosane CCCCCCCCCCC 36.7 7929 http://msds.c academic website
    15860 Icosanoic acidO=C(O)CCCCC 75 10035 http://msds.c academic website
    15861 Iodic acid O=I(=O)O 110 22761 http://msds.c academic website
    15862 Iodine II 113.5 785 http://msds.c academic website
    15863 Iodoacetic aciICC(=O)O 81 5050 http://msds.c academic website
    15864 Iodoethane CCI -108 6100 http://msds.c academic website
    15865 Iodoform IC(I)I 121.5 6134 http://msds.c academic website
    15866 Iodomethane CI -64 6088 http://msds.c academic website
    15867 Isobutane CC(C)C -159.6 6120 http://msds.c academic website
    15868 IsocyanatocycO=C=N/C1CCC -80 17475 http://msds.c academic website
    15869 IsocyanatomeCN=C=O -80 11727 http://msds.c academic website
    15870 Isonicotinohy O=C(NN)c1ccn 171 3635 http://msds.c academic website
    15871 IsonicotinonitrN#Cc1ccncc1 76 7225 http://msds.c academic website
    15872 Isopentane CC(C)CC -160 6308 http://msds.c academic website
    15873 Isopropylben CC(C)c1ccccc1 -96 7128 http://msds.c academic website
    15874 Isothiocyana CN=C=S 35 10694 http://msds.c academic website
    15875 L-Alanine C[C@H](N)C( 314 5735 http://msds.c academic website
    15876 L-Alanyl-L-ala C[C@H](NC(=O 280 4588478 http://msds.c academic website
    15877 Lauramide NC(=O)CCCCC 99 13618 http://msds.c academic website
    15878 Lauric acid O=C(O)CCCCC 45 3756 http://msds.c academic website
    15879 L-Glucose O[C@@H]([C@ 150.5 9129332 http://msds.c academic website
    15880 L-Leucine CC(C)C[C@H]( 287 5880 http://msds.c academic website
    15881 L-Methionine O=C(O)[C@@H 284 5907 http://msds.c academic website
    15882 L-Proline O=C(O)[C@@ 228 128566 http://msds.c academic website
    15883 L-Threonine O=C(O)[C@@H 256 9943238 http://msds.c academic website
    15884 L-Tyrosine Oc1ccc(C[C@H 295 5833 http://msds.c academic website
    15885 Magnesium diO=C(CCCCCCC 89 10704 http://msds.c academic webx metal
    15886 Malic acid O=C(O)C(O)CC 130 510 http://msds.c academic website
    15887 Malonic acid O=C(O)CC(=O 136 844 http://msds.c academic website
    15888 m-Cresol Cc1cc(O)ccc1 11 21105871 http://msds.c academic website
    15889 Mesitylene Cc1cc(C)cc(C) -45 7659 http://msds.c academic website
    15890 Methacrylald C=C(C)C=O -81 6314 http://msds.c academic website
    15891 Methacrylic a C=C(C)C(=O)O 16 3951 http://msds.c academic website
    15892 MethanamineCN -93 6089 http://msds.c academic website
    15893 Methane C -182 291 http://msds.c academic website
    15894 MethanedithiS=C=S -112 6108 http://msds.c academic website
    15895 MethanethiolCS -121 855 http://msds.c academic website
    15896 Methanol CO -98 864 http://msds.c academic website
    15897 Methionine O=C(O)C(N)CC 281 853 http://msds.c academic website
    15898 Methyl (1E)-NC/C(=NOC(=O) 79 4510206 http://msds.c academic website
    15899 Methyl (3betaCOc1cc(cc(O 238 4444446 http://msds.c academic website
    15900 Methyl 2-ami Nc1ccccc1C(= 24 13858096 http://msds.c academic website
    15901 Methyl 3,5-di Clc1nc(C(=O) 212.5 66461 http://msds.c academic website
    15902 Methyl 3-nitr O=[N+]([O-])c 78 62472 http://msds.c academic website
    15903 Methyl 4-formCOC(=O)c1ccc 61 14559 http://msds.c academic website
    15904 Methyl 4-hyd Oc1ccc(cc1)C 127 7176 http://msds.c academic website
    15905 Methyl acetatCC(=O)OC -98 6335 http://msds.c academic website
    15906 Methyl acryla C=CC(=O)OC -75 7022 http://msds.c academic website
    15907 Methyl benzoCOC(=O)c1ccc -12 6883 http://msds.c academic website
    15908 Methyl beta-DO[C@@H]1[C 172 85024 http://msds.c academic website
    15909 Methyl butyraCCCC(=O)OC -95 11680 http://msds.c academic website
    15910 Methyl formaO=COC -100 7577 http://msds.c academic website
    15911 Methyl hexanCCCCCC(=O)O -71 7536 http://msds.c academic website
    15912 Methyl L-alphO=C(O)C[C@H] 249 118630 http://msds.c academic website
    15913 Methyl L-tyro Oc1ccc(C[C@H 134 63818 http://msds.c academic website
    15914 Methyl methac
    C=C(C)C(=O)O -48 6406 http://msds.c academic website
    15915 Methyl methaCS(=O)(=O)OC 20 4013 http://msds.c academic website
    15916 Methyl nitrat [O-][N+](=O) -108 11231 http://msds.c academic website
    15917 Methyl nitriteCON=O -16 11730 http://msds.c academic website
    15918 Methyl phenylCSc1ccccc1 -15 7239 http://msds.c academic website
    15919 Methyl propioCCC(=O)OC -88 10653 http://msds.c academic website
    15920 Methyl salicylOc1ccccc1C(= -9 13848808 http://msds.c academic website
    15921 Methylcycloh CC1CCCCC1 -127 7674 http://msds.c academic website
    15922 Methylene bisN#CSCSC#N 106 21349 http://msds.c academic website
    15923 MethylhydrazCNN -21 5837 http://msds.c academic website
    15924 Methylphospho
    CP(=O)(O)O 106 13220 http://msds.c academic website
    15925 Methylphospho
    CP(Cl)(Cl)=O 35 12150 http://msds.c academic website
    15926 Morpholine C1CNCCO1 -5 13837537 http://msds.c academic website
    15927 Myristic acid O=C(O)CCCCC 55.1 10539 http://msds.c academic website
    15928 N-(2-AminoethNCCNCCN -35 13835401 http://msds.c academic website
    15929 N-(2-AminoethNCCNCCNCCN -40 7905 http://msds.c academic website
    15930 N-(2-Hydroxy Oc1ccccc1NC( 205 11477 http://msds.c academic website
    15931 N-(3-AminoproNCCCNCCCCN 23.5 1071 http://msds.c academic website
    15932 N-(3-AminoproNCCCNCCCN -14 5729 http://msds.c academic website
    15933 N-(3-MethylbuOC(=O)C[C@H] 233 4586014 http://msds.c academic website
    15934 N-(3-Methylp O=C(C)Nc1cc( 65 11332993 http://msds.c academic website
    15935 N-(4-EthoxyphCCOc1ccc(cc1 134 4590 http://msds.c academic website
    15936 N-(4-Hydroxy Oc1ccc(cc1OC 57 2891 http://msds.c academic website
    15937 N-(4-Hydroxy Oc1ccc(NC(C) 170.5 1906 http://msds.c academic website
    15938 N-(4-NitropheO=C(C)Nc1ccc( 215 7407 http://msds.c academic website
    15939 N-(9H-FluorenCC(=O)Nc1ccc 194 5686 http://msds.c academic website
    15940 N-(9H-FluorenCC(=O)N(O)c1 136.5 5685 http://msds.c academic website
    15941 N-(Butylcarb Cc1ccc(cc1)S 128.5 5304 http://msds.c academic website
    15942 N,N,3-Trimethy
    CN(C)c2ccc(/N 68 5703 http://msds.c academic website
    15943 N,N,N',N',N'' CN(C)P(=O)(N( 7.2 12158 http://msds.c academic website
    15944 N,N'-Bis(2-amNCCNCCNCCN 12 21106175 http://msds.c academic website
    15945 N,N-Bis(2-chl O=P1(NCCCO1) 43 2804 http://msds.c academic website
    15946 N,N-Bis{2-[bi O=C(O)CN(CCN 220 2945 http://msds.c academic website
    15947 N,N-Diallylpr C=CCN(CC=C) -70 7335 http://msds.c academic website
    15948 N,N-DibutylbuCCCCN(CCCC) -70 7340 http://msds.c academic website
    15949 N,N-Diethyl- Cc1cccc(c1)C( -45 4133 http://msds.c academic website
    15950 N,N-DiethylaniCCN(CC)c1ccc -38 6794 http://msds.c academic website
    15951 N,N-DiethylbeCCN(CC)c1ccc 27 13839884 http://msds.c academic website
    15952 N,N-Diethyle CCN(CC)CC -115 8158 http://msds.c academic website
    15953 N,N-Diethylni O=C(N(CC)CC) 25 5296 http://msds.c academic website
    15954 N,N-Dimethyl CN(C)Cc1cccc -75 7398 http://msds.c academic website
    15955 N,N-Dimethyl-O=C(C(c1ccccc 133.5 13133 http://msds.c academic website
    15956 N,N-Dimethyl-CN(C)c1ccc(N 86 8419 http://msds.c academic website
    15957 N,N-Dimethyl CN(C)C(C)=O -20 29107 http://msds.c academic website
    15958 N,N-DimethylaCN(C)c1ccccc1 2 924 http://msds.c academic website
    15959 N,N-Dimethyl Nc1ccc(cc1)N( 35 13884246 http://msds.c academic website
    15960 N,N-Dimethyl CCN(C)C -140 11230 http://msds.c academic website
    15961 N,N-Dimethyl CN(C)C=O -61 5993 http://msds.c academic website
    15962 N,N-Dimethyl CN(C)C -117 1114 http://msds.c academic website
    15963 N,N-Dimethyl CN(C)CCCCCC -57 15396 http://msds.c academic website
    15964 N,N-Dimethyl C=CCN(C)C 0 21106097 http://msds.c academic website
    15965 N,N-Dimethyl CN(C)C(=O)CC -45 12425 http://msds.c academic website
    15966 N,N-DimethylpCN(C)c1ccncc 111 13646 http://msds.c academic website
    15967 N,N-Diphenylac1ccccc1N(c2c 127 11282 http://msds.c academic website
    15968 N'',N'''-Diph O=C(NNc1cccc 173 8459 http://msds.c academic website
    15969 N,N-Dipropyl CCCN(CCC)CC -93.5 7334 http://msds.c academic website
    15970 N,N''''-HexaneClc2ccc(NC(= 134 2612 http://msds.c academic website
    15971 N-[(4-AminophNc1ccc(cc1)S 182 5129 http://msds.c academic website
    15972 N-[(7S)-1,2,3 CC(=O)N[C@H] 142 5933 http://msds.c academic website
    15973 N-[2-(DimethyCN(C)CCN(C)C 18 17187 http://msds.c academic website
    15974 N~4~-(7-ChlorCCN(CC)CCCC( 87 2618 http://msds.c academic website
    15975 N~6~-(tert-BuO=C(O)[C@H]( 132 2006755 http://msds.c academic website
    15976 N-Acetyl-L-meO=C(C)N[C@@ 105.5 395338 http://msds.c academic website
    15977 N-Acetyl-L-tr O=C(O)[C@@H] 190 610602 http://msds.c academic website
    15978 N-Acetyl-L-tr CC(=O)NC(=O) 195 19951629 http://msds.c academic website
    15979 N-Acetyl-L-tyrOc1ccc(C[C@H 149 61606 http://msds.c academic website
    15980 Naphthalen-2Nc1ccc2ccccc 111.5 6790 http://msds.c academic website
    15981 Naphthalene c1cccc2ccccc1 77 906 http://msds.c academic website
    15982 Naphthalene-Nc1cc2ccccc2 190 63067 http://msds.c academic website
    15983 N-Benzyl-1-p C(NCc1ccccc1) -26 7373 http://msds.c academic website
    15984 N-Benzyl-9H-pn2cnc(NCc1cc 231 56177 http://msds.c academic website
    15985 N-Butylbutan CCCCNCCCC -60 7856 http://msds.c academic website
    15986 N-Cyclohexyl O=S(=O)(NC1C 84.5 6381 http://msds.c academic website
    15987 N-Cyclohexyl C1CCCCC1NC2 -1 7301 http://msds.c academic website
    15988 N-DecyldecanCCCCCCCCCCN 43 13623 http://msds.c academic website
    15989 N-Ethyl-4-me Cc1ccc(cc1)S( 64 6385 http://msds.c academic website
    15990 N-Ethyl-4-nitrCCNc1ccc(cc1) 96 18227 http://msds.c academic website
    15991 N-EthylanilineCCNc1ccccc1 -64 7387 http://msds.c academic website
    15992 N-Ethylethan CCNCC -50 7730 http://msds.c academic website
    15993 N-Ethyl-N-iso CC(C)N(CC)C(C -50 73565 http://msds.c academic website
    15994 N-HydroxyanilONc1ccccc1 83.5 7237 http://msds.c academic website
    15995 N-HydroxybutCC(CC)=NO -29.5 7020 http://msds.c academic website
    15996 N-HydroxycycON=C1/CCCCC 90 7236 http://msds.c academic website
    15997 N-Hydroxy-N-ON(C(=O)c1cc 119 60858 http://msds.c academic website
    15998 Nicotinamide NC(=O)c1cccn 130 911 http://msds.c academic website
    15999 Nicotinic acid O=C(O)c1cccn 237 913 http://msds.c academic website
    16000 Nicotinonitril N#Cc1cccnc1 50 78 http://msds.c academic website
    16001 N-Isopropylp CC(C)NC(C)C -61 7624 http://msds.c academic website
    16002 Nitric acid [O-][N+](=O)O -51 919 http://msds.c academic website
    16003 Nitric acid [O-][N+](=O)O -42 919 http://msds.c academic website
    16004 Nitrobenzene [O-][N+](=O)c 5 7138 http://msds.c academic website
    16005 Nitrogen oxid [O-][N+]#N -90.8 923 http://msds.c academic website
    16006 Nitromethane[O-][N+](C)=O -29 6135 http://msds.c academic website
    16007 Nitrosobenze O=Nc1ccccc1 65 10989 http://msds.c academic website
    16008 N-Methyl-4-niCNc1ccc(cc1)[ 152 7203 http://msds.c academic website
    16009 N-MethylacetCC(=O)NC 27 6334 http://msds.c academic website
    16010 N-MethylaniliCNc1ccccc1 -57 7234 http://msds.c academic website
    16011 N-Methylmet CNC -92 654 http://msds.c academic website
    16012 N-Nitrobenza O=C(N[N+]([O- 143 14262579 http://msds.c academic website
    16013 N-Nitroso-N-pO=NN(c1ccccc 66.5 6577 http://msds.c academic website
    16014 N-Octyloctan-CCCCCCCCNCC 14 2984 http://msds.c academic website
    16015 Nonacosane CCCCCCCCCCC 66 11903 http://msds.c academic website
    16016 NonadecafluorFC(F)(C(F)(F)C 78 9181 http://msds.c academic website
    16017 Nonadecane CCCCCCCCCCC 33 11895 http://msds.c academic website
    16018 NonadecanoicO=C(O)CCCCC 69 12071 http://msds.c academic website
    16019 Nonan-1-ol CCCCCCCCCO -7 8574 http://msds.c academic website
    16020 Nonanal CCCCCCCCC= -18 29029 http://msds.c academic website
    16021 Nonane CCCCCCCCC -53 7849 http://msds.c academic website
    16022 N-Pentylpent CCCCCNCCCC -44 15482 http://msds.c academic website
    16023 N-Phenylacet O=C(C)Nc1ccc 115 880 http://msds.c academic website
    16024 N-Phenylanili c1ccccc1Nc2c 53 11003 http://msds.c academic website
    16025 N-PhenylbenzNc2ccc(Nc1ccc 74 7283 http://msds.c academic website
    16026 N-PhenylformO=CNc1ccccc1 47 7388 http://msds.c academic website
    16027 N-Phenylnaphc1ccc3ccccc3 61 6746 http://msds.c academic website
    16028 N-Phenylnaphc1cc3ccccc3c 108 8355 http://msds.c academic website
    16029 N-Propylprop CCCNCCC -40 8562 http://msds.c academic website
    16030 N-tert-Butyl-NCSc1nc(NCC)nc 104 12874 http://msds.c academic website
    16031 O,O-Diethyl O-Clc1cc(Cl)c(C 42.5 2629 http://msds.c academic website
    16032 O,O-Dimethyl S=P(Oc1ccc(cc 36 3987 http://msds.c academic website
    16033 O,O-Dimethyl Cc1cc(ccc1SC 7 3229 http://msds.c academic website
    16034 O,O-Dimethyl COP(=S)(OC)S 72 2181 http://msds.c academic website
    16035 O,O-Dimethyl COP(=S)(OC)S 51.5 2973 http://msds.c academic website
    16036 O,S-Dimethyl NP(=O)(OC)SC 45 3954 http://msds.c academic website
    16037 o-Cresol Cc1ccccc1O 33 13835772 http://msds.c academic website
    16038 Octadecafluo FC(F)(C(F)(F)C( -25 9018 http://msds.c academic website
    16039 Octadecan-1- CCCCCCCCCCC 56 15016 http://msds.c academic website
    16040 Octadecyl 3-( CC(C)(C)c1cc 52.5 15539 http://msds.c academic website
    16041 o-Toluidine Cc1ccccc1N -16 13854136 http://msds.c academic website
    16042 Oxacyclohept O=C1CCCCCC 33.5 7695 http://msds.c academic website
    16043 Oxalaldehyde O=CC=O 15 7572 http://msds.c academic website
    16044 Oxanthrene c1ccc2Oc3ccc 122.5 8861 http://msds.c academic website
    16045 Oxirane C1CO1 -111 6114 http://msds.c academic website
    16046 Oxosulfane di O=S(=O)=O 16.8 23080 http://msds.c academic website
    16047 Oxosulfane oxO=S=O -73 1087 http://msds.c academic website
    16048 Palmitic acid O=C(O)CCCCC 62.5 960 http://msds.c academic website
    16049 p-Cresol Cc1ccc(O)cc1 34 13839082 http://msds.c academic website
    16050 Pent-1-ene CCCC=C -165 7713 http://msds.c academic website
    16051 Penta-1,4-die C=CCC=C -148 11099 http://msds.c academic website
    16052 PentabromophBrc1c(O)c(Br)c 230 11359 http://msds.c academic website
    16053 Pentachlorop Clc1c(O)c(Cl)c 174 967 http://msds.c academic website
    16054 PentadecafluoFC(F)(C(F)(F)C 55.5 9180 http://msds.c academic website
    16055 Pentadecane CCCCCCCCCCC 9.9 11885 http://msds.c academic website
    16056 PentadecanoicO=C(O)CCCCC 52 13249 http://msds.c academic website
    16057 PentaerythritoOCC(CO)(CO) 260.5 7984 http://msds.c academic website
    16058 Pentafluoro- FBr(F)(F)(F)F -60.5 23008 http://msds.c academic website
    16059 PentafluorophFc1c(F)c(F)c(F 35 12499 http://msds.c academic website
    16060 Pentan-1-ol CCCCCO -78 6040 http://msds.c academic website
    16061 Pentan-2-ol CC(O)CCC -50 21011 http://msds.c academic website
    16062 Pentan-2-one CC(=O)CCC -78 7607 http://msds.c academic website
    16063 Pentan-3-one CCC(=O)CC -40 7016 http://msds.c academic website
    16064 Pentane CCCCC -130 7712 http://msds.c academic website
    16065 Pentane-1,5-diSCCCCCS -72 63421 http://msds.c academic website
    16066 Pentane-2,3-dCC(=O)C(=O)C -52 11254 http://msds.c academic website
    16067 Pentane-2,4-dCC(=O)CC(C)= -23 29001 http://msds.c academic website
    16068 Perchloric aci O=Cl(=O)(=O) -17 22669 http://msds.c academic website
    16069 Periodic acid O=I(=O)(=O)O 122 58684 http://msds.c academic website
    16070 Perylene c1ccc5cccc4c 278 8788 http://msds.c academic website
    16071 Phenanthrenec2cc3ccc1cccc 100 970 http://msds.c academic website
    16072 PhenanthreneO=C2c3ccccc3 210 6505 http://msds.c academic website
    16073 Phenanthrene-N#Cc2cc3cccc 111 16353 http://msds.c academic website
    16074 Phenoxathiinec1ccc2Sc3ccc 59.5 8862 http://msds.c academic website
    16075 Phenyl vinyl s O=S(=O)(C=C) 68 71964 http://msds.c academic website
    16076 Phenyl(2-thie O=C(c1ccccc1) 57 60596 http://msds.c academic website
    16077 PhenylmethanOCc1ccccc1 -15 13860335 http://msds.c academic website
    16078 Phthalaldehy O=Cc1ccccc1 56 4642 http://msds.c academic website
    16079 Pregn-4-ene-3CC(=O)[C@H] 128 5773 http://msds.c academic website
    16080 Prop-1-ene C=CC -185 7954 http://msds.c academic website
    16081 Prop-2-en-1-oC=CCO -129 13872989 http://msds.c academic website
    16082 Propan-1-ol CCCO -127 1004 http://msds.c academic website
    16083 Propane CCC -188 6094 http://msds.c academic website
    16084 Propane-1,2,3-O=C(C)OC(COC 3 13835706 http://msds.c academic website
    16085 Propane-1,2,3-O=C(CCC)OC( -75 13849665 http://msds.c academic website
    16086 Propane-1,3-dNCCCN -12 415 http://msds.c academic website
    16087 Propane-1,3-diSCCCS -79 13848090 http://msds.c academic website
    16088 Propanoic anhCCC(=O)OC(= -45 29003 http://msds.c academic website
    16089 Propionaldeh CCC=O -81 512 http://msds.c academic website
    16090 Propionic acidCCC(=O)O -20.8 1005 http://msds.c academic website
    16091 PropiononitrilCCC#N -92 7566 http://msds.c academic website
    16092 PropiophenonO=C(CC)c1ccc 18 6881 http://msds.c academic website
    16093 Propyl 4-hydr Oc1ccc(cc1)C 96.5 6907 http://msds.c academic website
    16094 Propyl acetat CC(=O)OCCC -95 7706 http://msds.c academic website
    16095 PropylbenzenCCCc1ccccc1 -99 7385 http://msds.c academic website
    16096 Propylene glycCC(O)CO -60 13835224 http://msds.c academic website
    16097 p-Toluidine Cc1ccc(N)cc1 43 13835151 http://msds.c academic website
    16098 Pyrazine c1cnccn1 55 8904 http://msds.c academic website
    16099 Pyren-1-amin Nc4ccc1ccc2c 116 14613 http://msds.c academic website
    16100 Pyrene c1ccc2ccc3cc 150 29153 http://msds.c academic website
    16101 Pyridine c1ccccn1 -42 1020 http://msds.c academic website
    16102 Pyridine-2-thi Sc1ccccn1 129 2005897 http://msds.c academic website
    16103 Pyridine-2-thi [O-][n+]1cccc 70.5 10446934 http://msds.c academic website
    16104 Pyrimidine c1ccncn1 21 8903 http://msds.c academic website
    16105 Pyrocatechol Oc1ccccc1O 105 13837760 http://msds.c academic website
    16106 Pyrrolidine C1CCCN1 -60 29008 http://msds.c academic website
    16107 Quinolin-8-ol Oc1cccc2cccn 76 1847 http://msds.c academic website
    16108 Resorcinol Oc1cccc(O)c1 111 4878 http://msds.c academic website
    16109 Retinoic acid CC=1CCC[C@]( 189.5 392618 http://msds.c academic website
    16110 Retinol CC=1CCC[C@]( 63 393012 http://msds.c academic website
    16111 S,S'-1,4-Dioxa S=P(SC1OCCOC -20 6283 http://msds.c academic website
    16112 SalicylaldehydO=Cc1ccccc1 1.5 13863618 http://msds.c academic website
    16113 Salicylamide O=C(N)c1cccc 140 4963 http://msds.c academic website
    16114 Salicylic acid OC(=O)c1cccc 161 331 http://msds.c academic website
    16115 Salicylonitrile N#Cc1ccccc1O 93.5 11413 http://msds.c academic website
    16116 Sebacic acid O=C(O)CCCCC 134.5 5004 http://msds.c academic website
    16117 Stearic acid O=C(O)CCCCC 68 5091 http://msds.c academic website
    16118 Strychnidin-1 O=C2C[C@@H] 286 389877 http://msds.c academic website
    16119 Styrene C=Cc1ccccc1 -31 7220 http://msds.c academic website
    16120 Suberic acid O=C(O)CCCCC 143 10025 http://msds.c academic website
    16121 Succinic acid O=C(O)CCC(= 185 1078 http://msds.c academic website
    16122 SulfanylaceticO=C(O)CS -16.5 1101 http://msds.c academic website
    16123 Sulfuric acid O=S(=O)(O)O -2 1086 http://msds.c academic website
    16124 SulfurochloridClS(=O)(=O)O -80 23040 http://msds.c academic website
    16125 SulfurofluoridiFS(=O)(=O)O -87.3 23005 http://msds.c academic website
    16126 Sulfuryl dichloClS(Cl)(=O)=O -54 23050 http://msds.c academic website
    16127 Sulfuryl difluoFS(F)(=O)=O -135.8 16647 http://msds.c academic website
    16128 Tartaric acid O=C(O)C(O)C( 210 852 http://msds.c academic website
    16129 TerephthalonitN#Cc1ccc(C#N 225.5 11672 http://msds.c academic website
    16130 tert-Butyl be CC(C)(C)OOC( 8 11472 http://msds.c academic website
    16131 tert-Butyl hy CC(C)(C)OO -3 6170 http://msds.c academic website
    16132 tert-Butylben CC(C)(C)c1ccc -59.5 7088 http://msds.c academic website
    16133 Tetrabromog Br[Ge](Br)(Br) 26 24230 http://msds.c academic webx metal - AL
    16134 Tetracene c1cccc2cc3cc4 350 6813 http://msds.c academic website
    16135 Tetrachlorom ClC(Cl)(Cl)Cl -23 5730 http://msds.c academic website
    16136 Tetradec-1-enCCCCCCCCCCC -13 13622 http://msds.c academic website
    16137 TetradecafluoFC(F)(C(F)(F)C( -4 9262 http://msds.c academic website
    16138 Tetradecane CCCCCCCCCCC 5.5 11883 http://msds.c academic website
    16139 Tetradecylbe CCCCCCCCCCC 9 14358 http://msds.c academic website
    16140 Tetraethyl ortCCO[Si](OCC) -86 6270 http://msds.c academic website
    16141 Tetrafluoroet F/C(F)=C(/F)F -142.5 8000 http://msds.c academic website
    16142 Tetrafluorom FC(F)(F)F -184 6153 http://msds.c academic website
    16143 TetrahydrofurC1CCCO1 -108 7737 http://msds.c academic website
    16144 Tetrahydroth C1CCCS1 -96 1095 http://msds.c academic website
    16145 TetramethylpyCc1nc(C)c(C)n 85 13658 http://msds.c academic website
    16146 Tetranitrome O=[N+]([O-])C 14 13842838 http://msds.c academic website
    16147 Tetraphene c1c4ccccc4cc3 158 5739 http://msds.c academic website
    16148 Thionyl dichloClS(Cl)=O -104 22797 http://msds.c academic website
    16149 Thionyl difluo FS(F)=O -110.5 22954 http://msds.c academic website
    16150 Thiophene c1cccs1 -38 7739 http://msds.c academic website
    16151 Thiourea NC(N)=S 175.5 2005981 http://msds.c academic website
    16152 Thioxometha O=C=S -139 9644 http://msds.c academic website
    16153 Thymidine CC1=CN(C(=O 188 5585 http://msds.c academic website
    16154 Thymine CC1=CNC(=O) 316.5 1103 http://msds.c academic website
    16155 Thymol CC(C)c1ccc(C) 49 21105998 http://msds.c academic website
    16156 Toluene Cc1ccccc1 -93 1108 http://msds.c academic website
    16157 Triacontane CCCCCCCCCCC 66 12018 http://msds.c academic website
    16158 TribromoacetiBrC(Br)(Br)C( 131.5 6175 http://msds.c academic website
    16159 Tributyl boratCCCCOB(OCCC -70 12189 http://msds.c academic website
    16160 Tributyl phos CCCCOP(=O)( -80 29090 http://msds.c academic website
    16161 TributylphospCCCCP(CCCC) -60 13231 http://msds.c academic website
    16162 Trichloro(~2 ClC(Cl)(Cl)[2H] -64 64654 http://msds.c academic website
    16163 Trichloro(flu ClC(Cl)(Cl)F -110.5 6149 http://msds.c academic website
    16164 Trichloro(nit ClC(Cl)(Cl)[N+ -69.2 13861343 http://msds.c academic website
    16165 Trichloroacet ClC(Cl)(Cl)C=O -57.5 13863645 http://msds.c academic website
    16166 TrichloroacetiClC(Cl)(Cl)C(= 57 10772050 http://msds.c academic website
    16167 TrichloroacetoClC(Cl)(Cl)C#N -42 13861934 http://msds.c academic website
    16168 TrichloroacetyClC(Cl)(Cl)C(C -146 6180 http://msds.c academic website
    16169 Tricosane CCCCCCCCCCC 49 12017 http://msds.c academic website
    16170 Tridecafluoro FC(F)(C(F)(F)C 30 61135 http://msds.c academic website
    16171 Tridecan-2-onCC(=O)CCCCC 24 11132 http://msds.c academic website
    16172 Tridecane CCCCCCCCCCC -5 11882 http://msds.c academic website
    16173 Tridecanoic acO=C(O)CCCCC 41.5 12013 http://msds.c academic website
    16174 Triethyl phos CCOP(=O)(OC -56 6287 http://msds.c academic website
    16175 Trifluoroaceti FC(F)(F)C(=O) -15 10239201 http://msds.c academic website
    16176 Trifluoroaceti FC(F)(F)C(=O) -63 21106178 http://msds.c academic website
    16177 Trifluoro-la FBr(F)F 8.8 22996 http://msds.c academic website
    16178 Trifluoro-lam FCl(F)F -76.3 23039 http://msds.c academic website
    16179 TrifluoromethFC(F)(F)S(=O) -40 56192 http://msds.c academic website
    16180 Trimethoxysil CO[SiH](OC)O -115 16295 http://msds.c academic website
    16181 Trimethyl bor COB(OC)OC -34 8157 http://msds.c academic website
    16182 Trimethyl phoCOP(OC)OC 111 8159 http://msds.c academic webx took bp instead of mp JCB
    16183 Trioctyl phos O=P(OCCCCCC -74 14961 http://msds.c academic website
    16184 Trioctylphosp CCCCCCCCP(= 52 59020 http://msds.c academic website
    16185 Trioxid-2-en- [O-][O+]=O -193 23208 http://msds.c academic website
    16186 Trioxochromi O=[Cr](=O)=O 197 14212 http://msds.c academic webx metal - AL
    16187 Triphenyl phoO=P(Oc1ccccc 50.5 7988 http://msds.c academic website
    16188 Triphenyl phoO(P(Oc1ccccc1 23 7259 http://msds.c academic website
    16189 Triphenylmet OC(c1ccccc1)( 163 6215 http://msds.c academic website
    16190 Triphenylphosc1ccccc1P(c2c 80.5 11283 http://msds.c academic website
    16191 Tris(2-butoxy CCCCOCCOP(= -70 6292 http://msds.c academic website
    16192 Tris(2-ethylheCCCCC(COP(=O -70 6289 http://msds.c academic website
    16193 Tris(2-methyl Cc3ccccc3OP( -33 21106216 http://msds.c academic website
    16194 TritriacontaneCCCCCCCCCCC 72 11905 http://msds.c academic website
    16195 Tropic acid OCC(C(=O)O)c 118 10274 http://msds.c academic website
    16196 Undecafluoro(FC1(F)C(F)(F)C -37 9260 http://msds.c academic website
    16197 Undecan-1-ol CCCCCCCCCC 11 7892 http://msds.c academic website
    16198 Undecan-2-onCC(=O)CCCCC 12 7871 http://msds.c academic website
    16199 Undecane CCCCCCCCCCC -26 13619 http://msds.c academic website
    16200 UndecanedioicO=C(O)CCCCC 109 15037 http://msds.c academic website
    16201 Undecanoic acO=C(O)CCCCC 28.5 7888 http://msds.c academic website
    16202 UndecylbenzeCCCCCCCCCCC -5 21703 http://msds.c academic website
    16203 Uracil O=C1C=CNC(= 330 1141 http://msds.c academic website
    16204 Urea NC(N)=O 136 1143 http://msds.c academic website
    16205 ValeraldehydeCCCCC=O -91.5 7772 http://msds.c academic website
    16206 Valeronitrile CCCCC#N -96 7770 http://msds.c academic website
    16207 Vinyl 2-ethyl C=COC(=O)C(C -90 56135 http://msds.c academic website
    16208 Vinyl acetate CC(=O)OC=C -100 7616 http://msds.c academic website
    16209 Vinyl stearateC=COC(=O)CC 36 59467 http://msds.c academic website
    16210 Fomepizole Cc1cnnc1 25 3289 http://www.dDrugBank
    16211 F-Loop of Vit C[C@H](O)C[ 25 5641721 http://www.dDrugBank
    16212 Spermine (Ful[NH3+]CCC[N 29 394003 http://www.dDrugBank
    16213 TranylcypromN[C@@H]2CC2 79.5 390008 http://www.dDrugBank
    16214 Cabergoline CCNC(=O)N(C 103 49452 http://www.dDrugBank
    16215 Famciclovir CC(=O)OCC(CO 103 3207 http://www.dDrugBank
    16216 Pentoxifylline CC(=O)CCCCN2 105 4578 http://www.dDrugBank
    16217 Gentamicin CC(NC)C1CCC( 105 3348 http://www.dDrugBank
    16218 Talbutal CN1C(=O)C(CC 109 527603 http://www.dDrugBank
    16219 Toremifene CN(C)CCOc1ccc 109 2275722 http://www.dDrugBank
    16220 Cisapride Clc1cc(c(OC) 110 2667 http://www.dDrugBank
    16221 Fenfluramine FC(F)(F)c1ccc 110 3220 http://www.dDrugBank
    16222 Flutamide O=C(Nc1cc(c(c 112 3280 http://www.dDrugBank
    16223 Miglitol OCCN1C[C@H] 114 390074 http://www.dDrugBank
    16224 Mirtazapine CN1CC2N(CC1) 115 4060 http://www.dDrugBank
    16225 Capecitabine O=C(OCCCCC) 115.5 54916 http://www.dDrugBank
    16226 Alprostadil O[C@@H]1CC( 115.5 4444306 http://www.dDrugBank
    16227 Valrubicin CCCCC(=O)OCC 116.5 38088 http://www.dDrugBank
    16228 Valsartan O=C(O)[C@H]( 116.5 54833 http://www.dDrugBank
    16229 Deferasirox O=C(O)c1ccc( 116.5 10770206 http://www.dDrugBank
    16230 Clavulanate OC(=O)[C@H] 117.75 4444466 http://www.dDrugBank
    16231 Nandrolone dCCCCCCCCCC( 118 9296 http://www.dDrugBank
    16232 BeclomethasoOCC(=O)[C@] 118.5 19276 http://www.dDrugBank
    16233 Riluzole FC(F)(F)Oc1cc 119 4892 http://www.dDrugBank
    16234 Terbutaline Oc1cc(cc(O)c1 120.5 5210 http://www.dDrugBank
    16235 Trandolapril O=C(OCC)[C@ 121 4588590 http://www.dDrugBank
    16236 Fluvoxamine FC(F)(F)c1cc 121.25 4514696 http://www.dDrugBank
    16237 Rosiglitazone CN(CCOc2ccc( 122.5 70383 http://www.dDrugBank
    16238 Penicillin V OC(=O)[C@@H 124 6607 http://www.dDrugBank
    16239 Nimodipine CC=1NC(C)=C( 125 4341 http://www.dDrugBank
    16240 Valproic Acid CCCC(CCC)C(= 125 3009 http://www.dDrugBank
    16241 Quinapril O=C(OCC)[C@H 125 49565 http://www.dDrugBank
    16242 Tacrolimus O[C@@H]1CC[ 126 4976056 http://www.dDrugBank
    16243 Terconazole CC(C)N1CCN(C 126.3 390122 http://www.dDrugBank
    16244 Cefditoren Nc1scc(n1)C( 128 4942398 http://www.dDrugBank
    16245 Voriconazole O[C@@](Cn1cn 128.5 64684 http://www.dDrugBank
    16246 Proguanil Clc1ccc(NC(/N 129 4754 http://www.dDrugBank
    16247 Oxybutynin OC(C(=O)OCC# 129.5 4473 http://www.dDrugBank
    16248 Clonidine Clc2cccc(Cl) 130 2701 http://www.dDrugBank
    16249 Paroxetine Fc1ccc(cc1) 130 39888 http://www.dDrugBank
    16250 Anastrozole N#CC(C)(C)c1c 130.14 2102 http://www.dDrugBank
    16251 Repaglinide O=C(O)c1ccc( 130.5 59377 http://www.dDrugBank
    16252 Brinzolamide NS(=O)(=O)c1 131 62077 http://www.dDrugBank
    16253 Progabide O=C2C=CC(F)= 134 4514729 http://www.dDrugBank
    16254 Echothiophat C[N+](C)(C)C 138 10108 http://www.dDrugBank
    16255 Emtricitabine FC1=CN(C(=O 138 54859 http://www.dDrugBank
    16256 Zafirlukast Cc1ccccc1S(= 139 5515 http://www.dDrugBank
    16257 PhenmetrazinCC2NCCOC2c1 139 4598 http://www.dDrugBank
    16258 Fluconazole OC(Cn1cncn1) 139 3248 http://www.dDrugBank
    16259 ThioproperaziCN(C)S(=O)(= 140 9058 http://www.dDrugBank
    16260 Efavirenz FC(F)(F)[C@@ 140 57715 http://www.dDrugBank
    16261 NADH Nc5ncnc1c5n 141 388299 http://www.dDrugBank
    16262 Selegiline C#CCN(C)[C@H 141.5 24930 http://www.dDrugBank
    16263 Cimetidine CN=C(/NC#N) 142 2654 http://www.dDrugBank
    16264 Phenylephrin O[C@@H](CNC 142.5 5818 http://www.dDrugBank
    16265 Swainsonine O[C@H]2CCC 143.5 9151169 http://www.dDrugBank
    16266 Enalapril OC(=O)[C@@H 143.75 4514913 http://www.dDrugBank
    16267 SelenocysteinO=C(O)[C@@H 144.5 23436 http://www.dDrugBank x metal - AL
    16268 Zileuton NC(=O)N(O)C( 144.7 54531 http://www.dDrugBank
    16269 Felodipine CC=1NC(C)=C( 145 3216 http://www.dDrugBank
    16270 Raloxifene Oc1ccc(cc1)c 145 4859 http://www.dDrugBank
    16271 Gallamine Tri CCN(CC)CCOc1 147.5 60750 http://www.dDrugBank
    16272 Fosinopril O=C(CP(=O)(C 151 50469 http://www.dDrugBank
    16273 BenzphetaminCN(Cc1ccccc1) 152.5 2251 http://www.dDrugBank
    16274 PyridostigminO=C(Oc1ccc[n+ 153 4817 http://www.dDrugBank
    16275 Tegaserod CCCCCN=C(/N 155 4589305 http://www.dDrugBank
    16276 Exemestane O=C3C=C4C(= 155.13 54278 http://www.dDrugBank
    16277 OrphenadrineCN(C)CCOC(c1 156.5 4440 http://www.dDrugBank
    16278 AminolevulinicNCC(=O)CCC( 157 134 http://www.dDrugBank
    16279 Clopidogrel Clc1ccccc1[C 158 54632 http://www.dDrugBank
    16280 Nitrendipine CC=1NC(C)=C( 158 4351 http://www.dDrugBank
    16281 Zaleplon CC(=O)N(CC)c 158 5517 http://www.dDrugBank
    16282 Stavudine CC1=CN(C(=O 159.5 17270 http://www.dDrugBank
    16283 Atorvastatin O[C@H](CCn1c 159.95 54810 http://www.dDrugBank
    16284 Nystatin O=C(O)C1C(O 160 21429752 http://www.dDrugBank
    16285 Warfarin CC(=O)CC(C=1 161 6436 http://www.dDrugBank
    16286 Miconazole Clc3ccc(C(OCc 161 4044 http://www.dDrugBank
    16287 Lamivudine NC1=NC(=O)N 161 54812 http://www.dDrugBank
    16288 Didanosine O=C3N=CNc1c 161.5 45864 http://www.dDrugBank
    16289 Zonisamide NS(=O)(=O)Cc 162 5532 http://www.dDrugBank
    16290 Gabapentin NCC1(CC(=O) 164 3328 http://www.dDrugBank
    16291 Torasemide O=S(=O)(NC(= 164 38123 http://www.dDrugBank
    16292 Abacavir OC[C@@H]1C= 165 390063 http://www.dDrugBank
    16293 Modafinil O=S(CC(N)=O)C 165 4088 http://www.dDrugBank
    16294 Leflunomide Cc2oncc2C(=O) 165.5 3762 http://www.dDrugBank
    16295 Itraconazole CC(CC)N1N=CN 166.2 49927 http://www.dDrugBank
    16296 Aldosterone OCC(=O)[C@H 166.5 5633 http://www.dDrugBank
    16297 ProcainamideO=C(NCCN(CC) 167 4744 http://www.dDrugBank
    16298 Indinavir O[C@H](CN1CC 167.75 4515036 http://www.dDrugBank
    16299 Gemcitabine NC1=NC(=O)N 168.64 54753 http://www.dDrugBank
    16300 Isradipine O=C(OC)C3=C( 169 3652 http://www.dDrugBank
    16301 Amphotericin O=C(O)[C@@H 170 4444451 http://www.dDrugBank
    16302 Diethyltrypta CCN(CC)CCc2c 170 5865 http://www.dDrugBank
    16303 Sumatriptan CNS(=O)(=O)C 170 5165 http://www.dDrugBank
    16304 Miglustat OC[C@H]1N(C 170.5 46764 http://www.dDrugBank
    16305 Lovastatin C[C@@H](CC) 174.5 48085 http://www.dDrugBank
    16306 Ribavirin NC(=O)c1ncn 175 34439 http://www.dDrugBank
    16307 Lactulose O[C@H]2[C@H 175.5 10856 http://www.dDrugBank
    16308 Adenosine tri O=P(O)(O)OP 176 5742 http://www.dDrugBank
    16309 Olmesartan CC=5OC(=O)OC 177.5 115748 http://www.dDrugBank
    16310 Amlodipine O=C(OC)C1=C( 178.5 2077 http://www.dDrugBank
    16311 Rizatriptan CN(C)CCc2cnc 179 4900 http://www.dDrugBank
    16312 PhenprocoumO=C1c3ccccc3 179.5 9524 http://www.dDrugBank
    16313 Lansoprazole FC(F)(F)COc3c 180 3746 http://www.dDrugBank
    16314 Fluoxetine FC(F)(F)c2ccc 180.5 3269 http://www.dDrugBank
    16315 Tramadol O[C@@]1(CCC 180.5 31105 http://www.dDrugBank
    16316 Irbesartan CCCCC5=NC1(C 180.5 3618 http://www.dDrugBank
    16317 5-Methoxy-N,N
    CC(C)N(CCc2c 181 133247 http://www.dDrugBank
    16318 Tridihexethyl OC(CC[N+](CC 181.5 19124 http://www.dDrugBank
    16319 Raltitrexed O=C(N[C@@H]( 182 94568 http://www.dDrugBank
    16320 Citalopram CN(C)CCCC2(O 182.5 2669 http://www.dDrugBank
    16321 Proparacaine CCN(CC)CCOC( 182.65 4766 http://www.dDrugBank
    16322 Gatifloxacin CC1CN(CCN1)c 183.5 5186 http://www.dDrugBank
    16323 Pioglitazone CCc1ccc(nc1) 183.5 4663 http://www.dDrugBank
    16324 Letrozole N#Cc1ccc(cc1) 184.5 3765 http://www.dDrugBank
    16325 Troglitazone Cc1c(O)c(C)c 185 5389 http://www.dDrugBank
    16326 Doxepin CN(C)CCC=C1c 185 580858 http://www.dDrugBank
    16327 AcetohexamidO=C(NC1CCCCC 189 1912 http://www.dDrugBank
    16328 Atracurium COc1ccc(cc1O 189.5 43067 http://www.dDrugBank
    16329 Sildenafil CN1CCN(CC1)S 189.5 5023 http://www.dDrugBank
    16330 Hydroxyzine Clc1ccc(cc1) 190 3531 http://www.dDrugBank
    16331 Oxyphenoniu OC(C(=O)OCC[ 191.5 5547 http://www.dDrugBank
    16332 Sibutramine CN(C)C(CC(C)C 191.5 5021 http://www.dDrugBank
    16333 Vardenafil CCN1CCN(CC1) 192 99300 http://www.dDrugBank
    16334 Bicalutamide Fc1ccc(cc1)S( 192 2284 http://www.dDrugBank
    16335 Glycopyrrolat C[N+]3(C)CCC 192.5 3374 http://www.dDrugBank
    16336 Mifepristone CN(C)c1ccc( 193.5 49889 http://www.dDrugBank
    16337 Amoxicillin OC(=O)[C@@H 194 31006 http://www.dDrugBank
    16338 Olanzapine CN1CCN(CC1)C 195 4424 http://www.dDrugBank
    16339 BenzoylecgonCN1[C@H]2CC 195 395095 http://www.dDrugBank
    16340 Fluvastatin O=C(O)C[C@@H 195.5 1265982 http://www.dDrugBank
    16341 Terbinafine CC(C)(C)C#CC 196.5 1266005 http://www.dDrugBank
    16342 L-Carnitine C[N+](C)(C)C[ 196.5 10455 http://www.dDrugBank
    16343 Cefadroxil CC=3CSC2C(NC 197 2511 http://www.dDrugBank
    16344 Acenocoumaro
    [O-][N+](=O) 197 8700 http://www.dDrugBank
    16345 Carprofen O=C(O)C(C)c1c 197.5 2483 http://www.dDrugBank
    16346 Ambenonium Clc2ccccc2C[N 197.5 2046 http://www.dDrugBank
    16347 Piroxicam O=C2c1ccccc1 199 4444107 http://www.dDrugBank
    16348 Dronabinol CCCCCc2cc1OC 200 15266 http://www.dDrugBank
    16349 Doxycycline NC(=O)C=4C(= 201 10469369 http://www.dDrugBank
    16350 Midodrine COc1ccc(cc1C 201.5 4050 http://www.dDrugBank
    16351 Nitazoxanide O=C(Nc1ncc(s1 202 38037 http://www.dDrugBank
    16352 Buspirone O=C4CC1(CCC 202 2383 http://www.dDrugBank
    16353 Naloxone O=C1CC[C@@] 202.5 4447644 http://www.dDrugBank
    16354 Cloxazolam Clc1ccccc1C3 203 2714 http://www.dDrugBank
    16355 Niflumic Acid FC(F)(F)c1cc( 203 4333 http://www.dDrugBank
    16356 Phentermine NC(C)(C)Cc1cc 205 4607 http://www.dDrugBank
    16357 N-Acetyl-D-gl OC1O[C@H](C 205 388319 http://www.dDrugBank
    16358 Sodium lauryl OS(=O)(=O)O 205.5 8448 http://www.dDrugBank
    16359 Epinastine NC2=NCC3c4cc 206.5 3128 http://www.dDrugBank
    16360 Donepezil COc1cc2C(=O) 206.72 3040 http://www.dDrugBank
    16361 Glimepiride CC=3CN(C(=O) 207 3357 http://www.dDrugBank
    16362 Brimonidine Brc2c3nccnc 207.5 2341 http://www.dDrugBank
    16363 Glipizide Cc1cnc(cn1)C 208.5 3359 http://www.dDrugBank
    16364 Carbachol C[N+](C)(C)C 210 2454 http://www.dDrugBank
    16365 Colistin CC(CC)CCCC( 210 4470591 http://www.dDrugBank
    16366 Levobunolol CC(C)(C)NC[C 210 36089 http://www.dDrugBank
    16367 Tenoxicam O=C2c1sccc1S 211 4471584 http://www.dDrugBank
    16368 TemozolomidNC(=O)c1ncn2 212 5201 http://www.dDrugBank
    16369 Nortriptyline CNCCC=C1c3cc 214 4384 http://www.dDrugBank
    16370 Paclitaxel O=C(N[C@@H] 214.5 10368587 http://www.dDrugBank
    16371 Pancuronium C[N+]1(CCCC 215 390052 http://www.dDrugBank
    16372 Gentian VioletC/[N+](C)=C1C 215 3349 http://www.dDrugBank
    16373 Cladribine Nc3nc(Cl)nc 215 19105 http://www.dDrugBank
    16374 Topotecan CN(C)Cc1c2cc 215.5 54705 http://www.dDrugBank
    16375 Desipramine CNCCCN2c3ccc 216 2888 http://www.dDrugBank x salt JCB
    16376 OxybuprocainCCN(CC)CCOC( 216.5 4472 http://www.dDrugBank
    16377 Lamotrigine Clc1cccc(c1Cl 217 3741 http://www.dDrugBank
    16378 Megestrol CC(=O)[C@@] 219 18023 http://www.dDrugBank
    16379 Mometasone ClCC(=O)[C@ 219 110210 http://www.dDrugBank
    16380 Vincristine O=C(OC)[C@@ 220 5758 http://www.dDrugBank
    16381 DiphenoxylateO=C(OCC)C3(C 221 12919 http://www.dDrugBank
    16382 Cefprozil Oc1ccc(cc1) 221.5 4444481 http://www.dDrugBank
    16383 Cefixime Nc1scc(n1)/ 221.5 4882023 http://www.dDrugBank
    16384 Cefuroxime CON=C(/c1cc 221.5 4514699 http://www.dDrugBank
    16385 Demeclocycli NC(O)=C3/C(= 221.5 4470600 http://www.dDrugBank
    16386 Loteprednol O=C(OCCl)[C 222 392049 http://www.dDrugBank
    16387 Irinotecan CC[C@]3(O)C= 222.5 54825 http://www.dDrugBank
    16388 Procarbazine CC(C)NC(=O)c 223 4746 http://www.dDrugBank
    16389 Bacitracin O=C(O)C[C@H 223 388635 http://www.dDrugBank
    16390 MethylphenidO=C(OC)C(C1C 225 4015 http://www.dDrugBank
    16391 Budesonide OCC(=O)[C@] 226.5 56704 http://www.dDrugBank
    16392 Delavirdine O=C(c1cc2cc( 227 5423 http://www.dDrugBank
    16393 Dienestrol Oc1ccc(cc1)C( 227.5 580857 http://www.dDrugBank
    16394 Loperamide CN(C)C(=O)C(C 228 3818 http://www.dDrugBank
    16395 Guanabenz Clc1cccc(Cl)c 228 4642445 http://www.dDrugBank
    16396 Alprazolam Clc1cc2C(=NC 228.25 2034 http://www.dDrugBank
    16397 Pentagastrin NC(=O)[C@H]( 229 392037 http://www.dDrugBank
    16398 Ipratropium bC[N+]2(C(C)C 231 39400 http://www.dDrugBank
    16399 Benzthiazide NS(=O)(=O)c3 231.5 2253 http://www.dDrugBank
    16400 Bupropion O=C(c1cc(Cl)c 233.5 431 http://www.dDrugBank
    16401 Triazolam Clc4ccccc4C1= 234 5355 http://www.dDrugBank
    16402 Methadone O=C(C(c1cccc 235 559067 http://www.dDrugBank x HBr Salt - EC
    16403 ChlordiazepoxClC=1C=CC2=N 236.2 2611 http://www.dDrugBank
    16404 RescinnamineCOc1cc(cc(O 238.5 4444446 http://www.dDrugBank
    16405 Cetyl-Trimet C[N+](C)(C)C 240 2580 http://www.dDrugBank
    16406 Amiloride Clc1nc(C(=O) 240 15403 http://www.dDrugBank
    16407 3-HydroxyanthNc1c(cccc1O) 240 84 http://www.dDrugBank
    16408 Moxifloxacin O=C(O)C2=CN 240 134802 http://www.dDrugBank
    16409 TTNPB O=C(O)c1ccc(c 240.5 4451454 http://www.dDrugBank
    16410 Clidinium OC(c1ccccc1) 240.5 2682 http://www.dDrugBank
    16411 Cromoglicate O=C(O)C1=CC( 241.5 25758 http://www.dDrugBank
    16412 O-PhosphoethO=P(O)(O)OC 242 21428496 http://www.dDrugBank
    16413 DactinomycinCC(C)C6NC(=O 242.25 1942 http://www.dDrugBank
    16414 Sertraline Clc1ccc(cc1C 244 61881 http://www.dDrugBank
    16415 Flunisolide OCC(=O)[C@] 245 74144 http://www.dDrugBank
    16416 Ropinirole CCCN(CCC)CCc 246.5 4916 http://www.dDrugBank
    16417 Thiamine Cc2nc(N)c(C[n 248 1098 http://www.dDrugBank
    16418 Olopatadine O=C(O)Cc1ccc 248 4444528 http://www.dDrugBank
    16419 Quinacrine CCN(CC)CCCC( 249 232 http://www.dDrugBank
    16420 Digoxin O=C1C=C(CO1 249 28162 http://www.dDrugBank
    16421 Ganciclovir OCC(CO)OCn2 250 3336 http://www.dDrugBank
    16422 Flurandrenoli OCC(=O)[C@] 251 14475 http://www.dDrugBank
    16423 Digitoxin O=C1C=C(CO1 255.5 389987 http://www.dDrugBank
    16424 Pemoline NC1=NC(=O)C( 256 4561 http://www.dDrugBank
    16425 Ciprofloxacin O=C(O)C2=CN( 256 2662 http://www.dDrugBank
    16426 Aciclovir NC=2Nc1c(nc 256.75 1945 http://www.dDrugBank
    16427 Fludarabine O=P(O)(O)OC 260 28532 http://www.dDrugBank
    16428 Telmisartan O=C(O)c1cccc 262 59391 http://www.dDrugBank
    16429 Levamisole N1=C3SCCN3C 264.5 25037 http://www.dDrugBank
    16430 Vinblastine O=C(OC)[C@@ 267 211446 http://www.dDrugBank
    16431 Decamethoni C[N+](C)(C)C 269 2862 http://www.dDrugBank
    16432 AdamantanonO=C3[C@@H]1 270 16743818 http://www.dDrugBank
    16433 Fluticasone P O=C(SCF)[C@ 272.5 392059 http://www.dDrugBank
    16434 Tetraphenylp c1ccccc1[P+]( 273 144579 http://www.dDrugBank
    16435 CamptothecinCC[C@]1(O)C 276 22775 http://www.dDrugBank
    16436 Penciclovir OCC(CO)CCn2 276 4563 http://www.dDrugBank
    16437 Dolasetron O=C(OC1CC3C 278 54666 http://www.dDrugBank
    16438 Tenofovir O=P(O)(O)CO[ 278 408154 http://www.dDrugBank
    16439 Dasatinib Cc4cccc(Cl)c 283 2323020 http://www.dDrugBank
    16440 Diclofenac Clc2cccc(Cl)c 284 2925 http://www.dDrugBank x sodium salt JCB
    16441 Dorzolamide NS(=O)(=O)c1 284 3042 http://www.dDrugBank
    16442 Doxazosin COc1cc2nc(nc 289.5 3045 http://www.dDrugBank
    16443 Dicumarol OC=4Oc1ccccc 290 633 http://www.dDrugBank
    16444 Imiquimod CC(C)Cn3cnc2 293 51809 http://www.dDrugBank
    16445 Flucytosine NC=1NC(=O)N 296 3249 http://www.dDrugBank
    16446 8-Azaguanine OC=1NC(N)=N 300 8325 http://www.dDrugBank
    16447 Tadalafil O=C6N(C)CC( 301.5 99301 http://www.dDrugBank
    16448 MercaptopuriS=C2N=CNc1n 313 580869 http://www.dDrugBank
    16449 Pravastatin O=C(O)C[C@H 326 49398 http://www.dDrugBank
    16450 Cephalexin CC=3CS[C@H]2 326.8 25541 http://www.dDrugBank
    16451 Cefaclor ClC=3CS[C@H] 327 37396 http://www.dDrugBank
    16452 Diazoxide Clc1ccc2NC(C 330.5 2911 http://www.dDrugBank
    16453 Nelfinavir Oc1cccc(c1C) 349.84 57718 http://www.dDrugBank
    16454 Saquinavir NC(=O)C[C@H] 349.84 54783 http://www.dDrugBank
    16455 Chlorothiazid NS(=O)(=O)c2 350 2619 http://www.dDrugBank
    16456 Allopurinol O=C2N=CN=C 350 2010 http://www.dDrugBank
    16457 Succimer O=C(O)C(S)C( 193 8988 http://www.dDrugBank
    16458 Spermine NCCCNCCCCN 28 1072 http://www.dDrugBank
    16459 MechlorethamClCCN(C)CCCl 109.5 3893 http://www.dDrugBank x salt JCB
    16460 Codeine COc5ccc1C[C 155 4447447 http://www.dDrugBank
    16461 Epirubicin OCC(=O)[C@@] 344.53 38201 http://www.dDrugBank
    16462 PhenylpropanO[C@@H](c1c 192 25082 http://www.dDrugBank
    16463 L-Isoleucine C[C@@H](CC) 169 6067 http://www.dDrugBank
    16464 Penicillin G OC(=O)[C@@H 215.5 5693 http://www.dDrugBank
    16465 Cyproheptadi CN1CCC(CC1)= 216 2810 http://www.dDrugBank x HCl salt JCB
    16466 Idoxuridine IC1=CN(C(=O 165 5694 http://www.dDrugBank
    16467 Cocaine CN1C2CCC1[C 195 5557 http://www.dDrugBank
    16468 Furosemide NS(=O)(=O)c2c 206 3322 http://www.dDrugBank
    16469 Oxalate Ion [O-]C(=O)C([O 189.5 64235 http://www.dDrugBank
    16470 Dihydrocodei COc5ccc1C[C 112.5 4447600 http://www.dDrugBank
    16471 Danthron Oc3cccc2C(=O 193 2845 http://www.dDrugBank
    16472 UrsodeoxycholO=C(O)CC[C@ 203 29131 http://www.dDrugBank
    16473 Meperidine CN1CCC(CC1)( 187.5 3918 http://www.dDrugBank
    16474 PseudoephedrO[C@@H](c1c 117.5 6761 http://www.dDrugBank
    16475 SpironolactonCC(=O)S[C@@ 134.5 5628 http://www.dDrugBank
    16476 Nizatidine CN(C)Cc1nc(C 203 2298266 http://www.dDrugBank
    16477 Ouabain O=C1C=C(CO1 200 388599 http://www.dDrugBank
    16478 Propranolol CC(C)NCC(O)C 163.5 4777 http://www.dDrugBank
    16479 Pyridoxal Pho Oc1c(C=O)c(c 205 1022 http://www.dDrugBank
    16480 L-Methionine O=C(O)[C@@H 277.5 5907 http://www.dDrugBank
    16481 3-phenylpropiO=C(O)CCc1cc 48.5 10181339 http://www.dDrugBank
    16482 Antipyrine O=C2C=C(C)N( 114 2121 http://www.dDrugBank
    16483 Estradiol Oc3cc4CC[C@ 176 5554 http://www.dDrugBank
    16484 Podofilox COc1cc(cc(O 228 10162 http://www.dDrugBank
    16485 L-Aspartic Aci O=C(O)C[C@H 230 5745 http://www.dDrugBank
    16486 Dexrazoxane O=C2CN(C[C@ 194 64479 http://www.dDrugBank
    16487 1,10-Phenanthc1ccnc3c1ccc 117 1278 http://www.dDrugBank
    16488 Menthol CC(C)[C@@H] 43 15803 http://www.dDrugBank
    16489 Bolasterone C[C@@H]4CC1 164 92280 http://www.dDrugBank
    16490 LevonorgestreO=C4CC[C@H] 240 12560 http://www.dDrugBank
    16491 L-Cystine N[C@@H](CSS 260.5 60997 http://www.dDrugBank
    16492 Hyoscyamine CN3C1CCC3CC( 141 58240 http://www.dDrugBank
    16493 DexamethasoOCC(=O)[C@] 262 5541 http://www.dDrugBank
    16494 Norepinephri Oc1ccc(cc1O 217 388394 http://www.dDrugBank
    16495 Doxorubicin OCC(=O)[C@@] 204.5 29400 http://www.dDrugBank
    16496 Iproniazid O=C(NNC(C)C) 150 3617 http://www.dDrugBank
    16497 Diltiazem CN(C)CCN2c3c 231 35850 http://www.dDrugBank
    16498 Nandrolone pO=C5CC[C@H] 118 199761 http://www.dDrugBank
    16499 L-Glutamic AcOC(=O)CC[C@ 224 30572 http://www.dDrugBank
    16500 L-Proline O=C(O)[C@@ 228 128566 http://www.dDrugBank
    16501 Vitamin C OC=1C(=O)O[ 191 10189562 http://www.dDrugBank
    16502 D-tartaric acidO=C(O)[C@@H 169 394447 http://www.dDrugBank
    16503 Glycine NCC(=O)O 240 730 http://www.dDrugBank
    16504 Mannitol OC(C(O)CO)C( 168 440 http://www.dDrugBank
    16505 Penicillamine O=C(O)[C@H]( 198.5 5643 http://www.dDrugBank
    16506 Ergotamine CN2C[C@@H]( 213.5 7930 http://www.dDrugBank
    16507 L-Citrulline N[C@@H](CCC 214 9367 http://www.dDrugBank
    16508 Adenosine Nc3ncnc1c3n 235.5 54923 http://www.dDrugBank
    16509 Quinidine COc1cc2c(cc 174 389880 http://www.dDrugBank
    16510 ChlorhexidineClc2ccc(NC(= 134 2612 http://www.dDrugBank
    16511 L-Threonine O=C(O)[C@@H 256 6051 http://www.dDrugBank
    16512 L-Tyrosine Oc1ccc(C[C@H 343 5833 http://www.dDrugBank
    16513 Rhamnose O[C@@H]1[C@ 122 5145574 http://www.dDrugBank
    16514 (R)-Mandelic O[C@H](C(=O) 119 388690 http://www.dDrugBank
    16515 L-Leucine CC(C)CC(N)C( 278 834 http://www.dDrugBank
    16516 Tetracycline NC(=O)C1=C(O 165 10257122 http://www.dDrugBank
    16517 3-Hydroxyphen
    Oc1cc(C[C@H] 268 5323512 http://www.dDrugBank
    16518 Orotic Acid OC(=O)C1=CC 345.5 942 http://www.dDrugBank
    16519 Atropine CN3[C@@H]1C 118.5 151965 http://www.dDrugBank
    16520 Ampicillin OC(=O)[C@@H 208 6013 http://www.dDrugBank
    16521 Prednisone OCC(=O)[C@@ 234 5656 http://www.dDrugBank
    16522 Tocainide O=C(Nc1c(C)c 256 35632 http://www.dDrugBank
    16523 Adenosine moO=P(O)(O)OC 185.5 5858 http://www.dDrugBank
    16524 L-Valine CC(C)[C@H](N 307.5 6050 http://www.dDrugBank
    16525 Azacitidine NC1=NC(=O)N 229 9072 http://www.dDrugBank
    16526 Phenytoin O=C1NC(=O)C( 286 1710 http://www.dDrugBank
    16527 CyclophosphaO=P1(NCCCO1) 43 2804 http://www.dDrugBank
    16528 Cycloserine NC1CONC1=O 147 390 http://www.dDrugBank
    16529 Alitretinoin CC=1CCCC(C)( 189.5 392618 http://www.dDrugBank
    16530 MonobenzoneOc2ccc(OCc1c 114 7356 http://www.dDrugBank
    16531 Estriol Oc3cc4CC[C@ 282 5553 http://www.dDrugBank
    16532 L-Alanine C[C@H](N)C( 300 5735 http://www.dDrugBank
    16533 Labetalol O=C(N)c1cc(c 195.5 3734 http://www.dDrugBank
    16534 Etoposide COc1cc(cc(O 243.5 33510 http://www.dDrugBank
    16535 MedroxyprogeCC(=O)[C@@] 221.75 10185 http://www.dDrugBank
    16536 Methaqualon Cc1ccccc1N3C 113 6055 http://www.dDrugBank
    16537 Pyridoxal Oc1c(C=O)c(c 172 1021 http://www.dDrugBank
    16538 L-Serine O=C(O)[C@@H 222 5736 http://www.dDrugBank
    16539 TriamcinoloneOCC(=O)[C@] 276 29046 http://www.dDrugBank
    16540 Levodopa Oc1ccc(C[C@H 277 5824 http://www.dDrugBank
    16541 Diazepam Clc1ccc2c(c1) 125.5 2908 http://www.dDrugBank
    16542 Salbutamol OCc1cc(ccc1O 157.5 1999 http://www.dDrugBank
    16543 SulfametopyraCOc2nccnc2NS 169.5 8695 http://www.dDrugBank
    16544 Cyclothiazide NS(=O)(=O)c4 227.5 2807 http://www.dDrugBank
    16545 Ephedrine O[C@H](c1ccc 34 8935 http://www.dDrugBank
    16546 Nadolol CC(C)(C)NCC 130 35815 http://www.dDrugBank
    16547 Diflunisal OC(=O)c1cc(cc 215.5 2951 http://www.dDrugBank
    16548 Menadione O=C2C=C(C)C( 102 3915 http://www.dDrugBank
    16549 Zalcitabine NC1=NC(=O)N 212 22498 http://www.dDrugBank
    16550 L-Histidine N[C@@H](Cc1 282 6038 http://www.dDrugBank
    16551 Estrone Oc3cc4CC[C@ 255.25 5660 http://www.dDrugBank
    16552 Methylpredni OCC(=O)[C@@ 232.5 6485 http://www.dDrugBank
    16553 Zidovudine CC1=CN(C(=O 109 32555 http://www.dDrugBank
    16554 Camphor CC2(C)[C@@H 180 392267 http://www.dDrugBank
    16555 Carbidopa Oc1ccc(C[C@] 204 31640 http://www.dDrugBank
    16556 L-Arginine N[C@@H](CCC 221 6082 http://www.dDrugBank
    16557 Hydroxyurea NC(=O)NO 144 3530 http://www.dDrugBank
    16558 Iohexol OCC(O)CNC(=O) 177 3599 http://www.dDrugBank
    16559 Sulfisoxazole Cc2c(NS(=O)(= 194 5151 http://www.dDrugBank
    16560 Phenacetin CCOc1ccc(cc1 135 4590 http://www.dDrugBank
    16561 Pyruvic acid CC(=O)C(=O)O 11.8 1031 http://www.dDrugBank
    16562 5-methylbenzCc1ccc2ncnc2 112 11484 http://www.dDrugBank
    16563 Calcitriol C=C1C(C[C@@ 113 4446829 http://www.dDrugBank
    16564 Acebutolol CC(C)NCC(O)C 121 1901 http://www.dDrugBank
    16565 Oxaprozin OC(=O)CCc1nc( 158.5 4453 http://www.dDrugBank
    16566 CefoperazoneO=C1C(=O)N(C 169 40204 http://www.dDrugBank
    16567 Pindolol CC(C)NCC(O)C 169 4662 http://www.dDrugBank
    16568 Sulfadoxine O=S(=O)(Nc1n 192 16218 http://www.dDrugBank
    16569 TrimethoprimNc2nc(N)ncc2 201 5376 http://www.dDrugBank
    16570 Pimozide Fc1ccc(cc1)C 216 15520 http://www.dDrugBank
    16571 Enoxacin O=C(O)C2=CN( 222 3116 http://www.dDrugBank
    16572 Chlorthalidon NS(=O)(=O)c1c 241 2631 http://www.dDrugBank
    16573 HydroflumethiFC(F)(F)c1cc 272.5 3521 http://www.dDrugBank
    16574 Fluorouracil FC1=CNC(=O) 281 3268 http://www.dDrugBank
    16575 Mephenytoin CCC1(NC(=O)N 135 3920 http://www.dDrugBank
    16576 Simvastatin CC(C)(CC)C( 136.5 4925517 http://www.dDrugBank
    16577 Phosphonoacet
    O=C(O)CP(=O) 144.5 531 http://www.dDrugBank
    16578 Pyridoxine Oc1c(CO)c(cn 160.5 1025 http://www.dDrugBank
    16579 Naltrexone O=C1CC[C@@] 169.5 4514524 http://www.dDrugBank
    16580 Tolazamide Cc1ccc(cc1)S 171.5 5302 http://www.dDrugBank
    16581 Oxytetracycli NC(=O)C=4C(= 183 10482174 http://www.dDrugBank
    16582 Succinic acid O=C(O)CCC(= 186.5 1078 http://www.dDrugBank
    16583 Trifluridine FC(F)(F)C1= 187.5 6020 http://www.dDrugBank
    16584 Glutathione O=C(NCC(=O) 193.5 111188 http://www.dDrugBank
    16585 Etorphine CC(O)(CCC)C1 215.5 24895 http://www.dDrugBank
    16586 HydrocortisonOCC(=O)[C@@ 220 5551 http://www.dDrugBank
    16587 Metformin N=C(N)NC(=N) 224.5 3949 http://www.dDrugBank
    16588 Butylamine CCCCN -49 7716 http://www.dDrugBank
    16589 Vitamin E CC(C)CCC[C@@ 2 14265 http://www.dDrugBank
    16590 2-Hydroxyethyl
    OCCSSCCO 26 15117 http://www.dDrugBank
    16591 Ifosfamide O=P1(NCCCl) 40 3562 http://www.dDrugBank
    16592 D-Xylitol O[C@H](CO)[ 104 6646 http://www.dDrugBank
    16593 Metipranolol O=C(C)Oc1c(C 106 29193 http://www.dDrugBank
    16594 Alprenolol CC(C)NCC(O)C 108 2035 http://www.dDrugBank
    16595 4-IodopyrazolIc1cnnc1 109 69468 http://www.dDrugBank
    16596 Clotiazepam Clc3ccccc3C1 119 2709 http://www.dDrugBank
    16597 Temazepam Clc1ccc2c(c1) 120 5198 http://www.dDrugBank
    16598 Loratadine Clc3cc4CCc1c 135 3820 http://www.dDrugBank
    16599 Practolol CC(C)NC[C@H] 135 391603 http://www.dDrugBank
    16600 Aminorex NC1=NCC(O1)c 137 15767 http://www.dDrugBank
    16601 Nicardipine CC=2NC(C)=C( 137 4319 http://www.dDrugBank
    16602 DeferoxamineCC(=O)N(O)C 139 2867 http://www.dDrugBank
    16603 Oxamniquine [O-][N+](=O) 148 4451 http://www.dDrugBank
    16604 EsomeprazoleCc3c(OC)c(C) 155 4433 http://www.dDrugBank
    16605 Nifedipine CC=1NC(C)=C( 173 4330 http://www.dDrugBank
    16606 Altretamine CN(C)c1nc(nc( 173 2038 http://www.dDrugBank
    16607 AminohippuraO=C(NCC(=O)O 199.5 2063 http://www.dDrugBank
    16608 Ethylmorphin CCOc5ccc1C[ 200 4514250 http://www.dDrugBank
    16609 Flumazenil O=C(OCC)c3nc 202 3256 http://www.dDrugBank
    16610 Mexiletine CC(N)COc1c(C 204 4034 http://www.dDrugBank
    16611 Baclofen Clc1ccc(cc1)C 207 2197 http://www.dDrugBank
    16612 Clofazimine Clc1ccc(cc1) 211 2692 http://www.dDrugBank
    16613 Trimetrexate COc1cc(cc(OC 216 5381 http://www.dDrugBank
    16614 Bendroflumeth
    FC(F)(F)c1cc2 222 2225 http://www.dDrugBank
    16615 Acitretin Cc1c(C)c(/C= 229 4942363 http://www.dDrugBank
    16616 L-Asparagine NC(=O)C[C@H 235 6031 http://www.dDrugBank
    16617 Finasteride CC(C)(C)NC( 253 51714 http://www.dDrugBank
    16618 Theophylline O=C2c1ncnc1N 272 2068 http://www.dDrugBank
    16619 Debrisoquin N=C(N)N1Cc2c 279 2860 http://www.dDrugBank
    16620 Enprofylline O=C2NC(=O)N 288 1613 http://www.dDrugBank
    16621 Fludiazepam Fc3ccccc3C2=N 296 3252 http://www.dDrugBank
    16622 Quazepam Fc3ccccc3C2=N 138.25 4825 http://www.dDrugBank
    16623 Clobetasol ClCC(=O)[C@ 196.25 30399 http://www.dDrugBank
    16624 Lomefloxacin O=C(O)C2=CN( 239.75 3811 http://www.dDrugBank
    16625 Prilocaine O=C(Nc1ccccc 37.5 4737 http://www.dDrugBank
    16626 Isocarboxazid Cc1cc(no1)C( 105.5 3628 http://www.dDrugBank
    16627 Bupivacaine Cc2cccc(C)c2 107.5 2380 http://www.dDrugBank
    16628 Loxapine CN1CCN(CC1)C 109.5 3827 http://www.dDrugBank
    16629 Flurbiprofen Fc2cc(ccc2c1c 110.5 3277 http://www.dDrugBank
    16630 PropericiazineOC1CCN(CC1)C 116.5 4585 http://www.dDrugBank
    16631 Ergocalciferol C=C3CC[C@H] 117 4444351 http://www.dDrugBank
    16632 Aprindine CCN(CC)CCCN( 120.5 2132 http://www.dDrugBank
    16633 Amisulpride CCN2CCCC2CNC 126.5 2074 http://www.dDrugBank
    16634 Tinidazole O=S(=O)(CCn1c 127.5 5279 http://www.dDrugBank
    16635 Thiamylal O=C1NC(=S)NC 132.5 2297298 http://www.dDrugBank
    16636 Sulfinpyrazon O=C4C(CCS(=O 136.5 5149 http://www.dDrugBank
    16637 Bevantolol COc1cc(ccc1O 137.5 2282 http://www.dDrugBank
    16638 3-Beta-Hydro O=C4CC[C@@H 140.5 5670 http://www.dDrugBank
    16639 Prazepam Clc1ccc3c(c1 145.5 4721 http://www.dDrugBank
    16640 Terfenadine CC(C)(C)c1ccc 147.5 5212 http://www.dDrugBank
    16641 Phenindione O=C2c1ccccc1 149.5 4596 http://www.dDrugBank
    16642 Felbamate NC(=O)OCC(CO 151.5 3214 http://www.dDrugBank
    16643 Moricizine O=C(OCC)Nc1c 156.5 31872 http://www.dDrugBank
    16644 Celecoxib NS(=O)(=O)c1c 157.5 2562 http://www.dDrugBank
    16645 Metronidazol Cc1ncc([N+]( 160 4029 http://www.dDrugBank
    16646 Flunitrazepam[O-][N+](=O)c 166.5 3263 http://www.dDrugBank
    16647 GlibenclamideO=C(NC1CCCCC 169.5 3368 http://www.dDrugBank
    16648 Hydralazine NNc2nncc1ccc 172.5 3511 http://www.dDrugBank
    16649 Clozapine CN1CCN(CC1)C 183.5 10442628 http://www.dDrugBank
    16650 L-Glutamine O=C(N)CC[C@ 185 5746 http://www.dDrugBank
    16651 Levorphanol Oc3ccc4C[C@ 198.5 16736212 http://www.dDrugBank
    16652 Amikacin NCC[C@H](O) 203.5 34635 http://www.dDrugBank
    16653 Oxazepam Clc1ccc2NC(= 205.5 4455 http://www.dDrugBank
    16654 Daunorubicin CC(=O)[C@@]4 208.5 28163 http://www.dDrugBank
    16655 Epinephrine Oc1ccc(cc1O 211.5 5611 http://www.dDrugBank
    16656 Norfloxacin O=C(O)C2=CN( 227.5 4380 http://www.dDrugBank
    16657 Mefenamic acO=C(O)c2cccc 230.5 3904 http://www.dDrugBank
    16658 Betamethaso OCC(=O)[C@] 232.5 9399 http://www.dDrugBank
    16659 OxymorphoneO=C1CC[C@@] 248.5 4447650 http://www.dDrugBank
    16660 Ofloxacin CN1CCN(CC1)c 253.5 4422 http://www.dDrugBank
    16661 Fluocinolone OCC(=O)[C@] 265.5 5980 http://www.dDrugBank
    16662 Dantrolene [O-][N+](=O) 279.5 5290202 http://www.dDrugBank
    16663 L-Tryptophan O=C(O)[C@@H] 282.5 6066 http://www.dDrugBank
    16664 Niacin O=C(O)c1cccn 237 913 http://www.dDrugBank
    16665 1,4-ButanedioOCCCCO 20.1 13835209 http://www.dDrugBank
    16666 Cefalotin O=C(O)C=2N3 160.25 5802 http://www.dDrugBank
    16667 Acetaminoph Oc1ccc(NC(C) 169.75 1906 http://www.dDrugBank
    16668 Sotalol O=S(C)(=O)Nc 206.75 5063 http://www.dDrugBank
    16669 BenzophenonO=C(c1ccccc1) 47.9 2991 http://www.dDrugBank
    16670 Perflutren FC(F)(F)C(F)(F) -147.6 6192 http://www.dDrugBank
    16671 Halothane BrC(Cl)C(F)(F) -118 3441 http://www.dDrugBank
    16672 2-Butanol C[C@@H](O)C -114.7 76392 http://www.dDrugBank
    16673 Ethanol CCO -114.1 682 http://www.dDrugBank
    16674 1,2-Dichloro- C[C@@H](Cl)C -100 393311 http://www.dDrugBank
    16675 Hexane CCCCCC -95.3 7767 http://www.dDrugBank
    16676 Ethylbenzene CCc1ccccc1 -94.9 7219 http://www.dDrugBank
    16677 Methylamine O=C(CCl)c1ccc -93.4 10303 http://www.dDrugBank x incorrect SMILES - mp for methylamine JC
    16678 Propyl Acetat CC(=O)OCCC -93 7706 http://www.dDrugBank
    16679 FormaldehydeC=O -92 692 http://www.dDrugBank
    16680 Pentanal CCCCC=O -91.5 7772 http://www.dDrugBank
    16681 Butan-1-Ol CCCCO -89.8 258 http://www.dDrugBank
    16682 Isopropyl AlcoCC(C)O -89.5 3644 http://www.dDrugBank
    16683 N-Butylbenze CCCCc1ccccc1 -87.9 7419 http://www.dDrugBank
    16684 2-MethoxyethOCCOC -85.1 7728 http://www.dDrugBank
    16685 Isoflurophate FP(=O)(OC(C) -82 5723 http://www.dDrugBank
    16686 Nicotine CN2CCCC2c1c -79 917 http://www.dDrugBank
    16687 2-EthoxyethanCCOCCO -70 13836591 http://www.dDrugBank
    16688 DimethylformCN(C)C=O -60.4 5993 http://www.dDrugBank
    16689 1,2-PropanediC[C@@H](O) -60 228188 http://www.dDrugBank
    16690 1,2-Dimethox COCCOC -58 13836589 http://www.dDrugBank
    16691 N-Octane CCCCCCCC -56.8 349 http://www.dDrugBank
    16692 Amylamine CCCCCN -55 7769 http://www.dDrugBank
    16693 5-MethylpyrroCc1ccnc1 -48.4 11528 http://www.dDrugBank
    16694 Isobutyric Aci CC(C)C(=O)O -46 6341 http://www.dDrugBank
    16695 Tetrahydropy C1CCCCO1 -45 8554 http://www.dDrugBank
    16696 Chloroaceton CC(=O)CCl -44.5 6323 http://www.dDrugBank
    16697 Methoxyflura ClC(Cl)C(F)(F) -35 3973 http://www.dDrugBank
    16698 2-FluoroanilinFc1ccccc1N -34.6 9208 http://www.dDrugBank
    16699 N-Valeric AcidCCCCC(=O)O -34 7701 http://www.dDrugBank
    16700 CyclohexanonO=C1CCCCC1 -31 7679 http://www.dDrugBank
    16701 Decane CCCCCCCCCC -29.7 14840 http://www.dDrugBank
    16702 2-Phenyl-EthaOCCc1ccccc1 -27 5830 http://www.dDrugBank
    16703 PhytonadioneCC(C)CCC[C@@ -20 4447652 http://www.dDrugBank
    16704 Acetone CyanN#CC(C)(C)O -19 6166 http://www.dDrugBank
    16705 3-MethylpyridCc1cccnc1 -18.1 21106520 http://www.dDrugBank
    16706 Alpha-LinoleniO=C(O)CCCCC -16.5 4444437 http://www.dDrugBank
    16707 Ethylene Glyc OCCO -13 13835235 http://www.dDrugBank
    16708 Dodecane CCCCCCCCCCC -9.6 7890 http://www.dDrugBank
    16709 TetraethyleneOCCOCCOCCO -6.2 7908 http://www.dDrugBank
    16710 2-Allylphenol Oc1ccccc1CC= -6 14864 http://www.dDrugBank
    16711 Malathion CCOC(=O)CC(S 2.8 3864 http://www.dDrugBank
    16712 2-bromophenoOc1ccccc1Br 5.6 6974 http://www.dDrugBank
    16713 Benzylamine NCc1ccccc1 10 7223 http://www.dDrugBank
    16714 M-Cresol Cc1cc(O)ccc1 11.8 21105871 http://www.dDrugBank
    16715 Nitroglycerin O=[N+]([O-])O 13.5 4354 http://www.dDrugBank
    16716 Acrylic Acid C=CC(=O)O 13.5 6333 http://www.dDrugBank
    16717 S,3-Hydroxyb CC(=O)[C@H]( 15 394765 http://www.dDrugBank
    16718 2,5-Xylidine Cc1cc(N)c(C)c 15.5 13869434 http://www.dDrugBank
    16719 Caprylic acid O=C(O)CCCCC 16.3 370 http://www.dDrugBank
    16720 Propofol CC(C)c1cccc(C 18 4774 http://www.dDrugBank
    16721 Dimethyl sulf CS(C)=O 18.5 659 http://www.dDrugBank
    16722 Benzyl BenzoaO=C(OCc1cccc 21 13856959 http://www.dDrugBank
    16723 Putrescine NCCCCN 27.5 13837702 http://www.dDrugBank
    16724 Carmustine O=C(NCCCl)N( 31 2480 http://www.dDrugBank
    16725 3-ChlorophenoOc1cc(Cl)ccc1 32.6 13875432 http://www.dDrugBank
    16726 Laevulinic Aci CC(=O)CCC(=O 33 11091 http://www.dDrugBank
    16727 Phenylacetal O=CCc1ccccc1 33.5 13876539 http://www.dDrugBank
    16728 Permethrin ClC(Cl)=C/C3C 34 36845 http://www.dDrugBank
    16729 Pilocarpine Cn2cncc2C[C 34 5699 http://www.dDrugBank
    16730 P-Cresol Cc1ccc(O)cc1 35.5 13839082 http://www.dDrugBank
    16731 Prenylamine CC(Cc1ccccc1) 36.5 9418 http://www.dDrugBank
    16732 Acetoacetic A CC(=O)CC(=O) 36.5 94 http://www.dDrugBank
    16733 2,3,4,5,6-PentFc1c(CO)c(F)c( 37.5 9535 http://www.dDrugBank
    16734 Phenoxybenz CC(COc1ccccc 39 4604 http://www.dDrugBank
    16735 Thenoyltriflu O=C(CC(=O)C(F 42 5399 http://www.dDrugBank
    16736 Tropinone CN2[C@H]1CC 43 393722 http://www.dDrugBank
    16737 Lauric Acid O=C(O)CCCCC 43.2 3756 http://www.dDrugBank
    16738 N-TridecanoicO=C(O)CCCCC 44.5 12013 http://www.dDrugBank
    16739 Trimipramine CN(C)CC(C)CN 45 5382 http://www.dDrugBank
    16740 Hexane-1,6-DiOCCCCCCO 45 13839416 http://www.dDrugBank
    16741 Dimethyltryp CN(C)CCc2cnc 46 5864 http://www.dDrugBank
    16742 Trimethadion CN1C(=O)OC(C 46 5374 http://www.dDrugBank
    16743 PhencyclidineC1CC(CCC1)(c 46.5 6224 http://www.dDrugBank
    16744 DiethylcarbamO=C(N1CCN(C) 48 2944 http://www.dDrugBank
    16745 Ethyl carbamaNC(=O)OCC 49 5439 http://www.dDrugBank
    16746 Guanidine N=C(N)N 50 3400 http://www.dDrugBank
    16747 2-BromoacetyBrCC(=O)O 50 10301338 http://www.dDrugBank
    16748 Metyrapone CC(C)(c1cccnc 50.5 4030 http://www.dDrugBank
    16749 Vitamin A CC=1CCCC(C)( 63.5 8079655 http://www.dDrugBank
    16750 Lidocaine O=C(Nc1c(C)c 68.5 3548 http://www.dDrugBank
    16751 Bisoprolol CC(C)NCC(O)C 100 2312 http://www.dDrugBank
    16752 Secobarbital O=C1NC(=O)NC 100 28897 http://www.dDrugBank
    16753 Orciprenaline Oc1cc(cc(O)c1 100 3944 http://www.dDrugBank
    16754 Estramustine ClCCN(CCCl)C 104.5 17134 http://www.dDrugBank
    16755 Phenylbutazo O=C3C(CCCC)C 105 4617 http://www.dDrugBank
    16756 MeprobamateO=C(N)OCC(C) 105 3924 http://www.dDrugBank
    16757 1,2-Dihydrox Oc1ccccc1O 105 13837760 http://www.dDrugBank
    16758 PhysostigmineCNC(=O)Oc1cc 105.5 5763 http://www.dDrugBank
    16759 N-AcetylmethO=C(C)N[C@@ 105.5 395338 http://www.dDrugBank
    16760 Captopril OC(=O)[C@@H 106 40130 http://www.dDrugBank
    16761 Pimelic Acid O=C(O)CCCCC 106 376 http://www.dDrugBank
    16762 Piperazine C1CNCCN1 106 13835459 http://www.dDrugBank
    16763 Azelaic Acid O=C(O)CCCCC 106.5 2179 http://www.dDrugBank
    16764 Quinestrol C#C[C@]5(O) 107.5 8694 http://www.dDrugBank
    16765 Metaraminol O[C@H](c1cc( 107.5 5695 http://www.dDrugBank
    16766 Ramipril O=C(OCC)[C@ 109 4514937 http://www.dDrugBank
    16767 Desogestrel C=C3C[C@@]1 109.5 37400 http://www.dDrugBank
    16768 Acetylcystein CC(=O)N[C@@ 109.5 11540 http://www.dDrugBank
    16769 Tolnaftate Cc1cc(ccc1)N( 111 5309 http://www.dDrugBank
    16770 Duroquinone CC=1C(=O)C(C 111.5 61539 http://www.dDrugBank
    16771 Lindane ClC1C(Cl)C(Cl) 112.5 707 http://www.dDrugBank
    16772 Cetirizine O=C(O)COCCN1 112.5 2577 http://www.dDrugBank
    16773 Haloprogin Clc1cc(OCC#CI 113.5 3440 http://www.dDrugBank
    16774 Biperiden OC(CCN1CCCCC 114 2289 http://www.dDrugBank
    16775 Azithromycin CN(C)[C@H]3 114 49833 http://www.dDrugBank
    16776 Carvedilol COc4ccccc4OC 114.5 2487 http://www.dDrugBank
    16777 Butyramide CCCC(N)=O 114.8 10464 http://www.dDrugBank
    16778 Chlorotrianis COc1ccc(cc1)C 115 10815 http://www.dDrugBank
    16779 Streptozocin O[C@H]1O[C@ 115 27273 http://www.dDrugBank
    16780 ChlormezanonO=C1CCS(=O)( 116.2 2616 http://www.dDrugBank
    16781 Melatonin CC(=O)NCCc2c 117 872 http://www.dDrugBank
    16782 PivmecillinamCC(C)(C)C(= 119 21258050 http://www.dDrugBank
    16783 Progesterone CC(=O)[C@H] 121 5773 http://www.dDrugBank
    16784 1-(Isopropylt CC(C)S[C@@H 121 2080754 http://www.dDrugBank
    16785 Minaprine Cc2cc(nnc2NC 122 4054 http://www.dDrugBank
    16786 Metaxalone Cc1cc(cc(C)c 122 14709 http://www.dDrugBank
    16787 Ethacrynic aciClc1c(ccc(OCC 122.5 3163 http://www.dDrugBank
    16788 Carbimazole S=C1N(C=CN1 123.5 28829 http://www.dDrugBank
    16789 Suprofen O=C(c1ccc(cc1 124.3 5166 http://www.dDrugBank
    16790 3-IndolebutyriO=C(O)CCCc2c 124.5 8298 http://www.dDrugBank
    16791 Probucol CC(C)(C)c2cc(S 125 4743 http://www.dDrugBank
    16792 DihydrotachysCC3CCC(O)CC3 126 4444485 http://www.dDrugBank
    16793 Lofexidine Clc2cccc(Cl) 127 28460 http://www.dDrugBank
    16794 DromostanoloCCC(=O)O[C@ 128 194604 http://www.dDrugBank
    16795 TetrabenazineCC(C)CC2CN3C 128 5796 http://www.dDrugBank
    16796 BenzhydroxamO=C(NO)c1ccc 128 9891 http://www.dDrugBank
    16797 ChlorpropamiO=S(=O)(NC(= 128 2626 http://www.dDrugBank
    16798 Tolbutamide Cc1ccc(cc1)S 128.5 5304 http://www.dDrugBank
    16799 Butethal O=C1NC(=O)N 128.5 6229 http://www.dDrugBank
    16800 2-(3,4-Dihydr Oc1ccc(CC(=O 128.5 532 http://www.dDrugBank
    16801 Pentobarbital O=C1NC(=O)NC 129.5 4575 http://www.dDrugBank
    16802 Nicotinamide NC(=O)c1cccn 130 911 http://www.dDrugBank
    16803 Mequitazine c3ccc4Sc5ccc 130.5 3926 http://www.dDrugBank
    16804 BenzquinamidCCN(CC)C(=O) 131 2252 http://www.dDrugBank
    16805 Flufenamic AcFC(F)(F)c1cc( 133.5 3254 http://www.dDrugBank
    16806 AminophenazCN(C)C=2C(=O 134.5 5787 http://www.dDrugBank
    16807 Naphthalen-1-O=C(O)Cc2ccc 135 6601 http://www.dDrugBank
    16808 Malonate Ion [O-]C(=O)CC([ 135 8731 http://www.dDrugBank
    16809 Alfacalcidol C=C1C(/C[C@ 136 4445376 http://www.dDrugBank
    16810 Praziquantel O=C2CN(CC1c 136 4722 http://www.dDrugBank
    16811 Butalbital O=C1NC(=O)NC 138.5 2387 http://www.dDrugBank
    16812 Phenazopyrid Nc2nc(N)ccc2 139 4592 http://www.dDrugBank
    16813 Alizapride C=CCN3CCCC3 139 39202 http://www.dDrugBank
    16814 Cefradine CC=3CS[C@H] 140 34933 http://www.dDrugBank
    16815 Alfentanil CCC(=O)N(c1c 140.8 46451 http://www.dDrugBank
    16816 MycophenolicO=C(O)CCC(C) 141 393865 http://www.dDrugBank
    16817 Aprobarbital O=C1NC(=O)NC 141 6221 http://www.dDrugBank
    16818 Fexofenadine O=C(O)C(C)(C) 142.5 3231 http://www.dDrugBank
    16819 Ciclopirox CC=2C=C(C1CC 144 2647 http://www.dDrugBank
    16820 (2r)-2,3-Dihy O=C[C@H](O) 145 71347 http://www.dDrugBank
    16821 Droperidol Fc1ccc(cc1)C 145.75 3056 http://www.dDrugBank
    16822 Ketoconazole CC(=O)N1CCN( 146 43284 http://www.dDrugBank
    16823 Methimazole S=C1NC=CN1C 146 1131173 http://www.dDrugBank
    16824 Pentazocine C/C(C)=CCN1 146.3 390041 http://www.dDrugBank
    16825 Bufotenine CN(C)CCc2cnc 146.5 9839 http://www.dDrugBank
    16826 Etodolac O=C(O)CC3(CC 146.5 3192 http://www.dDrugBank
    16827 Salsalate O=C(Oc1ccccc 147 4977 http://www.dDrugBank
    16828 Atenolol CC(C)NCC(O)C 147 2162 http://www.dDrugBank
    16829 MetoclopramiNc1cc(OC)c(c 147.25 4024 http://www.dDrugBank
    16830 Clotrimazole Clc1ccccc1C(c 148 2710 http://www.dDrugBank
    16831 Benazepril O=C(OCC)[C@H 148.5 4514935 http://www.dDrugBank
    16832 Ticrynafen O=C(c1ccc(OCC 149 35204 http://www.dDrugBank
    16833 Astemizole Fc1ccc(cc1)C 149.1 2160 http://www.dDrugBank
    16834 AminoglutethCCC1(CCC(=O) 149.5 2060 http://www.dDrugBank
    16835 Mestranol COc3cc4CC[C 150.5 6054 http://www.dDrugBank
    16836 ChlorampheniO=[N+]([O-])c 150.5 292 http://www.dDrugBank
    16837 Mepivacaine O=C(Nc1c(C)c 150.5 3922 http://www.dDrugBank
    16838 AminosalicylicOC(=O)c1ccc( 150.5 4488 http://www.dDrugBank
    16839 Metharbital O=C1NC(=O)N( 150.5 3957 http://www.dDrugBank
    16840 Floxuridine FC1=CN(C(=O 150.5 5586 http://www.dDrugBank
    16841 Haloperidol Fc1ccc(cc1)C( 151.5 3438 http://www.dDrugBank
    16842 Nialamide O=C(NNCCC(=O 151.6 4317 http://www.dDrugBank
    16843 Naproxen O=C(O)C(C)c1 153 1262 http://www.dDrugBank
    16844 5-Hydroxy-2-(O=C1C=C(CO) 153.5 3708 http://www.dDrugBank
    16845 Testosterone O=C4CC[C@@] 155 5791 http://www.dDrugBank
    16846 Colchicine CC(=O)N[C@H] 156 5933 http://www.dDrugBank
    16847 Tolmetin OC(=O)Cc2ccc( 156 5308 http://www.dDrugBank
    16848 Omeprazole Cc3c(OC)c(C) 156 4433 http://www.dDrugBank
    16849 Amdinocillin OC(=O)[C@@H 156 10482146 http://www.dDrugBank
    16850 Quinaldic AcidO=C(O)c1ccc2 156 6857 http://www.dDrugBank
    16851 Anisindione COc1ccc(cc1) 156.5 2112 http://www.dDrugBank
    16852 Medrysone CC(=O)[C@H] 156.5 216968 http://www.dDrugBank
    16853 DihydromorphOc5ccc1C[C@ 157 4514282 http://www.dDrugBank
    16854 IndomethacinClc1ccc(cc1)C 158 3584 http://www.dDrugBank
    16855 Salicyclic acid OC(=O)c1cccc 158 331 http://www.dDrugBank
    16856 Camphane CC2(C)[C@H]1 158.5 16743887 http://www.dDrugBank
    16857 Midazolam Fc4ccccc4C2=N 159 4047 http://www.dDrugBank
    16858 Cilostazol O=C1CCc2cc( 160 2652 http://www.dDrugBank
    16859 Indapamide NS(=O)(=O)c1 161 3574 http://www.dDrugBank
    16860 Dyphylline OCC(O)Cn2cnc 161.5 3070 http://www.dDrugBank
    16861 Ergonovine C[C@@H](CO) 162 391970 http://www.dDrugBank
    16862 Dipyridamole OCCN(CCO)c2n 163 2997 http://www.dDrugBank
    16863 Ethionamide CCc1cc(ccn1)C 163 2041901 http://www.dDrugBank
    16864 2'-Deoxyuridi O=C1NC(=O)N 163 18922863 http://www.dDrugBank
    16865 Famotidine N/C(N)=N/c1n 163.5 3208 http://www.dDrugBank
    16866 Boldenone O=C3C=C4CC[ 165 12744 http://www.dDrugBank
    16867 Uridine O=C1NC(=O)N 165 10394623 http://www.dDrugBank
    16868 Sulfanilamide Nc1ccc(cc1)S( 165.5 5142 http://www.dDrugBank
    16869 Sulfacytine O=C1N=C(C=CN 166.5 5131 http://www.dDrugBank
    16870 Butabarbital O=C1NC(=O)NC 166.5 2385 http://www.dDrugBank
    16871 SulfamethoxaCc2cc(NS(=O)( 167 5138 http://www.dDrugBank
    16872 Lorazepam Clc3ccccc3C2= 167 3821 http://www.dDrugBank
    16873 DiphenhydramCN(C)CCOC(c1 168 2989 http://www.dDrugBank
    16874 Dydrogestero CC(=O)[C@H] 169.5 8699 http://www.dDrugBank
    16875 Risperidone CC=5N=C1CCCC 170 4895 http://www.dDrugBank
    16876 DiethylstilbestOc1ccc(cc1)C( 170.5 395306 http://www.dDrugBank
    16877 Isoproterenol Oc1ccc(cc1O) 170.5 3647 http://www.dDrugBank
    16878 Isoniazid O=C(NN)c1ccn 171.4 3635 http://www.dDrugBank
    16879 MethylergonoCC[C@@H](CO 172 7933 http://www.dDrugBank
    16880 Heroin CC(=O)Oc5cc 173 4575379 http://www.dDrugBank
    16881 PhenobarbitalO=C1NC(=O)NC 174 4599 http://www.dDrugBank
    16882 HeptabarbitalO=C1NC(=O)N 174 10081 http://www.dDrugBank
    16883 Tolazoline c2cc(CC1=NCC 174 5303 http://www.dDrugBank
    16884 2-AminophenoNc1ccccc1O 174 5596 http://www.dDrugBank
    16885 Imipramine CN(C)CCCN2c3 174.5 3568 http://www.dDrugBank
    16886 PhentolamineCc1ccc(cc1)N 174.5 5571 http://www.dDrugBank
    16887 Amoxapine Clc1ccc2Oc4c 175.5 2085 http://www.dDrugBank
    16888 Dapsone Nc1ccc(cc1)S( 175.5 2849 http://www.dDrugBank
    16889 MethylphenobO=C1NC(=O)N( 176 7972 http://www.dDrugBank
    16890 Phenformin N=C(N)NC(=N) 176.5 7953 http://www.dDrugBank
    16891 Sulpiride CCN2CCCC2CNC 178 5162 http://www.dDrugBank
    16892 Zopiclone CN1CCN(CC1)C 178 5533 http://www.dDrugBank
    16893 Zomepirac Cc2cc(CC(=O)O 178.5 5531 http://www.dDrugBank
    16894 Clioquinol Oc1c(I)cc(Cl) 178.5 2686 http://www.dDrugBank
    16895 Chloroxine Oc1c(Cl)cc(Cl 179.5 2621 http://www.dDrugBank
    16896 Amantadine NC12CC3CC(C1 180 2045 http://www.dDrugBank
    16897 Nomifensine Nc3cccc1c3CN 180 4371 http://www.dDrugBank
    16898 Nitroxoline [O-][N+](=O)c 180 18756 http://www.dDrugBank
    16899 Molindone O=C1C(CCc2nc 180.5 22342 http://www.dDrugBank
    16900 Gliquidone O=C(NC1CCCCC 181 82719 http://www.dDrugBank
    16901 Tretinoin CC=1CCCC(C)( 181 4925342 http://www.dDrugBank
    16902 DihydrotestosO=C3CC4CCC2 181 14 http://www.dDrugBank
    16903 Levallorphan Oc3ccc4C[C@ 181 10481920 http://www.dDrugBank
    16904 Gliclazide Cc1ccc(cc1)S 181 3356 http://www.dDrugBank
    16905 OxymetazolinCC(C)(C)c2cc 182 4475 http://www.dDrugBank
    16906 Melphalan O=C(O)C(N)Cc1 182.5 3913 http://www.dDrugBank
    16907 Ethinyl EstradiOc3cc4CC[C@ 183 5770 http://www.dDrugBank
    16908 Sulindac CS(=O)c1ccc(c 183 1265915 http://www.dDrugBank
    16909 SulfacetamideNc1ccc(cc1)S 183 5129 http://www.dDrugBank
    16910 Tacrine Nc1c3ccccc3n 183.5 1859 http://www.dDrugBank
    16911 Losartan OCc4c(Cl)nc( 184 3824 http://www.dDrugBank
    16912 P-Anisic Acid COc1ccc(cc1) 185 10181338 http://www.dDrugBank
    16913 Masoprocol Oc2ccc(C[C@H 185.5 64490 http://www.dDrugBank
    16914 Dimethylglyci CN(C)CC(=O)O 185.5 653 http://www.dDrugBank
    16915 Bezafibrate O=C(NCCc1ccc( 186 35728 http://www.dDrugBank
    16916 Bithionol Oc2c(Sc1cc(Cl) 188 2313 http://www.dDrugBank
    16917 4-Aminobenzoi
    OC(=O)c1ccc( 188.5 953 http://www.dDrugBank
    16918 TrimethobenzCOc1c(cc(cc1 188.7 5375 http://www.dDrugBank
    16919 Clostebol ClC=4C(=O)C 189 62171 http://www.dDrugBank
    16920 Glisoxepide Cc1cc(no1)C( 189 30380 http://www.dDrugBank
    16921 Ethoxzolamid NS(=O)(=O)c1 189 3179 http://www.dDrugBank
    16922 ClomipramineCN(C)CCCN2c3 189.5 2699 http://www.dDrugBank
    16923 Hetacillin OC(=O)[C@@H 190 391616 http://www.dDrugBank
    16924 Barbital O=C1NC(=O)N 190 2206 http://www.dDrugBank
    16925 CarbamazepinNC(=O)N2c3cc 190.2 2457 http://www.dDrugBank
    16926 Erythromycin CN(C)[C@H]3 191 12041 http://www.dDrugBank
    16927 Chlorzoxazon Clc1cc2NC(=O 191.5 2632 http://www.dDrugBank
    16928 Sulfapyridine O=S(=O)(Nc1cc 192 5145 http://www.dDrugBank
    16929 Pyrazinamide NC(=O)c1cncc 192 1017 http://www.dDrugBank
    16930 Fusidic Acid O=C(O)C(CCC 192.5 2271900 http://www.dDrugBank
    16931 Ethyl loflazep Fc3ccccc3C2= 193.5 3183 http://www.dDrugBank
    16932 MethotrexateO=C(O)[C@H]( 195 112728 http://www.dDrugBank
    16933 MethysergideCC[C@@H](CO 195 9300 http://www.dDrugBank
    16934 Probenecid O=S(=O)(N(CC 195 4742 http://www.dDrugBank
    16935 Zolpidem CN(C)C(=O)Cc1 196 5530 http://www.dDrugBank
    16936 Amitriptyline CN(C)CCC=C1c 196.5 2075 http://www.dDrugBank
    16937 Hydrocodone O=C1CC[C@H] 198 4447623 http://www.dDrugBank
    16938 Cholic Acid O=C(O)CC[C@ 198 192176 http://www.dDrugBank
    16939 4-Amino-5-HyNc1nc(C)ncc1 198 756 http://www.dDrugBank
    16940 SulfamethazinO=S(=O)(Nc1nc 198.5 5136 http://www.dDrugBank
    16941 D-Glutamic AcOC(=O)CC[C@ 201 30572 http://www.dDrugBank
    16942 Timolol O[C@H](COc1 202 31013 http://www.dDrugBank
    16943 Isatin O=C1c2ccccc 203 6787 http://www.dDrugBank
    16944 Norethindron O=C4CC[C@H] 203.5 5994 http://www.dDrugBank
    16945 2,3-DihydroxyOc1c(cccc1O) 204 18 http://www.dDrugBank
    16946 3-Iodo-Tyrosi Ic1cc(C[C@H] 205 388804 http://www.dDrugBank
    16947 Dacarbazine O=C(N)c1ncnc 205 10481959 http://www.dDrugBank
    16948 Aminocaproic NCCCCCC(=O) 205 548 http://www.dDrugBank
    16949 Ecgonine CN1[C@H]2CC 205 82586 http://www.dDrugBank
    16950 5,6-DimethylbCc1cc2ncnc2c 205.5 655 http://www.dDrugBank
    16951 Norgestrel O=C4CC[C@H] 206 12560 http://www.dDrugBank
    16952 Uracil mustar O=C1NC(=O)NC 206 5959 http://www.dDrugBank
    16953 Acetylamino-ACC(=O)NCC(= 206 10507 http://www.dDrugBank
    16954 Pergolide CSC[C@@H]1C 207.5 43503 http://www.dDrugBank
    16955 Amodiaquine CCN(CC)Cc1cc( 208 2080 http://www.dDrugBank
    16956 Sulfamethizol Cc2nnc(NS(=O) 208 5137 http://www.dDrugBank
    16957 Albendazole O=C(OC)Nc1nc 209 1998 http://www.dDrugBank
    16958 4-Hydroxy-3- Oc1ccc(cc1OC) 211.5 21708 http://www.dDrugBank
    16959 Cytarabine NC1=NC(=O)N 212.5 6017 http://www.dDrugBank
    16960 MethazolamidCN1N=C(SC1=N 213.5 3958 http://www.dDrugBank
    16961 Polythiazide NS(=O)(=O)c2c 214 4704 http://www.dDrugBank
    16962 Phenacemide O=C(Cc1ccccc 215 4589 http://www.dDrugBank
    16963 Oxcarbazepin NC(=O)N3c1cc 215.5 31608 http://www.dDrugBank
    16964 Norgestimate CC(=O)O[C@@ 216 5022837 http://www.dDrugBank
    16965 DesoximetasoOCC(=O)[C@@ 217 4470604 http://www.dDrugBank
    16966 trans-2-hydroOc1ccccc1/C= 217 553146 http://www.dDrugBank
    16967 Testolactone O=C3C=C4CC[ 218.5 13172 http://www.dDrugBank
    16968 PropylthiouracS=C1NC(CCC) 219 571424 http://www.dDrugBank
    16969 Oxycodone O=C1CC[C@@] 219 4447649 http://www.dDrugBank
    16970 Sulfasalazine O=S(=O)(Nc1cc 220 10605946 http://www.dDrugBank
    16971 Griseofulvin O=C2c3c(O[C@ 220 389934 http://www.dDrugBank
    16972 Pentostatin O[C@@H]3CNC 220 388759 http://www.dDrugBank
    16973 Cortisone ace CC(=O)OCC(= 222 5543 http://www.dDrugBank
    16974 Metrizamide OC2O[C@H](CO 223 391998 http://www.dDrugBank
    16975 L-Lysine N[C@@H](CCC 224 5747 http://www.dDrugBank
    16976 Nitrazepam [O-][N+](=O) 225 4350 http://www.dDrugBank
    16977 MethyclothiazNS(=O)(=O)c2c 225 3978 http://www.dDrugBank
    16978 3,4-DihydroxyOc1ccc(/C=C/ 225 600426 http://www.dDrugBank
    16979 (2e)-3-(1h-ImiOC(=O)/C=C/c 225 643824 http://www.dDrugBank
    16980 2,4-DihydroxyOC(=O)c1ccc( 226 1446 http://www.dDrugBank
    16981 Guanfacine Clc1cccc(Cl)c 226 3399 http://www.dDrugBank
    16982 Hesperetin COc1ccc(cc1O 227.5 65234 http://www.dDrugBank
    16983 ProchlorperazCN1CCN(CC1)C 228 4748 http://www.dDrugBank
    16984 Mimosine N[C@@H](CN1 228 389405 http://www.dDrugBank
    16985 Estazolam Clc2cc3C(=NC 228.5 3146 http://www.dDrugBank
    16986 Quinolinic AciOC(=O)c1nccc 228.5 1037 http://www.dDrugBank
    16987 Dichlorphena Clc1c(cc(cc1C 228.7 2930 http://www.dDrugBank
    16988 Nalidixic Acid O=C(O)C2=CN( 229.5 4268 http://www.dDrugBank
    16989 Phthalic Acid OC(=O)c1cccc 230 992 http://www.dDrugBank
    16990 2-Amino-4-(HyN[C@H](CCP(C 230 5342158 http://www.dDrugBank
    16991 Deserpidine COc1cc(cc(O 230.5 8232 http://www.dDrugBank
    16992 Bumetanide O=S(N)(=O)c2 230.5 2377 http://www.dDrugBank
    16993 Vindesine O=C(OC)[C@@ 231 37302 http://www.dDrugBank
    16994 Docetaxel CC(C)(C)OC( 232 130581 http://www.dDrugBank
    16995 Biotin O=C1N[C@@H] 232 149962 http://www.dDrugBank
    16996 PyrimethaminCCc1nc(N)nc(N 233.5 4819 http://www.dDrugBank
    16997 Alendronate OC(CCCN)(P(O 234 2004 http://www.dDrugBank
    16998 Prednisolone OCC(=O)[C@@ 235 5552 http://www.dDrugBank
    16999 Amsacrine CS(=O)(=O)Nc 235 2094 http://www.dDrugBank
    17000 LevothyroxineO=C(O)[C@@H]( 235.5 5614 http://www.dDrugBank
    17001 DextrothyroxiO=C(O)C(N)Cc2c 235.5 830 http://www.dDrugBank
    17002 SulfamerazineO=S(=O)(Nc1nc 236 5134 http://www.dDrugBank
    17003 Liothyronine O=C(O)[C@@H]( 236.5 5707 http://www.dDrugBank
    17004 Oxandrolone O=C2C[C@@H] 236.5 5667 http://www.dDrugBank
    17005 CephaloglycinN[C@H](c1cc 237 18069 http://www.dDrugBank
    17006 Clonazepam [O-][N+](=O)c 237.5 2700 http://www.dDrugBank
    17007 NitrofurazoneO=[N+]([O-]) 238 4566720 http://www.dDrugBank
    17008 Caffeine O=C2c1n(C)cn 238 2424 http://www.dDrugBank
    17009 Equilin Oc3cc4CC=C1 239 193995 http://www.dDrugBank
    17010 Guanosine NC3=Nc1c(nc 239 399452 http://www.dDrugBank
    17011 L-Cysteine O=C(O)[C@@H 240 5653 http://www.dDrugBank
    17012 Bentiromide Oc3ccc(CC(NC 241 2239 http://www.dDrugBank
    17013 Yohimbine O=C(OC)[C@H 241 8622 http://www.dDrugBank
    17014 DomperidoneClc4cc5NC(=O 242.5 3039 http://www.dDrugBank
    17015 Azathioprine O=[N+]([O-]) 243.5 2178 http://www.dDrugBank
    17016 Aspartame O=C(O)CC(N)C 246.5 2155 http://www.dDrugBank
    17017 Minoxidil Nc1cc(nc(N)[ 248 10438564 http://www.dDrugBank
    17018 Folic Acid O=C(O)[C@H]( 250 5815 http://www.dDrugBank
    17019 Clodronate ClC(Cl)(P(O)( 250 23731 http://www.dDrugBank
    17020 QuinethazoneNS(=O)(=O)c1 251 6068 http://www.dDrugBank
    17021 Resveratrol Oc2cc(/C=C/c1 254 392875 http://www.dDrugBank
    17022 Meloxicam Cc3cnc(NC(=O 254 10442740 http://www.dDrugBank
    17023 Furazolidone [O-][N+](=O) 255 4481255 http://www.dDrugBank
    17024 Creatine N=C(N)N(C)CC 255 566 http://www.dDrugBank
    17025 Metolazone NS(=O)(=O)c1 256 4026 http://www.dDrugBank
    17026 Enoximone O=C(C=1NC(=O 256 48492 http://www.dDrugBank
    17027 MeclofenamicClc2ccc(C)c(C 257 3897 http://www.dDrugBank
    17028 TrihexyphenidOC(CCN1CCCCC 258.5 5371 http://www.dDrugBank x salt JCB
    17029 4-acetamidobeO=C(C)Nc1ccc 260 18177 http://www.dDrugBank
    17030 Acetazolamid O=S(N)(=O)c1 260.5 1909 http://www.dDrugBank
    17031 Cinoxacin O=C(O)C2=NN 261 2660 http://www.dDrugBank
    17032 PhenolphthaleOc1ccc(cc1)C3 262.5 4600 http://www.dDrugBank
    17033 Nitrofurantoi O=[N+]([O-]) 263 4510228 http://www.dDrugBank
    17034 Trilostane N#CC=2C[C@] 264 570949 http://www.dDrugBank
    17035 Reserpine COc1cc(cc(O 264.5 5566 http://www.dDrugBank
    17036 HydromorphoO=C1CC[C@H] 266.5 4447624 http://www.dDrugBank
    17037 Fluoxymester C[C@]4(O)CC 270 6205 http://www.dDrugBank
    17038 Thalidomide O=C1NC(=O)C 270 5233 http://www.dDrugBank
    17039 Pefloxacin CN1CCN(CC1)c 271 46291 http://www.dDrugBank
    17040 Terazosin O=C(N1CCN(CC 273 5208 http://www.dDrugBank
    17041 Desonide OCC(=O)[C@] 274 4470603 http://www.dDrugBank
    17042 HydrochlorothNS(=O)(=O)c2 274 3513 http://www.dDrugBank
    17043 Pyromellitic AOC(=O)c1cc(c 276 6695 http://www.dDrugBank
    17044 Kaempherol Oc1ccc(cc1)C 277 4444395 http://www.dDrugBank
    17045 Prazosin O=C(N1CCN(CC 279 4724 http://www.dDrugBank
    17046 Riboflavin OC[C@@H](O) 280 431981 http://www.dDrugBank
    17047 Primidone CCC1(C(=O)NC 281.5 4740 http://www.dDrugBank
    17048 Mesalazine OC(=O)c1cc(N 283 3933 http://www.dDrugBank
    17049 Proflavine Nc1cc2nc3cc( 285 6832 http://www.dDrugBank
    17050 Benzene Hexac
    OC(=O)c1c(c( 287 2244 http://www.dDrugBank
    17051 Busulfan O=S(C)(=O)OC 287 2384 http://www.dDrugBank x clearly out of range JCB
    17052 Fumarate [O-]C(=O)/C=C 287 4573886 http://www.dDrugBank
    17053 MebendazoleO=C(OC)Nc1nc 288.5 3890 http://www.dDrugBank
    17054 Chloroquine CCN(CC)CCCC( 289 2618 http://www.dDrugBank x too high - possibly salt JCB
    17055 Rosoxacin O=C(O)C2=CN( 290 253208 http://www.dDrugBank
    17056 D-Alanine C[C@H](N)C( 292 5735 http://www.dDrugBank
    17057 D-Leucine CC(C)C[C@H]( 293 5880 http://www.dDrugBank
    17058 Amrinone NC1=CC(=CNC 295 3570 http://www.dDrugBank
    17059 Fluoromethol CC(=O)[C@@] 297 9494 http://www.dDrugBank
    17060 Nedocromil O=C(O)C2=CC( 299 45608 http://www.dDrugBank
    17061 Thiabendazol n1c3ccccc3nc 300 5237 http://www.dDrugBank
    17062 Methyldopa Oc1ccc(C[C@] 300 35562 http://www.dDrugBank
    17063 Genistein Oc1ccc(cc1)C 301.5 4444448 http://www.dDrugBank
    17064 Iodipamide O=C(Nc1c(I)c( 307 3608 http://www.dDrugBank
    17065 Fluocinonide CC(=O)OCC(= 309 9265 http://www.dDrugBank
    17066 Metyrosine Oc1ccc(C[C@] 312.5 390103 http://www.dDrugBank
    17067 Fluorescein Oc4cc5Oc1cc( 315 15968 http://www.dDrugBank
    17068 Triamterene Nc2nc(N)nc1nc 316 5345 http://www.dDrugBank
    17069 2-Aminoethane
    NCCS(=O)(=O) 328 1091 http://www.dDrugBank
    17070 Cycloleucine O=C(O)C1(N) 330 2798 http://www.dDrugBank
    17071 Theobromine Cn1cnc2c1C(= 357 5236 http://www.dDrugBank
    17072 Guanine NC2=Nc1ncnc 360 744 http://www.dDrugBank
    17073 Rutin Oc1ccc(cc1O 125 4444362 http://www.dDrugBank
    17074 TelithromycinCN(C)[C@H]5 182 2273373 http://www.dDrugBank
    17075 Rifampin CN1CCN(CC1)/ 183 10468813 http://www.dDrugBank
    17076 Fumagillin C[C@@]1(O[C 194.5 16735819 http://www.dDrugBank
    17077 Clarithromyci CN(C)[C@H]3 218.5 10342604 http://www.dDrugBank
    17078 Josamycin CC(C)CC(=O) 131.5 4447629 http://www.dDrugBank
    17079 MethylthioinoCSc3ncnc1c3 164 19953230 http://www.dDrugBank
    17080 N-Cholylglyci O=C(O)CNC(= 166.5 16739143 http://www.dDrugBank
    17081 Sucrose O[C@@H]1[C@ 185.5 5768 http://www.dDrugBank
    17082 Ribostamycin N[C@H]3[C@H 193.5 16736166 http://www.dDrugBank
    17083 Natamycin O=C(O)[C@@H 290 21242908 http://www.dDrugBank
    17084 CarbenoxolonO=C(O)CCC(= 292.5 552190 http://www.dDrugBank
    17085 1,2,3-trichlo Clc1cccc(Cl)c1 52.6 13864445 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17086 1,3,5-trichlo Clc1cc(Cl)cc(C 63.4 7662 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17087 11a-hydroxypCC(=O)[C@H] 222 83709 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17088 17alpha-ethynOc3cc4CC[C@ 143.5 5770 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17089 3,4-benzopyr c1cc2c3ccc4cc 179 2246 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17090 4-aminobenzoiOC(=O)c1ccc( 187.8 953 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17091 5,5-diethyl-2- O=C1NC(=S)NC 180 580885 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17092 5,5-diethylbarO=C1NC(=O)N 190 2206 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17093 5-allyl-5-phenO=C1NC(=O)NC 158.5 7975 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17094 7-methylpteriCc1cnc2cncnc 197 512534 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17095 acebutolol CC(C)NCC(O)C 123 1901 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17096 acetanilide O=C(C)Nc1ccc 114 880 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17097 alclofenac Clc1cc(ccc1O 92.5 28714 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17098 allopurinol Oc2ncnc1nnc 350 2010 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17099 alprenolol CC(C)NCC(O)C 109 2035 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17100 alprostadil O[C@@H]1CC( 116 4444306 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17101 aminopyrine CN(C)C=2C(=O 108 5787 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17102 amobarbital O=C1NC(=O)NC 157 2079 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17103 anthracene c1ccc2cc3cccc 218 8111 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17104 aprobarbital O=C1NC(=O)NC 142.7 6221 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17105 ascorbic acid OC=1C(=O)O[ 191 10189562 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17106 atropine CN3[C@@H]1C 115 10194105 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17107 azathioprine O=[N+]([O-]) 243.5 2178 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17108 benzamide NC(=O)c1cccc 130 2241 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17109 benzoic acid O=C(O)c1cccc 122.4 238 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17110 betamethasonOCC(=O)[C@@ 232.5 9399 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17111 betamethasonOCC(=O)[C@@ 184 15673 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17112 butalbital O=C1NC(=O)NC 140 2387 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17113 butallylonal O=C1NC(=O)NC 131.5 13723 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17114 butamben Nc1ccc(cc1)C 58 2388 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17115 butobarbitoneO=C1NC(=O)N 125.5 6229 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17116 butylparaben Oc1ccc(cc1)C 68.5 6916 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17117 camphor CC2(C)[C@H]1 179.8 139902 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17118 carbamazepinNC(=O)N2c3cc 191.5 2457 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17119 carbofuran CNC(=O)Oc1cc 151.5 2468 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17120 cefazolin O=C(O)C=3N4 190 30723 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17121 chloral hydratClC(Cl)(Cl)C(O 57 2606 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17122 chlorampheniO=[N+]([O-]) 151 5744 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17123 chlordiazepoxClc1ccc2N=C(C 236 10248513 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17124 cimetidine N#CN=C(NC)N 141.5 2654 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17125 ciprofloxacin O=C(O)C2=CN( 266 2662 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17126 clozapine CN1CCN(CC1)C 183.9 10442628 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17127 cocaine CN3[C@H]1CC 98 10194104 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17128 colchicine CC(=O)N[C@H] 146 5933 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17129 cortisone acetCC(=O)OCC(= 222 5543 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17130 cyproheptadi CN1CCC(CC1)= 112.8 2810 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17131 dapsone Nc1ccc(cc1)S( 175.5 2849 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17132 deoxycorticosCC(=O)OCC(= 157 5737 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17133 desipramine CNCCCN2c3ccc 25 2888 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17134 dexamethaso OCC(=O)[C@@ 263 5541 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17135 didanosine O=C3NC=Nc2c 161.5 45864 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17136 diethylstilbestOc1ccc(cc1)C( 177.9 395306 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17137 diflunisal OC(=O)c1cc(cc 210.5 2951 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17138 disopyramide CC(C)N(CCC(c1 94.8 3002 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17139 disulfiram CCN(CC)C(=S) 70 3005 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17140 estradiol Oc3cc4CC[C@ 176 5554 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17141 estriol Oc3cc4CC[C@ 282 5553 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17142 ethyl-4-aminoNc1ccc(cc1)C 89 13854242 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17143 fenbuconazol Clc3ccc(CCC(C 125 77712 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17144 fenclofenac Clc2cc(Cl)ccc 135 58860 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17145 fludioxonil N#Cc3cncc3c1 199.4 77916 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17146 fluorouracil FC1=CNC(=O) 282 3268 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17147 furosemide NS(=O)(=O)c2c 295 3322 http://dx.doi Hughes LD; Palx only one value here while many cluster ar
    17148 glutethimide CCC1(CCC(=O) 87.5 3367 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17149 heptobarbital CC1(C(=O)NC( 228.5 59547 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17150 hydrochlorothNS(=O)(=O)c2 269.5 3513 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17151 hydrocortisonOCC(=O)[C@@ 220.8 5551 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17152 hyoscyamine CN3[C@H]1CC 108.5 10246417 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17153 (+/+)-ibuprof CC(C(=O)O)c1c 74.6 3544 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17154 indomethacinClc1ccc(cc1)C 159.8 3584 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17155 (+/+)-indopro O=C(O)C(C)c1 212.5 3587 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17156 isoniazid O=C(NN)c1ccn 171.4 3635 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17157 isoproturon O=C(Nc1ccc(cc 158 33695 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17158 ketoconazol CC(=O)N1CCN( 146 401695 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17159 (+/+)-ketopro CC(C(=O)O)c1c 93.9 3693 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17160 labetalol O=C(N)c1cc(c 188 3734 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17161 l-dopa Oc1ccc(C[C@H 277 5824 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17162 lomefloxacin O=C(O)C2=CN( 239.8 3811 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17163 lorazepam Clc3ccccc3C2= 167 3821 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17164 mannitol O[C@H]([C@H 168 6015 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17165 meprobamateO=C(N)OCC(C) 105 3924 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17166 methyclothiazNS(=O)(=O)c2c 225 3978 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17167 methyprylon O=C1C(C)CNC( 75.5 4018 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17168 mitomycin c NC(=O)OC[C@ 360 5544 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17169 nadolol CC(C)(C)NCC 125 35815 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17170 nalidixic acid O=C(O)C2=CN( 229.5 4268 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17171 naphthalene c1cccc2ccccc1 80.2 906 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17172 norethindron O=C4CC[C@H] 203.5 5994 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17173 norfloxacin O=C(O)C2=CN( 220.5 4380 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17174 oxamniquine [O-][N+](=O) 148 4451 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17175 oxazepam Clc1ccc2NC(= 205.5 4455 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17176 p-aminosalicylOC(=O)c1ccc( 150.5 4488 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17177 pentazocin C/C(C)=CCN2 146 390041 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17178 pentobarbital O=C1NC(=O)NC 129.5 4575 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17179 pentoxifylline CC(=O)CCCCN2 105 4578 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17180 phenacetin CCOc1ccc(cc1 134.4 4590 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17181 phenanthrenec2cc3ccc1cccc 100 970 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17182 phenolphthaleOc1ccc(cc1)C3 260 4600 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17183 phenylbutazo O=C3C(CCCC)C 105 4617 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17184 phenytoin O=C1NC(=O)C( 296.1 1710 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17185 pindolol CC(C)NCC(O)C 170 4662 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17186 piroxicam OC=2c1ccccc1 200.3 10442653 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17187 probarbital O=C1NC(=O)NC 198 6213 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17188 probenecid O=S(=O)(N(CC 198.5 4742 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17189 procaine Nc1ccc(cc1)C 61 4745 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17190 progesterone CC(=O)[C@H] 126 5773 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17191 promazine CN(C)CCCN1c3 33 4757 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17192 promethazineCN(C)C(C)CN1 60 4758 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17193 propoxur CC(C)Oc1cccc 91.5 4775 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17194 propoxypheneCN(C)C[C@@H] 75.5 9696 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17195 propylparabe Oc1ccc(cc1)C 96.5 6907 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17196 pyrazinamide NC(=O)c1cncc 190 1017 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17197 pyrene c1ccc2ccc3cc 156 29153 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17198 quinidine COc1cc2c(cc 174.5 389880 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17199 salicylic acid OC(=O)c1cccc 158 331 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17200 secobarbital O=C1NC(=O)NC 95 5005 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17201 sorbitol O[C@H]([C@H 111 5576 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17202 sulfacetamideNc1ccc(cc1)S 183 5129 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17203 sulfamerazineO=S(=O)(Nc1nc 236.5 5134 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17204 sulfathiazole O=S(=O)(Nc1nc 202 5148 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17205 talbutal O=C1NC(=O)NC 109 7976 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17206 tenoxicam OC=2c1sccc1S 211 10442339 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17207 testosterone O=C4CC[C@@] 153.8 5791 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17208 tetroxoprim Nc2nc(N)ncc2 154.5 58910 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17209 thalidomide O=C1NC(=O)C 270 5233 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17210 thiamphenicolO=S(C)(=O)c1 165.3 25315 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17211 thioridazine CN4CCCCC4CCN 73 5253 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17212 thymine CC1=CNC(=O) 316 1103 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17213 triamcinoloneOCC(=O)[C@@ 270 29046 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17214 triamcinoloneCC(=O)OCC(= 235 5981 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17215 triazolam Clc4ccccc4C1= 234 5355 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17216 trifluoperazin FC(F)(F)c2cc 25 5365 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17217 warfarin CC(=O)CC(C1= 161 10442445 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17218 2-naphthol Oc1ccc2ccccc 122 8341 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17219 5,5-diphenylbOC(=O)c1cc(N 288 3933 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17220 5-aminosalicylOC(=O)c1cc(N 280 3933 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17221 acenaphthenec1cc2cccc3CCc 95 6478 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17222 acetazolamid O=S(N)(=O)c1 258.5 1909 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17223 acyclovir NC2=Nc1c(nc 265 1945 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17224 adenosine Nc3ncnc2c3n 234.5 54923 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17225 allobarbital O=C1NC(=O)N 172 5635 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17226 antipyrine O=C2C=C(C)N( 112 2121 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17227 atenolol CC(C)NCC(O)C 147 2162 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17228 buprenorphinCC(C)(C)[C@ 210 559124 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17229 caffeine O=C2c1n(C)cn 238 2424 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17230 chlorpromazi CN(C)CCCN1c3 57 2625 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17231 deoxycorticosOCC(=O)[C@H 141.5 5932 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17232 diatrizoic acidO=C(C)Nc1c(I) 300 2055 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17233 diuron Clc1ccc(NC(=O 158.5 3008 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17234 epinephrine Oc1ccc(cc1O 211.5 5611 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17235 etomidate CC(c1ccccc1) 67 33418 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17236 felodipine CC=1NC(C)=C( 145 3216 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17237 fenbufen O=C(CCC(=O)O 186.1 3218 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17238 fenchlorphos Clc1cc(OP(=S) 41 8939 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17239 heptabarbital O=C1NC(=O)N 175 10081 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17240 imipramine CN(C)CCCN2c3 174.5 3568 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17241 iprodione O=C2CN(C(=O)N 136 34418 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17242 methocarbamNC(=O)OCC(O 93 3964 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17243 methyl-p-hyd Oc1ccc(cc1)C 131 7176 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17244 methyltestostO=C4CC[C@@] 163.5 5788 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17245 minoxidil Nc1cc(nc(N)[ 248 10438564 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17246 nitrofurantoinO=[N+]([O-]) 263 5036498 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17247 perazine CN1CCN(CC1)C 53 4582 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17248 perphenazineOCCN1CCN(CC1 96.9 4586 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17249 phenobarbitalO=C1NC(=O)NC 175 4599 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17250 prochlorperazCN1CCN(CC1)C 228 4748 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17251 proline O=C(O)[C@@ 221 128566 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17252 reposal O=C1NC(=O)N 213 10468690 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17253 saccharin O=C2NS(=O)(= 229.3 4959 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17254 salicylamide O=C(N)c1cccc 140 4963 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17255 secbutabarbitO=C1NC(=O)NC 166.5 2385 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17256 spironolactonCC(=O)S[C@@ 134.5 5628 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17257 stanolone O=C3C[C@@H] 181 10189 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17258 strychnine O=C2C[C@@H] 280 389877 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17259 sulfanilamide Nc1ccc(cc1)S( 165.5 5142 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17260 triphenylene c3cc4c1ccccc1 199 8816 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17261 uracil O=C1C=CNC(= 338 1141 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17262 1,4-dibromobBrc1ccc(Br)cc 87.3 13868640 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17263 3-methylchol Cc2ccc3cc1c5 179.5 1611 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17264 acetaminopheOc1ccc(NC(C) 169.8 1906 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17265 amitriptyline CN(C)CCC=C1c 196 2075 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17266 ampicillin OC(=O)[C@@H 200.5 6013 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17267 aspirin O=C(C)Oc1ccc 138.5 2157 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17268 atrazine Clc1nc(NCC)nc 172.5 2169 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17269 baclofen Clc1ccc(cc1)C 208 2197 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17270 benperidol Fc1ccc(cc1)C 170.9 15521 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17271 benzanthrace c1c4ccccc4cc3 160 5739 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17272 bifonazole c1cc(ccc1c2cc 142 2287 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17273 bumetanide O=S(N)(=O)c2 230.5 2377 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17274 busulfan O=S(C)(=O)OC 116 2384 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17275 chlorpropami O=S(=O)(NC(= 127.8 2626 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17276 chlorpyrifos Clc1cc(Cl)c(C 41.5 2629 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17277 chlortetracyclNC(=O)C1=C(O 168.5 10469370 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17278 chlorthalidon NS(=O)(=O)c1c 225 2631 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17279 chrysene c1cc4ccccc4c2 254 8817 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17280 clofazimine Clc1ccc(cc1) 211 2692 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17281 clonidine Clc2cccc(Cl) 130 2701 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17282 codeine COc1ccc2C[C 157.5 4447447 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17283 corticosteron OCC(=O)[C@H 145 5550 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17284 cortisone OCC(=O)[C@@ 222 193441 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17285 cyclobarbital O=C1NC(=O)N 172.5 5632 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17286 dexamethasonCC(=O)OCC(= 263 4447596 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17287 diazepam Clc1ccc2c(c1) 128.6 2908 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17288 diazoxide Clc1ccc2N=C( 327.2 2911 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17289 dichlorprop Clc1cc(Cl)ccc 117.5 8120 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17290 diclofenac Clc2cccc(Cl)c 157 2925 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17291 diphenyl c1cc(ccc1)c2c 70 6828 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17292 ephedrine O[C@@H]([C@ 34 8935 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17293 erythromycin CN(C)[C@H]3 191 12041 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17294 estrone Oc3cc4CC[C@ 255.3 5660 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17295 ethylparaben Oc1ccc(cc1)C 116 13846749 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17296 famotidine NC(=N)Nc1nc( 163.5 3208 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17297 fenoxycarb O=C(OCC)NCCO 53.5 46739 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17298 fenpiclonil Clc1cccc(c1Cl 152.9 82824 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17299 fludrocortisonOCC(=O)[C@@ 261 29111 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17300 flufenamic aciFC(F)(F)c1cc( 125 3254 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17301 fluometuron O=C(Nc1cc(ccc 163.5 15702 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17302 fluorene c1cccc2Cc3cc 116.5 6592 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17303 flurbiprofen Fc2cc(ccc2c1c 110 3277 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17304 g-bhc(lindaneCl[C@@H]1[C@ 112.5 10481896 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17305 griseofulvin O=C2c3c(O[C@ 219 389934 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17306 guaifenesin OCC(O)COc1c 78.8 3396 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17307 haloperidol Fc1ccc(cc1)C( 148.7 3438 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17308 heroin CC(=O)Oc1cc 173 4575379 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17309 hexachlorobe Clc1c(Cl)c(Cl)c 231 8067 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17310 hydroflumethiFC(F)(F)c1cc 272.5 3521 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17311 isocarboxazid Cc1cc(no1)C( 105.5 3628 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17312 lidocaine O=C(Nc1c(C)c 68.5 3548 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17313 linuron Clc1ccc(NC(=O 93.5 9130 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17314 lovastatin C[C@@H](CC) 174.5 48085 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17315 mefenamic acO=C(O)c2cccc 230.5 3904 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17316 metoclopramiNc1cc(OC)c(c 147.3 4024 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17317 metronidazol Cc1ncc([N+]( 159 4029 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17318 naphthacene c1cccc2cc3cc4 357 6813 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17319 naproxen O=C(O)[C@@H] 154.3 137720 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17320 nevirapine O=C3Nc1c(C)c 248 4308 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17321 nicotinamide NC(=O)c1cccn 129.5 911 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17322 nicotinic acid O=C(O)c1cccn 236.6 913 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17323 omeprazole Cc3c(OC)c(C) 156 4433 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17324 orotic acid OC(=O)C1=CC 345.5 942 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17325 penicillamine O=C(O)[C@H]( 204 5643 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17326 perylene c1ccc5cccc4c 273.5 8788 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17327 prasterone O=C4CC[C@@H 140.5 5670 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17328 primidone CCC1(C(=O)NC 281.5 4740 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17329 propranolol CC(C)NCC(O)C 129 4777 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17330 prostaglandinO[C@@H]1CC( 67 4444059 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17331 proxyphylline CC(O)Cn2cnc1 135.5 4806 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17332 pteridine n1ccnc2ncncc 139.5 1014 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17333 quinine COc1cc2c(cc 177 84989 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17334 simvastatin CC(C)(CC)C( 136.5 49179 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17335 sulfadiazine O=S(=O)(Nc1n 252.5 5026 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17336 sulfamethazinO=S(=O)(Nc1nc 176 5136 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17337 sulfamethoxazCc2cc(NS(=O)( 171.5 5138 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17338 sulindac CS(=O)c1ccc(c 185.3 1265915 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17339 sulpiride CCN2CCCC2CNC 179 5162 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17340 theobromine Cn1cnc2c1C(= 357 5236 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17341 theophylline O=C2c1ncnc1N 273 2068 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17342 triamcinoloneOCC(=O)[C@@ 293 6196 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17343 triamterene Nc2nc(N)nc1nc 316 5345 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17344 triflupromazi FC(F)(F)c1cc2 25 5367 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17345 trimethoprim Nc2nc(N)ncc2 200.4 5376 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17346 xanax Clc1cc2C(=NC 230 2034 http://dx.doi Hughes LD; Palmer DS; Nigsch F and Mitchell JBO. 2008 Why are som
    17347 1,2,3,4-tetrac Clc2c1Oc3cccc 188 32611 http://www.s PHYSPROP
    17348 clanobutin O=C(c1ccc(Cl) 115.5 32563 http://www.s PHYSPROP
    17349 1(trans), 2(ci CC1CCC(C)C1C -112 32554 http://www.s PHYSPROP
    17350 cyclopentane,CC1CCC(C)C1C -116.4 32554 http://www.s PHYSPROP
    17351 cyclopentane,CC1CCCC1(C)C -21.6 32553 http://www.s PHYSPROP
    17352 cyclohexane, 1CC1CC(C)CC(C -107.4 32551 http://www.s PHYSPROP
    17353 cyclohexane, 1CC1CC(C)CC(C -49.7 32551 http://www.s PHYSPROP
    17354 cyclohexane, 1CC1CCCCC1(C -29 32550 http://www.s PHYSPROP
    17355 1,3-diformylb O=Cc1cccc(C= 89.5 32002 http://www.s PHYSPROP
    17356 dibenzofuran,Clc2c1c3ccccc3 169 32526 http://www.s PHYSPROP
    17357 ethiofencarb O=C(Oc1ccccc 33.4 31991 http://www.s PHYSPROP
    17358 benzene, 1,2- Cc1cccc(Cl)c1C 6 31931 http://www.s PHYSPROP
    17359 moricizine O=C(OCC)Nc1c 156.5 31872 http://www.s PHYSPROP
    17360 cyclohexanol, OC1CCC(Cl)CC 82.5 31848 http://www.s PHYSPROP
    17361 2,3-dichlorod Clc1cc2Oc3cc 163 31828 http://www.s PHYSPROP
    17362 hexadecanol CCCC(O)CCCC 49.5 31787 http://www.s PHYSPROP
    17363 pirimiphos-meCCN(CC)c1nc( 15 31773 http://www.s PHYSPROP
    17364 bicyclo[2.2.1] ClC2CC1CCC2 -5 31785 http://www.s PHYSPROP
    17365 toloxatone OCC2CN(c1ccc 76 31769 http://www.s PHYSPROP
    17366 mercarphon [iCP(=S)(OC)SC 36 31737 http://www.s PHYSPROP
    17367 prodiamine [O-][N+](=O)c 124 31719 http://www.s PHYSPROP
    17368 dinitramine CCN(CC)c1c(cc 98 31718 http://www.s PHYSPROP
    17369 1,3,6,8-tetra [O-][N+](=O)c 207 31661 http://www.s PHYSPROP
    17370 thiophene, 2, Cc1sccc1C -49 31595 http://www.s PHYSPROP
    17371 oxcarbazepin NC(=O)N3c1cc 215.5 31608 http://www.s PHYSPROP
    17372 thiobencarb Clc1ccc(CSC(= 3.3 31512 http://www.s PHYSPROP
    17373 2,6-dichloros C=Cc1c(Cl)ccc 89 31561 http://www.s PHYSPROP
    17374 nicomol O=C(OCC4(COC 178.5 31410 http://www.s PHYSPROP
    17375 propane, 1,1,1FC(F)(F)C(F)(F) -95 31317 http://www.s PHYSPROP
    17376 diisooctyl pht CC(C)CCCCCOC -4 31280 http://www.s PHYSPROP
    17377 2,4,6-tribrom Brc1cc(Br)cc( 70 31264 http://www.s PHYSPROP
    17378 eterobarb COCN1C(=O)C( 117 31271 http://www.s PHYSPROP
    17379 1-n-propylnapCCCc2cccc1cc -8.6 31151 http://www.s PHYSPROP
    17380 tetrachlorophO=C1OCc2c1c(C 209.5 31144 http://www.s PHYSPROP
    17381 norflurazon FC(F)(F)c1cc( 184 31131 http://www.s PHYSPROP
    17382 tetradecanol CCCC(O)CCCC 38 31104 http://www.s PHYSPROP
    17383 oxychlordane ClC3=C(Cl)C4( 144 31129 http://www.s PHYSPROP
    17384 diisodecyl adi CC(C)CCCCCC 27.4 31101 http://www.s PHYSPROP
    17385 benzene, 1-(1Cc1cccc(c1)C( -41.4 31082 http://www.s PHYSPROP
    17386 1-iodopropan CCCI -101.3 31029 http://www.s PHYSPROP
    17387 penfluridol FC(F)(F)c1cc( 106 31017 http://www.s PHYSPROP
    17388 2-hexyne CCCC#CC -89.6 31016 http://www.s PHYSPROP
    17389 diisodecyl phtCC(C)CCCCCCC -50 30996 http://www.s PHYSPROP
    17390 acetin CC(=O)OCC(O -78 30918 http://www.s PHYSPROP
    17391 tridecane, 7-mCCCCCCC(C)C -37.2 30987 http://www.s PHYSPROP
    17392 profluralin CCCN(CC1CC1)c 32.3 30913 http://www.s PHYSPROP
    17393 secbumeton COc1nc(NCC)n 87 30881 http://www.s PHYSPROP
    17394 ethofumesateCS(=O)(=O)Oc 71 30816 http://www.s PHYSPROP
    17395 1,2-dichloro-1ClC(F)C(Cl)F -101.2 30713 http://www.s PHYSPROP
    17396 clometacin Clc1ccc(cc1)C 242 30657 http://www.s PHYSPROP
    17397 1,1,3-trichlo ClCCC(Cl)Cl -59 30645 http://www.s PHYSPROP
    17398 1,2-benzenedic
    O=C(OCCCCCC -4 30643 http://www.s PHYSPROP
    17399 thiazafluron FC(F)(F)c1nnc 136.5 30487 http://www.s PHYSPROP
    17400 dowanol tpm COCC(C)OCC(C -77.8 30564 http://www.s PHYSPROP
    17401 isodecanol CC(C)CCCCCC 5 30480 http://www.s PHYSPROP
    17402 3,4-dimethylcCc1cc(Cl)ccc1 -6 30471 http://www.s PHYSPROP
    17403 mcpa-thioethyClc1cc(C)c(OC 41.5 30463 http://www.s PHYSPROP
    17404 isofenphos S=P(Oc1ccccc -12 30459 http://www.s PHYSPROP
    17405 3,5-dichlorot Cc1cc(Cl)cc(Cl 26 30422 http://www.s PHYSPROP
    17406 glisoxepid Cc1cc(no1)C( 189 30380 http://www.s PHYSPROP
    17407 1-penten-3-onC=C(C)C(=O)C -69.5 30379 http://www.s PHYSPROP
    17408 3-butenoic ac C=CCC(=O)O -35 30349 http://www.s PHYSPROP
    17409 pyracarbolid CC=2OCCCC=2 110.5 30211 http://www.s PHYSPROP
    17410 benzenamine,CCc1cccc(C)c -33 30109 http://www.s PHYSPROP
    17411 triazophos CCOP(=S)(OCC 3.5 29847 http://www.s PHYSPROP
    17412 pronamide Clc1cc(cc(Cl) 155 29822 http://www.s PHYSPROP
    17413 ethyrimol CCNc1nc(C)c( 160 29820 http://www.s PHYSPROP
    17414 6-undecanol CCCCCC(O)CC 25 29719 http://www.s PHYSPROP
    17415 pirimiphos ethCCN(CC)c1nc( 15 29635 http://www.s PHYSPROP
    17416 benzoic acid, Oc1c(C)cccc1 29 29521 http://www.s PHYSPROP
    17417 piperidine, 4- c1ccccc1CC2 16.8 29432 http://www.s PHYSPROP
    17418 butachlor ClCC(=O)N(CO -2.8 29376 http://www.s PHYSPROP
    17419 pirimicarb Cc1nc(nc(OC( 90.5 29348 http://www.s PHYSPROP
    17420 2h-1,4-benzodFC(F)(F)CN2c1 165 29343 http://www.s PHYSPROP
    17421 dimethamrtryCSc1nc(NCC)n 65 29282 http://www.s PHYSPROP
    17422 1h-imidazole-O=C(Cn1ccnc1 189 29299 http://www.s PHYSPROP
    17423 proquazone CC(C)N2c1cc( 137.5 29222 http://www.s PHYSPROP
    17424 3-ethylaceto CCc1cccc(c1)C -20 29209 http://www.s PHYSPROP
    17425 metipranolol O=C(C)Oc1c(C 106 29193 http://www.s PHYSPROP
    17426 2-methyl-1-ni[O-][N+](=O)c 270.5 29156 http://www.s PHYSPROP
    17427 rafoxanide Clc2cc(ccc2Oc 169 29191 http://www.s PHYSPROP
    17428 pyrene c1ccc2ccc3cc 151.2 29153 http://www.s PHYSPROP
    17429 1,4,5,8-naphthO=C(O)c1ccc( 320 29152 http://www.s PHYSPROP
    17430 disperse violeO=C2c1ccccc1 268 29150 http://www.s PHYSPROP
    17431 quinizarin gre Cc1ccc(cc1)Nc 218 29146 http://www.s PHYSPROP
    17432 dibenzo(b,defO=C2c1ccccc1 385 29142 http://www.s PHYSPROP
    17433 2,6-di-t-butyl CC(C)(C)c1ccc 39 29135 http://www.s PHYSPROP
    17434 1-chloro-2,5-pO=C1CCC(=O) 150 29129 http://www.s PHYSPROP
    17435 n1-phenylsulfaNc1ccc(cc1)S( 200 29121 http://www.s PHYSPROP
    17436 diphenyl sulf O=S(=O)(c1ccc 128.5 29117 http://www.s PHYSPROP
    17437 n,n'-dimethyl CN(C)C(C)=O -20 29107 http://www.s PHYSPROP
    17438 chloroprene C=C(Cl)C=C -130 29102 http://www.s PHYSPROP
    17439 methacrylonitrC=C(C)C#N -35.8 29101 http://www.s PHYSPROP
    17440 oxanamide O=C(N)C1(CC 90 29098 http://www.s PHYSPROP
    17441 tributylphosp CCCCOP(=O)( -79 29090 http://www.s PHYSPROP
    17442 tris(2,3-dibr BrCC(Br)COP( 5.5 29089 http://www.s PHYSPROP
    17443 dipentaerythriOCC(COCC(CO 221 29085 http://www.s PHYSPROP
    17444 tetrahydrothi O=S1(=O)CCC 27.6 29080 http://www.s PHYSPROP
    17445 2-hydroxymeth
    O=[N+]([O-]) 214 29070 http://www.s PHYSPROP
    17446 r-11 O=CC13CC=CC -80 29074 http://www.s PHYSPROP
    17447 3-bromo-1-chlCC1(C)C(=O)N 163.5 29069 http://www.s PHYSPROP
    17448 thymolphthaleCC(C)c1cc(c(C 253 29054 http://www.s PHYSPROP
    17449 pleuromutilin OCC(=O)OC3CC 170.5 29062 http://www.s PHYSPROP
    17450 2-bromo-1,1,1FC(F)(F)C(Br)F -80 29040 http://www.s PHYSPROP
    17451 1,2-dibromoteBrC(F)(F)C(Br) -110.4 29041 http://www.s PHYSPROP
    17452 octadecanamiNC(=O)CCCCC 109 29032 http://www.s PHYSPROP
    17453 dibromochlor BrC(Br)Cl -20 29036 http://www.s PHYSPROP
    17454 tetradecanal CCCCCCCCCCC 20.5 29031 http://www.s PHYSPROP
    17455 diethylene gl CCCCOCCOCCO -32 29028 http://www.s PHYSPROP
    17456 octanonitrile CCCCCCCC#N -45.6 29026 http://www.s PHYSPROP
    17457 methyl myristO=C(CCCCCCC 19 29024 http://www.s PHYSPROP
    17458 isononene CCCCCCCC=C -81.3 29025 http://www.s PHYSPROP
    17459 ethylmyristat O=C(CCCCCCC 12.3 29023 http://www.s PHYSPROP
    17460 acetic acid, 2, O=C(O)CSCC( 129 29017 http://www.s PHYSPROP
    17461 n-butyl stearaO=C(CCCCCCC 27 29018 http://www.s PHYSPROP
    17462 isoamyl acetaCC(=O)OCCC(C -78.5 29016 http://www.s PHYSPROP
    17463 n-butyl acetatCC(=O)OCCCC -78 29012 http://www.s PHYSPROP
    17464 1,4-dioxane C1COCCO1 11.8 29015 http://www.s PHYSPROP
    17465 pyrrolidine C1CCCN1 -57.8 29008 http://www.s PHYSPROP
    17466 dioctyl adipat CCCCCCCCOC( -70 29011 http://www.s PHYSPROP
    17467 ethyl hexanoaO=C(CCCCC)O -67 29005 http://www.s PHYSPROP
    17468 propionic anhCCC(=O)OC(= -45 29003 http://www.s PHYSPROP
    17469 2,4-pentaned CC(=O)CC(C)= -23 29001 http://www.s PHYSPROP
    17470 benzene, 1,3- O=C=Nc1cccc( 50 29002 http://www.s PHYSPROP
    17471 isopentanol CC(C)CCO -117.2 29000 http://www.s PHYSPROP
    17472 acetic acid, suO=C(O)CS(=O) 85 28997 http://www.s PHYSPROP
    17473 2,5-dimethylpCc1cnc(C)cn1 15 28992 http://www.s PHYSPROP
    17474 ethyl nonanoaO=C(CCCCCCC -36.7 28991 http://www.s PHYSPROP
    17475 succinyl peroxO=C(CCC(=O) 127 28988 http://www.s PHYSPROP
    17476 propanoic acidO=C(OCCCCCC 41 28990 http://www.s PHYSPROP
    17477 di(n-propyl) k CCCC(=O)CCC -33 28986 http://www.s PHYSPROP
    17478 vinyl butyrateCCCC(=O)OC= 116.7 28987 http://www.s PHYSPROP
    17479 p-ethylphenolCCc1ccc(O)cc 45 28982 http://www.s PHYSPROP
    17480 dodecylbenzeCCCCCCCCCCC 3 28977 http://www.s PHYSPROP
    17481 1-phenyltride CCCCCCCCCCC 10 28978 http://www.s PHYSPROP
    17482 2-anilinoetha OCCNc1ccccc 11 28975 http://www.s PHYSPROP
    17483 phenyl acetat O=C(C)Oc1ccc -30 28969 http://www.s PHYSPROP
    17484 4-butoxyphenOc1ccc(OCCCC 65.5 28973 http://www.s PHYSPROP
    17485 hydrazobenzeN(Nc1ccccc1)c 131 28962 http://www.s PHYSPROP
    17486 decanedioic acO=C(CCCCCCC -48 28959 http://www.s PHYSPROP
    17487 2-butanone, 4Oc1ccc(cc1OC 40.5 28952 http://www.s PHYSPROP
    17488 phenyl glydidyc2ccc(OCC1CO 3.5 28958 http://www.s PHYSPROP
    17489 m-nitroacetanO=C(C)Nc1cccc 155 28947 http://www.s PHYSPROP
    17490 dimetan O=C1C=C(CC(C 45.5 28942 http://www.s PHYSPROP
    17491 fenitrothion S=P(Oc1cc(C)c 3.4 28941 http://www.s PHYSPROP
    17492 naphthalene, 6CCc1ccc2CCCC -70 28931 http://www.s PHYSPROP
    17493 n-carbethoxypO=C(OCC)N2C( 91 28929 http://www.s PHYSPROP
    17494 3,9-dinitroflu [O-][N+](=O)c 223 28928 http://www.s PHYSPROP
    17495 benzenepropaCC(N)CCc1ccc 143 28910 http://www.s PHYSPROP x too high - possibly salt JCB
    17496 rubratoxin a O=C1C=CCC(O1 214 28923 http://www.s PHYSPROP
    17497 tyrazol S=C1N(C=CN1 123.5 28829 http://www.s PHYSPROP
    17498 3-pyridineme NCc1cccnc1 -21.1 28777 http://www.s PHYSPROP
    17499 fenamiphos Cc1cc(ccc1SC 49 28827 http://www.s PHYSPROP
    17500 1h-purine-2,6Nc1nc(N)nc2n 302 28738 http://www.s PHYSPROP
    17501 alcofenac Clc1cc(ccc1O 92.5 28714 http://www.s PHYSPROP
    17502 acetylpyrazin CC(=O)c1cncc 77 28682 http://www.s PHYSPROP
    17503 di-sec-butanoCCC(O)CNCC( 69 28603 http://www.s PHYSPROP
    17504 rubratoxin b O=C1C=CCC(O1 170.5 28591 http://www.s PHYSPROP
    17505 benzene, [2-mCC(C)C(C(C)C) -24.5 28580 http://www.s PHYSPROP
    17506 cyanazine Clc1nc(NCC)n 168 28552 http://www.s PHYSPROP
    17507 leptophos Clc2cc(OP(=S) 70.4 28496 http://www.s PHYSPROP
    17508 naphthalene, CC1Cc2ccccc2 -5 28481 http://www.s PHYSPROP
    17509 lofexidine Clc2cccc(Cl) 127 28460 http://www.s PHYSPROP
    17510 capobenic aci COc1c(cc(cc1 122 28425 http://www.s PHYSPROP
    17511 1h-indole, 2,3Cc1cc2c(cc1)n 121.5 28386 http://www.s PHYSPROP
    17512 razoxane O=C2CN(CC(C) 238 28423 http://www.s PHYSPROP
    17513 prynachlor CC(C#C)N(C(=O 43.5 28361 http://www.s PHYSPROP
    17514 metribuzin O=C1C(=NN=C( 126 28287 http://www.s PHYSPROP
    17515 chloraniformeClc1ccc(NC(NC 135 28170 http://www.s PHYSPROP
    17516 1,2,3,4-tetra Clc2c1ccccc1c( 198 27793 http://www.s PHYSPROP
    17517 1-thiocyanatoCCCCCCCCSC# 105 27750 http://www.s PHYSPROP
    17518 metoxuron COc1ccc(cc1C 126.5 27749 http://www.s PHYSPROP
    17519 heptadecylcy CCCCCCCCCCC 38 27670 http://www.s PHYSPROP
    17520 benzene, 1-brClc1cc(Br)cc(C 83 27660 http://www.s PHYSPROP
    17521 amiodarone hy[Cl-].Ic1cc(c 156 27664 http://www.s PHYSPROP x salt
    17522 oxadiazon O=C2OC(=NN2c1 90 27628 http://www.s PHYSPROP
    17523 1h-indole, 2,3[O-][N+](=O) 68 27653 http://www.s PHYSPROP
    17524 carbamic acid,O=C(NCCCN(C 120.5 27597 http://www.s PHYSPROP
    17525 (2-bromo-phen
    Brc1ccccc1CC 1 27535 http://www.s PHYSPROP
    17526 1,2,3,7,8,9-h Clc2cc1Oc3cc(C 243 27495 http://www.s PHYSPROP
    17527 4-amino-2,6-dO=[N+]([O-])c 171 27494 http://www.s PHYSPROP
    17528 1-bromo-2,6- Clc1cccc(Cl)c1 65 27488 http://www.s PHYSPROP
    17529 benzene, 1,4- Clc1ccc(Cl)c(C 5 27492 http://www.s PHYSPROP
    17530 2,5-xylenol, p Cc3cc(OP(=O)( 79.8 27334 http://www.s PHYSPROP
    17531 taurolidine O=S2(=O)CCN 156 27486 http://www.s PHYSPROP
    17532 4-hexyloxypheOc1ccc(OCCCC 46 27298 http://www.s PHYSPROP
    17533 oryzalin O=S(N)(=O)c1c 141 27326 http://www.s PHYSPROP
    17534 phenol, 4-pro Oc1ccc(OCCC) 56.5 27296 http://www.s PHYSPROP
    17535 benzene, 1,3,5O=[N+]([O-])c1 72 27183 http://www.s PHYSPROP
    17536 1,4-benzenedic
    CC(C)COC(=O) 55 27175 http://www.s PHYSPROP
    17537 caroxazone NC(=O)CN1Cc 204 27057 http://www.s PHYSPROP
    17538 methabenzthiCNC(=O)N(C)c 120 27173 http://www.s PHYSPROP
    17539 1-nonadeceneCCCCCCCCCCC 23 27049 http://www.s PHYSPROP
    17540 ethyl eicosan O=C(CCCCCCC 50 26986 http://www.s PHYSPROP
    17541 bicyclo 3.1.1 CC2(C)C1CC2C 9.8 27001 http://www.s PHYSPROP
    17542 isopropyl 4,4 OC(c1ccc(Br)c 77 26916 http://www.s PHYSPROP
    17543 iodofenphos Clc1cc(I)c(Cl 72.5 26915 http://www.s PHYSPROP
    17544 methyltris(tri C[Si](C)(C)O[Si -76 26824 http://www.s PHYSPROP
    17545 fentiazac O=C(O)Cc1sc(n 161.5 26854 http://www.s PHYSPROP
    17546 benzene, 1-ethCc1cc(C)c(C)c -13.5 26801 http://www.s PHYSPROP
    17547 benzenemethan
    OCc1ccccc1Cl 73 26799 http://www.s PHYSPROP
    17548 clonixin O=C(O)c2cccn 234 26711 http://www.s PHYSPROP
    17549 n-(cyclohexyl O=C3c1ccccc 92.6 26768 http://www.s PHYSPROP
    17550 2,3,4-trichlor Clc1ccc([N+]([ 55.5 26691 http://www.s PHYSPROP
    17551 amphetaminilCC(NC(C#N)c1 86 26613 http://www.s PHYSPROP
    17552 c.i. disperse r O=C2c1ccccc1 185 26544 http://www.s PHYSPROP
    17553 1,1,1,2,2,3,3- FC(F)(C(=O)CC( 38 26612 http://www.s PHYSPROP
    17554 isopropyl t-buCC(C)(C)OC(C) -88 26504 http://www.s PHYSPROP
    17555 nonane, 4-metCCCC(C)CCCC -99 26473 http://www.s PHYSPROP
    17556 khellol glucos COc2c4ccoc4c 179 26423 http://www.s PHYSPROP
    17557 dimepheptanoOC(CC)C(CC(C) 127 26418 http://www.s PHYSPROP
    17558 etamiphyllin CCN(CC)CCn2c 75 26354 http://www.s PHYSPROP
    17559 naphthalene, 1CC(C)(C)c2ccc -11.3 26283 http://www.s PHYSPROP
    17560 1,1,1,3-tetra ClC(Cl)(Cl)C(= 65 26223 http://www.s PHYSPROP
    17561 1(3cl2ohpr)-2 Cc1ncc([N+]([ 77.5 26102 http://www.s PHYSPROP
    17562 4-chloroguaiaOc1ccc(Cl)cc 16.5 26091 http://www.s PHYSPROP
    17563 cyclopentane,CC1(CC)CCCC1 -143.8 26072 http://www.s PHYSPROP
    17564 3,4,5-trichlor Clc1cc(OC)c(O 66 26090 http://www.s PHYSPROP
    17565 2,3,3,4-tetra CC(C)C(C)(C)C -102.1 26070 http://www.s PHYSPROP
    17566 3,3,4-trimeth CC(CC)C(C)(C) -101.2 26067 http://www.s PHYSPROP
    17567 2,2-dimethyl- CCC(CC)C(C)(C -99.3 26068 http://www.s PHYSPROP
    17568 2,3,3-trimeth CC(C)C(C)(C)C -116.8 26065 http://www.s PHYSPROP
    17569 2,4,4-trimeth CC(C)CC(C)(C) -113.4 26066 http://www.s PHYSPROP
    17570 2,2,4-trimeth CC(CC)CC(C)(C -120 26064 http://www.s PHYSPROP
    17571 ethephon ClCCP(=O)(O) 74.5 26031 http://www.s PHYSPROP
    17572 ethephon ClCCP(=O)(O) 74 26031 http://www.s PHYSPROP
    17573 n,n-dimethylhCN(C)O 108 26020 http://www.s PHYSPROP
    17574 3-(1-nitroso-2O=NN2CCCC2c 47 25973 http://www.s PHYSPROP
    17575 benzeneaceton
    Brc1ccc(CC#N 48 25968 http://www.s PHYSPROP
    17576 thenaldine CN1CCC(CC1)N 96 25957 http://www.s PHYSPROP
    17577 4-phenylpentaO=C(O)CCC(C) 13 25938 http://www.s PHYSPROP
    17578 5-amino-2-metCc1ccc(N)cc1 56.5 25942 http://www.s PHYSPROP
    17579 carbamothioicCN(C)C(Cl)=S 42.5 25932 http://www.s PHYSPROP
    17580 1(2h)-quinolinO=C(OCC)N1c 56.5 25898 http://www.s PHYSPROP
    17581 2,4-dimethylbCc1cc(C)ccc1 22 25874 http://www.s PHYSPROP
    17582 carbetamide CCNC(=O)C(C) 119 25761 http://www.s PHYSPROP
    17583 2,3,5-trichlor Clc1cnc(Cl)c(C 49 25741 http://www.s PHYSPROP
    17584 2,5-dichloropyClc1cnc(Cl)cc1 60.5 25757 http://www.s PHYSPROP
    17585 iocetamic acidO=C(O)C(C)CN( 224 25724 http://www.s PHYSPROP
    17586 2,3,4-trichlor Oc1ccc(Cl)c(Cl 83.5 25672 http://www.s PHYSPROP
    17587 2-methyl-1-h C=C(C)CCCCC -90 25610 http://www.s PHYSPROP
    17588 nonane, 5-metCCCCC(C)CCC -87.7 25609 http://www.s PHYSPROP
    17589 2,4,5-trichlor Clc2cc(c1ccccc 76.3 25605 http://www.s PHYSPROP
    17590 chlortoluron Cc1ccc(NC(=O) 148.1 25472 http://www.s PHYSPROP
    17591 indole-5-cyanN#Cc1cc2ccnc 107 25604 http://www.s PHYSPROP
    17592 phosphine, triCCP(CC)CC -88 25463 http://www.s PHYSPROP
    17593 n-acetylpeniciCC(C)(S)C(NC( 183 25469 http://www.s PHYSPROP
    17594 fluorodifen [O-][N+](=O)c 94 25404 http://www.s PHYSPROP
    17595 benzamide, 2-O=C(Nc1ccccc1 137 25310 http://www.s PHYSPROP
    17596 n,n-diethyl-2 CCN(CC)C(=O) 75 25304 http://www.s PHYSPROP
    17597 benzenemethan
    OCc1c(Cl)cccc 98 25276 http://www.s PHYSPROP
    17598 2-methyl-1-prCC(C)(C)CC(C) -98 25257 http://www.s PHYSPROP
    17599 benzeneethano
    O=[N+]([O-]) 2 25177 http://www.s PHYSPROP
    17600 prednival OCC(=O)C4(OC 211.5 25244 http://www.s PHYSPROP
    17601 1,1,2,3,3-pen ClC(Cl)C(Cl)C(C -10 25168 http://www.s PHYSPROP
    17602 d & c red no. Brc4c5Oc1c(Br 295 25161 http://www.s PHYSPROP
    17603 3-heptanol, 4-CC(CCC)C(O)C -123 25131 http://www.s PHYSPROP
    17604 4-pentylphenoOc1ccc(CCCCC 23 25119 http://www.s PHYSPROP
    17605 decimemide NC(=O)c1cc(O 121.5 25078 http://www.s PHYSPROP
    17606 1h-imidazole, CC(C)c1ncc([N 60 25097 http://www.s PHYSPROP
    17607 4-benzoylpyri O=C(c1ccccc1 72 24905 http://www.s PHYSPROP
    17608 3-(2-methylphCc2ccccc2Oc1 78 24889 http://www.s PHYSPROP
    17609 clioxanide Clc2ccc(NC(=O 215.5 24870 http://www.s PHYSPROP
    17610 deflazacort CC(=O)OCC(= 256 24883 http://www.s PHYSPROP
    17611 2,3,4,6-tetra Brc1cc(Br)c(Br 113.5 24841 http://www.s PHYSPROP
    17612 2,3-dimethylbu
    CC(C)C(C)C(= -1.5 24786 http://www.s PHYSPROP
    17613 cloforex Clc1ccc(CC(C) 52.75 24781 http://www.s PHYSPROP
    17614 fenazaflor FC(F)(F)c2nc1 103 24776 http://www.s PHYSPROP
    17615 [3,3]db18c6-dC1COc3ccccc 163 24722 http://www.s PHYSPROP
    17616 n-tetratriaco CCCCCCCCCCC 72.6 24702 http://www.s PHYSPROP
    17617 cyclohexene, CC1(C)CC=CCC -74.4 24634 http://www.s PHYSPROP
    17618 ethyl margaraO=C(CCCCCCC 28 24592 http://www.s PHYSPROP
    17619 metopimazineNC(=O)C1CCN( 170.5 24584 http://www.s PHYSPROP
    17620 bisoxatin acetCC(=O)Oc1ccc 190 24586 http://www.s PHYSPROP
    17621 nequinate O=C(OC)c2cnc 287.5 24579 http://www.s PHYSPROP
    17622 heptane, 2,3- CC(C)C(C)CCC -116 24571 http://www.s PHYSPROP
    17623 diacerein CC(=O)Oc3ccc 217.5 24456 http://www.s PHYSPROP
    17624 p-chlorophenoClc1ccc(OCC( 164 24438 http://www.s PHYSPROP
    17625 tris(1,3-dichl ClCC(OP(=O)(O 27 24388 http://www.s PHYSPROP
    17626 delmadinone CC(=O)C3(OC( 168 24407 http://www.s PHYSPROP
    17627 2-propanol, 1-ClCC(C)OP(=O) -40 24387 http://www.s PHYSPROP
    17628 mopidamol OCCN(CCO)c1n 157.5 24383 http://www.s PHYSPROP
    17629 decabromobipBrc1c(c(Br)c(B 375 24375 http://www.s PHYSPROP
    17630 isonicotinic a [O-][n+]1ccc( 270.5 24341 http://www.s PHYSPROP
    17631 quinalphos CCOP(=S)(OCC 31.5 24335 http://www.s PHYSPROP
    17632 1-amino-2-butCCC(O)CN 3 24319 http://www.s PHYSPROP
    17633 cyclohexanol, CC(C)(C)C1CC 45 24282 http://www.s PHYSPROP
    17634 apazone CN(C)C2=Nc1c 247 24310 http://www.s PHYSPROP
    17635 heptane, 2,2, CC(C)(C)CC(C) -67 24272 http://www.s PHYSPROP
    17636 2,2,3,3-tetra CC(C)(C)C(C)( -54 24271 http://www.s PHYSPROP
    17637 pyrazophos O=C(OCC)c1cn 51 24247 http://www.s PHYSPROP
    17638 1-pentadecenC=CCCCCCCCC -2.8 24142 http://www.s PHYSPROP
    17639 1-butanamine,CCNCCCC -78 24143 http://www.s PHYSPROP
    17640 chlorbromuroClc1cc(NC(=O) 96 24141 http://www.s PHYSPROP
    17641 1-methylbenzoCn2nnc1ccccc 64.5 24133 http://www.s PHYSPROP
    17642 n-nitrososarcoCN(N=O)CC(= 66.5 24047 http://www.s PHYSPROP
    17643 thietane, 1-oxO=S1CCC1 31.5 23987 http://www.s PHYSPROP
    17644 terbufos CC(C)(C)SCSP -29.2 23912 http://www.s PHYSPROP
    17645 benzoic acid, Nc1ccc(cc1)C 52 23947 http://www.s PHYSPROP
    17646 cyanofenphosS=P(OCC)(Oc1 83 23911 http://www.s PHYSPROP
    17647 2,2'-dichlorobClc2ccccc2c1c 61.5 23886 http://www.s PHYSPROP
    17648 4-(heptyloxy) Oc1ccc(OCCCC 61.5 23889 http://www.s PHYSPROP
    17649 benzene, 1,2-dClc1ccc(cc1Cl) 25.8 23874 http://www.s PHYSPROP
    17650 ancymidol OC(C1CC1)(c2 110.5 23841 http://www.s PHYSPROP
    17651 aceglutamide O=C(C)NC(CCC 197 23836 http://www.s PHYSPROP
    17652 disperse blue Brc2c(cc(cc2/ 157 23821 http://www.s PHYSPROP
    17653 clodronic acidClC(Cl)(P(O)( 250 23731 http://www.s PHYSPROP
    17654 2,3-dimethyl- C/C(C)=C(/C)C -118.3 23718 http://www.s PHYSPROP
    17655 tridecanal CCCCCCCCCCC 14 23643 http://www.s PHYSPROP
    17656 nitrogen tetro[O-][N+](=O)[ -9.3 23681 http://www.s PHYSPROP
    17657 mcpb-ethyl Clc1cc(C)c(O -1 23619 http://www.s PHYSPROP
    17658 tetrazepam Clc1ccc2c(c1 144 23551 http://www.s PHYSPROP
    17659 dl-camphorquCC2(C)C1CCC2 199 23544 http://www.s PHYSPROP
    17660 boron trichlorCl[B@](Cl)Cl -107 23480 http://www.s PHYSPROP
    17661 dialifor CCOP(=S)(OCC 68 23490 http://www.s PHYSPROP
    17662 borontribrom Br[B@](Br)Br -46 23479 http://www.s PHYSPROP
    17663 2,2-dibromo- BrC(Br)(C#N) 124.5 23422 http://www.s PHYSPROP
    17664 bicyclo[2.2.1] CC2(C)C1CCC2 186.5 23477 http://www.s PHYSPROP
    17665 piperidine, 1,1S(SN1CCCCC1 64.2 23420 http://www.s PHYSPROP
    17666 5-bromoindolBrc1cc2ccnc2 91 23286 http://www.s PHYSPROP
    17667 2-dodecanol CC(O)CCCCCC 19 23408 http://www.s PHYSPROP
    17668 sec-butylaminCC(N)CC -104 23255 http://www.s PHYSPROP
    17669 phosphorane,ClP(Cl)(Cl)(Cl) 148 23204 http://www.s PHYSPROP
    17670 ozone [O-][O+]=O -193 23208 http://www.s PHYSPROP
    17671 tetrachlorosil Cl[Si@](Cl)(Cl) -70 23201 http://www.s PHYSPROP
    17672 phosphorus oxClP(Cl)(Cl)=O 1.25 23198 http://www.s PHYSPROP
    17673 trichlorosilan Cl[SiH](Cl)Cl -126.5 23196 http://www.s PHYSPROP
    17674 3-hydroxy-5-mCc1cc(O)no1 86.5 23167 http://www.s PHYSPROP
    17675 di(2-ethybutylCCC(CC)COC(= -15 23185 http://www.s PHYSPROP
    17676 hexamethyldisC[Si](C)(C)O[Si -66 23150 http://www.s PHYSPROP
    17677 octadecanoic aO=C(CCCCCCC 60.5 23148 http://www.s PHYSPROP
    17678 phenmediphaO=C(Oc1cccc( 143 23134 http://www.s PHYSPROP
    17679 desmediphamO=C(Oc1cccc( 120 23133 http://www.s PHYSPROP
    17680 cyprazine Clc2nc(NC1CC 167 23128 http://www.s PHYSPROP
    17681 2-propanol, 1,1
    CC(O)CN(CC(C 45 23121 http://www.s PHYSPROP
    17682 octamethyltri C[Si](C)(O[Si]( -80 23101 http://www.s PHYSPROP
    17683 1,3-dichlorop ClC=CCCl -50 23117 http://www.s PHYSPROP
    17684 octadecanoic aOCC(O)COC(= 74 23095 http://www.s PHYSPROP
    17685 glyceryl monoOCC(O)COC(= 57 23095 http://www.s PHYSPROP
    17686 isopropyl phe CC(C)OC(=O)N 87.3 23083 http://www.s PHYSPROP
    17687 sulfuryl chlori ClS(Cl)(=O)=O -54.1 23050 http://www.s PHYSPROP
    17688 sulfur trioxideO=S(=O)=O 39.55 23080 http://www.s PHYSPROP
    17689 chlorosulfonicClS(=O)(=O)O -80 23040 http://www.s PHYSPROP
    17690 chlorine oxideClOCl -120.6 23048 http://www.s PHYSPROP
    17691 propane, 1,3,3CCOC(CCOCC) 53 23026 http://www.s PHYSPROP
    17692 phosphorous tBrP(Br)Br -41.5 23016 http://www.s PHYSPROP
    17693 thionyl fluori FS(F)=O -129.5 22954 http://www.s PHYSPROP
    17694 cyclohexanol, CC(=C)C1CCC( 78 22988 http://www.s PHYSPROP
    17695 hydrazoic acid[N-]=[N+]=N -80 22937 http://www.s PHYSPROP
    17696 chlorine ClCl -101 22933 http://www.s PHYSPROP
    17697 vancide-th CCN1CN(CN(C 70 22920 http://www.s PHYSPROP
    17698 bromine BrBr -7.25 22817 http://www.s PHYSPROP
    17699 cyclohexanoneCC(=C)C1CC(= -11 22881 http://www.s PHYSPROP
    17700 phosphorus P 44.1 22814 http://www.s PHYSPROP x inorganic element phosporus JCB
    17701 phosphine P -133 22814 http://www.s PHYSPROP x inorganic JCB
    17702 thionyl chlori ClS(Cl)=O -104.5 22797 http://www.s PHYSPROP
    17703 phosphorus trClP(Cl)Cl -93.6 22798 http://www.s PHYSPROP
    17704 4-bromo-2-nitOc1ccc(Br)cc1 92 22779 http://www.s PHYSPROP
    17705 propionylpro CCC(=O)c1cc2 69.5 22768 http://www.s PHYSPROP
    17706 benzenemethan
    C(N(Cc1ccccc1 91.5 22739 http://www.s PHYSPROP
    17707 quinoline, 5-mCc1cccc2nccc 19 22730 http://www.s PHYSPROP
    17708 oxirane, (1,1- CC(C)(C)OCC1 -70 22732 http://www.s PHYSPROP
    17709 s-triazine-2,4,N#Cc1nc(C#N) 119 22677 http://www.s PHYSPROP
    17710 1,8-octanediaNCCCCCCCCN 52 22672 http://www.s PHYSPROP
    17711 2,3-dichlorob CC(Cl)C(C)Cl -80 22655 http://www.s PHYSPROP
    17712 butane, 2,3-dicCC(Cl)C(C)Cl -80 22655 http://www.s PHYSPROP
    17713 dichloroacety ClC#CCl -66 22649 http://www.s PHYSPROP
    17714 2-ethylstyren CCc1ccccc1C= -75.5 22640 http://www.s PHYSPROP
    17715 m-ethylstyrenCCc1cccc(C=C -101 22567 http://www.s PHYSPROP
    17716 phenol, 2-(ph Oc2ccccc2Cc1 21 22638 http://www.s PHYSPROP
    17717 1,2-benzenediOC(=O)Cc1ccc 151 22547 http://www.s PHYSPROP
    17718 2-methylcycloh
    C[C@H]1CCCC 7 22439 http://www.s PHYSPROP
    17719 2-methylcycloC[C@@H]1CC -21 22437 http://www.s PHYSPROP
    17720 etaqualone CCc1ccccc1N3 81 22357 http://www.s PHYSPROP
    17721 1,1'-biphenyl,Cc1cccc(c1)c2 14.5 22306 http://www.s PHYSPROP
    17722 molindone O=C1C(CCc2nc 180.5 22342 http://www.s PHYSPROP
    17723 octanohydroxaO=C(CCCCCCC 78.75 22293 http://www.s PHYSPROP
    17724 2,3,4-trichlor Cc1ccc(Cl)c(Cl 43.5 22272 http://www.s PHYSPROP
    17725 hepes OCCN1CCN(CC 234 22278 http://www.s PHYSPROP
    17726 dimethylmalon
    N#CC(C)(C)C# 31.5 22200 http://www.s PHYSPROP
    17727 erythrityl tetr O=[N+]([O-])O 61 22183 http://www.s PHYSPROP
    17728 2-methylquinoCc1cnc2ccccc 180.5 22148 http://www.s PHYSPROP
    17729 monalide (potClc1ccc(NC(=O 87.5 22175 http://www.s PHYSPROP
    17730 aflatoxin g2 O=C2Oc1c4C5 238.5 22132 http://www.s PHYSPROP
    17731 aflatoxin b2 O=C2Oc1c4C5 287.5 22111 http://www.s PHYSPROP
    17732 cyheptamide NC(=O)C2c3cc 193.5 22071 http://www.s PHYSPROP
    17733 2-bromo-benzo
    O=C(Cl)c1cccc 11 22012 http://www.s PHYSPROP
    17734 3(2h)-benzof O=C2COc1ccc 102.5 22025 http://www.s PHYSPROP
    17735 3-methyl-4-chNc1ccc(Cl)c(C 83.5 22006 http://www.s PHYSPROP
    17736 2,3-dimethyl- C/C(C)=C(/C)C -115.1 21998 http://www.s PHYSPROP
    17737 4-chloro-5-meOc1cc(C)c(Cl) 133 22002 http://www.s PHYSPROP
    17738 4-piperidine NCC1CCNCC1 25 21997 http://www.s PHYSPROP
    17739 methyl penta O=C(CCCCCCC 18.5 21988 http://www.s PHYSPROP
    17740 piperidine, 1-n[O-][N+](=O) -5.5 21977 http://www.s PHYSPROP
    17741 tetratetracon CCCCCCCCCCC 87.5 21965 http://www.s PHYSPROP
    17742 phosphoric aciO=P(O)(OCCC 59 21941 http://www.s PHYSPROP
    17743 dmamp CN(C)C(C)(C)C 19 21914 http://www.s PHYSPROP
    17744 phosphonothioi
    CP(=S)(OCC)O -84.4 21906 http://www.s PHYSPROP
    17745 2-methyldecaCCCCCCCCC(C -48.9 21896 http://www.s PHYSPROP
    17746 dioxacarb CNC(=O)Oc1c 114.5 21901 http://www.s PHYSPROP
    17747 tiadenol OCCSCCCCCCC 69.5 21885 http://www.s PHYSPROP
    17748 3-bromobenzon
    N#Cc1cc(Br)cc 39.5 21865 http://www.s PHYSPROP
    17749 hexanedioic acCC(C)OC(=O)C -1.1 21853 http://www.s PHYSPROP
    17750 3-methyl-4-brNc1ccc(Br)c(C 81 21844 http://www.s PHYSPROP
    17751 1,2-dimethylcC[C@@H]1CC -90 21800 http://www.s PHYSPROP
    17752 di (sec-butyl) CC(CC)OC(C)C -100 21785 http://www.s PHYSPROP
    17753 6-dodecanol CCCCCCC(O)C 30 21760 http://www.s PHYSPROP
    17754 1h-pyrazole, 3Cc1nnc(Cl)c1[ 111 21750 http://www.s PHYSPROP
    17755 1-cyclohexylhCCCCCCCCCCC 33.6 21749 http://www.s PHYSPROP
    17756 sec-butyl met CC(CC)OC -100 21740 http://www.s PHYSPROP
    17757 m-acetylacet O=C(C)c1cccc( 32 21733 http://www.s PHYSPROP
    17758 1-heptadecenCCCCCCCCCCC 11.5 21723 http://www.s PHYSPROP
    17759 1-phenylundeCCCCCCCCCCC -5 21703 http://www.s PHYSPROP
    17760 propanenitrileClc2cc(ccc2/N 157 21650 http://www.s PHYSPROP
    17761 1-cyclopentyl CCCCCCCCCCC 42 21682 http://www.s PHYSPROP
    17762 2,4,5-trichlor Cc1cc(Cl)c(Cl) 82.4 21642 http://www.s PHYSPROP
    17763 morpholine, 4-[O-][N+](=O) 110.5 21533 http://www.s PHYSPROP
    17764 n-phenylmorpC1CC(CCC1)N 52.5 21477 http://www.s PHYSPROP
    17765 bis(2-ethylhexCCC(CCCC)COC -48 21471 http://www.s PHYSPROP
    17766 2,6-dinitro-4- O=[N+]([O-])c 171.5 21447 http://www.s PHYSPROP
    17767 allyxycarb [bsiO=C(Oc1cc(C) 67 21446 http://www.s PHYSPROP
    17768 cloxyfonac Clc1cc(CO)c( 141 21439 http://www.s PHYSPROP
    17769 hexanoic acid,O=C(CCCCC)O -55 21430 http://www.s PHYSPROP
    17770 9h-fluoren-1- Nc2cccc1c3cc 125.5 21392 http://www.s PHYSPROP
    17771 1h-inden-1-ol,OC2CCc1ccccc 54.8 21394 http://www.s PHYSPROP
    17772 4-nitrobenzenO=S(N)(=O)c1c 179 21360 http://www.s PHYSPROP
    17773 (2-methoxyphCOc2ccccc2/N 41 21353 http://www.s PHYSPROP
    17774 1-propanone, O=C(CC)c1ccc( 37.3 21278 http://www.s PHYSPROP
    17775 2-chloro-5-nitNc1cc(ccc1Cl) 121 21272 http://www.s PHYSPROP
    17776 4-(bromomethy
    BrCc1ccc(cc1) 230 21185 http://www.s PHYSPROP
    17777 methyl p-nitr COS(=O)(=O)c1 94 21173 http://www.s PHYSPROP
    17778 c.i. disperse Clc2cc(cc(Cl) 127 21184 http://www.s PHYSPROP
    17779 aminopentamNC(=O)C(CC(C) 137 21159 http://www.s PHYSPROP
    17780 desethylatraz Nc1nc(NC(C)C) 133 21157 http://www.s PHYSPROP
    17781 methyl decyl CC(=O)CCCCC 21 21153 http://www.s PHYSPROP
    17782 cyclohexane, 1C(CCC1CCCCC 12 21143 http://www.s PHYSPROP
    17783 chlordimefor Clc1cc(C)c(/N 35 21141 http://www.s PHYSPROP
    17784 1-isopropylnaCC(C)c2cccc1c -16 21133 http://www.s PHYSPROP
    17785 2,4,5-trichlor Clc1cc(OC)c(Cl 77.5 21106 http://www.s PHYSPROP
    17786 indole, 5-nitro[O-][N+](=O)c 141 21124 http://www.s PHYSPROP
    17787 mebhydrolineCN3Cc4c1cccc 95 21129 http://www.s PHYSPROP
    17788 11-methylbenCc2cccc1cc3c 118 21092 http://www.s PHYSPROP
    17789 2-methyl-1-h C=C(C)CCCC -102.8 21073 http://www.s PHYSPROP
    17790 4-pentynoic aC#CCCC(=O)O 57.7 21069 http://www.s PHYSPROP
    17791 1h-1,2,4-triaz c2cc(Cn1cncn1 49 21064 http://www.s PHYSPROP
    17792 c.i. disperse d [O-][N+](=O) 156 21040 http://www.s PHYSPROP
    17793 cytisine O=C2C=CC=C3 152.5 21030 http://www.s PHYSPROP
    17794 butanilicaine Clc1cccc(C)c 45.5 21004 http://www.s PHYSPROP
    17795 2-pentanol CC(O)CCC -73 21011 http://www.s PHYSPROP
    17796 tetrachloroth Clc1sc(Cl)c(Cl 30.5 20971 http://www.s PHYSPROP
    17797 n-pentadecylcCCCCCCCCCCC 29 20955 http://www.s PHYSPROP
    17798 n-tridecylcyc CCCCCCCCCCC 18.5 20954 http://www.s PHYSPROP
    17799 d-limonene CC1=CCC(CC1) -74.3 20939 http://www.s PHYSPROP
    17800 limonene CC1=CCC(CC1) -95 20939 http://www.s PHYSPROP
    17801 s-(-)-limoneneCC1=CCC(CC1) -90 20939 http://www.s PHYSPROP
    17802 hydrohydrastiCN1Cc2cc3OC 66 20932 http://www.s PHYSPROP
    17803 3-amino-2-napO=C(O)c1cc2c 216.5 20884 http://www.s PHYSPROP
    17804 terbuthylazin Clc1nc(NCC)nc 178 20848 http://www.s PHYSPROP
    17805 benzoylhydrazO=C(NN)c1ccc 166 20861 http://www.s PHYSPROP
    17806 nonane, 3-metCCC(C)CCCCC -84.8 20844 http://www.s PHYSPROP
    17807 ethyl docosanO=C(CCCCCCC 50 20841 http://www.s PHYSPROP
    17808 terbacil O=C1NC(C)=C( 176 20830 http://www.s PHYSPROP
    17809 a-(a-aminoproOC(C(N)CC)c1 79.5 20829 http://www.s PHYSPROP
    17810 4-dimethylamCN(C)c1ccc(O) 77 20816 http://www.s PHYSPROP
    17811 2-amino-butanCCC(N)CO -2 20788 http://www.s PHYSPROP
    17812 2-amino-1-butCCC(N)CO -2 20788 http://www.s PHYSPROP
    17813 isopropyl-4,4' OC(c1ccc(Cl)c 73 20762 http://www.s PHYSPROP
    17814 thiophen-2-c NC(=O)c1cccs 182 20732 http://www.s PHYSPROP
    17815 1-methyl-1,2-CC(Cc1ccccc1) 52 20737 http://www.s PHYSPROP
    17816 1h-benzimidazCc2nc1ccccc1 51 20723 http://www.s PHYSPROP
    17817 methyl hexac O=C(CCCCCCC 63.8 20719 http://www.s PHYSPROP
    17818 alpha-bromobe
    N#CC(Br)c1cc 29 20715 http://www.s PHYSPROP
    17819 maleic hydrazO=C1C=CC(=O 306 20632 http://www.s PHYSPROP
    17820 acetonitrile, 2N#CCN(CCN(C 128 20659 http://www.s PHYSPROP
    17821 acetylpyruvic CC(=O)CC(=O) 99.5 20603 http://www.s PHYSPROP
    17822 2-dimethylamiCN(C)c1ccccn 182 20570 http://www.s PHYSPROP
    17823 dimoxyline CCOc1ccc(cc1 124.5 20564 http://www.s PHYSPROP
    17824 oct-2-ynoic acO=C(O)C#CCC 4 20558 http://www.s PHYSPROP
    17825 heptylcycloheCCCCCCCC1CC -30 20521 http://www.s PHYSPROP
    17826 prednisolone CCN(CC)CC(=O 176 20527 http://www.s PHYSPROP
    17827 benzenamine,Fc1c(F)c(F)cc( 28 20449 http://www.s PHYSPROP
    17828 chlorpyrifos mClc1cc(Cl)c(C 43 20493 http://www.s PHYSPROP
    17829 iopydol OC(CN1C=C(I) 161 20443 http://www.s PHYSPROP
    17830 teclozan ClC(Cl)C(=O)N 140 20418 http://www.s PHYSPROP
    17831 pyrene, 1-nitr[O-][N+](=O)c 155 20390 http://www.s PHYSPROP
    17832 buquinolate CC(C)COc1cc2 289.5 20350 http://www.s PHYSPROP
    17833 2,6-di-sec-butOc1c(cccc1C(C -42 20381 http://www.s PHYSPROP
    17834 n-(3-bromoproO=C2c1ccccc1 75 20311 http://www.s PHYSPROP
    17835 butyl heptanoO=C(CCCCCC) -67.5 20298 http://www.s PHYSPROP
    17836 3-methylcycloh
    C[C@@H]1C[C -5.5 20301 http://www.s PHYSPROP
    17837 3,5-dimethylcCC1CC(O)CC(C 11.6 20286 http://www.s PHYSPROP
    17838 phenyl-b-pyri O=C(c1ccccc1 38 20245 http://www.s PHYSPROP
    17839 9h-fluorene, 2[O-][N+](=O)c 334 20209 http://www.s PHYSPROP
    17840 2,3-dibromobBrC(C)C(Br)C -24 20215 http://www.s PHYSPROP
    17841 3-pentanone, O=C(CCc1cccc 13.5 20203 http://www.s PHYSPROP
    17842 2-hydroxyethyNC(=O)OCCO 43 20199 http://www.s PHYSPROP
    17843 cis-1,2,2-trim CC1(CCC(C(=O 187 20198 http://www.s PHYSPROP
    17844 2,6-dinitro-4- O=[N+]([O-])c 147 20191 http://www.s PHYSPROP
    17845 camphoric aciCC1(CCC(C(=O 189.1 20198 http://www.s PHYSPROP
    17846 dibenzo(a,e)f c5cc6c3cc1ccc 232 20188 http://www.s PHYSPROP
    17847 2,4-nh2-5(3,4 Nc2nc(N)ncc2 233 20162 http://www.s PHYSPROP
    17848 4-aminobenzoO=C(NN)c1ccc 226 20160 http://www.s PHYSPROP
    17849 3-chloro-4-meCOc1ccc(N)cc1 52.5 20151 http://www.s PHYSPROP
    17850 benzenemethaOCc1ccccc1N 83.5 20149 http://www.s PHYSPROP
    17851 m-aminobenzyl
    OCc1ccccc1N 94 20149 http://www.s PHYSPROP
    17852 1-(4-methylphCc1ccc(cc1)C( 7.2 20140 http://www.s PHYSPROP
    17853 2,6-dimethylcCC1CCCC(C)C 32.5 20139 http://www.s PHYSPROP
    17854 1-ethoxy-naphCCOc2cccc1cc 5.5 20115 http://www.s PHYSPROP
    17855 3-bromoquinoBrc1cc2ccccc 13.3 20124 http://www.s PHYSPROP
    17856 1-hydroxypyr Oc4ccc1ccc2c 180 20100 http://www.s PHYSPROP
    17857 cyclohexylacetOC(=O)CC1CC 33 20080 http://www.s PHYSPROP
    17858 phenylisothio N#CSc1ccccc1 -21 20074 http://www.s PHYSPROP
    17859 oxycarboxin CC=1OCCS(=O) 120 20048 http://www.s PHYSPROP
    17860 carboxin O=C(Nc1ccccc 91.5 20027 http://www.s PHYSPROP
    17861 benzadox O=C(NOCC(=O) 140 20040 http://www.s PHYSPROP
    17862 dimethirimol Cc1nc(nc(O)c 102 20014 http://www.s PHYSPROP
    17863 ethyl isopropyCC(C)SCC -122.2 19957 http://www.s PHYSPROP
    17864 c.i. disperse O=S(=O)(Nc1cc 156 19933 http://www.s PHYSPROP
    17865 1h-isoindole-1O=C2c1ccccc1 79 19862 http://www.s PHYSPROP
    17866 benzoic acid, O=C(C)Oc2ccc 175 19846 http://www.s PHYSPROP
    17867 2-benzothiazoc1cccc2sc(nc 99.75 19825 http://www.s PHYSPROP
    17868 3-methyl-2-niO=[N+]([O-])c 37 19776 http://www.s PHYSPROP
    17869 benzene, 1,1' Cc1ccc(cc1)Cc 28 19816 http://www.s PHYSPROP
    17870 dehydroemetiCOc4cc5CCN[ 95 19773 http://www.s PHYSPROP
    17871 2,3,4,5-tetra Clc1c(O)cc(Cl) 116.5 19766 http://www.s PHYSPROP
    17872 octyl caproateCCCCCCCCOC( -28 19759 http://www.s PHYSPROP
    17873 1,1'-bicyclopeO=C1CCCC1C2 -13 19756 http://www.s PHYSPROP
    17874 1-chlorohexa CCCCCCCCCCC 17.9 19747 http://www.s PHYSPROP
    17875 pentanedioic aCC(C)(CC(O)= 103.5 19739 http://www.s PHYSPROP
    17876 1,3-dithiolaneC1CSCS1 -50 19727 http://www.s PHYSPROP
    17877 1-naphthalen OCc2cccc1ccc 64 19669 http://www.s PHYSPROP
    17878 3-cyclohexeneO=C(O)C1CC= 17 19664 http://www.s PHYSPROP
    17879 3-chloro-2-nitO=[N+]([O-])c 238 19663 http://www.s PHYSPROP
    17880 nitralin O=S(C)(=O)c1c 150 19622 http://www.s PHYSPROP
    17881 benzene, 2,4- Cc1cc(C)ccc1C -82 19607 http://www.s PHYSPROP
    17882 2-tetradecanoCC(O)CCCCCC 34 19606 http://www.s PHYSPROP
    17883 cyclohexane, 1C1CCCCC1OC2 -36 19544 http://www.s PHYSPROP
    17884 3-methylcarbaCc1cc2c3cccc 208.5 19534 http://www.s PHYSPROP
    17885 2,4,6-tribrom Brc1c(C)c(Br) 84 19526 http://www.s PHYSPROP
    17886 13h-dibenzo(aO=C3c1c5cccc 214 19519 http://www.s PHYSPROP
    17887 2-methylaminCNc1ccccn1 15 19516 http://www.s PHYSPROP
    17888 3-phenyl-n-butO=C(O)CC(C)c 38 19513 http://www.s PHYSPROP
    17889 c.i. disperse r Clc2cc(ccc2/N 190 19460 http://www.s PHYSPROP
    17890 2-methylpentaCC(CCC#N)C# -45 19482 http://www.s PHYSPROP
    17891 nitracrine CN(C)CCCNc1c3 134.5 19425 http://www.s PHYSPROP
    17892 6-bromo-2,4-dClc1cc(Cl)cc(B 68 19415 http://www.s PHYSPROP
    17893 1,1,3-trimeth CC1CCC(C)(C) -142.4 19413 http://www.s PHYSPROP
    17894 c.i. disperse b O=C2c1ccccc1 248 19353 http://www.s PHYSPROP
    17895 benzene, (1-etCCC(CCC)c1cc -55.4 19350 http://www.s PHYSPROP
    17896 2,4,5-trimeth COc1cc(OC)c( 114 19331 http://www.s PHYSPROP
    17897 c.i. disperse r O=C3c1ccccc1 168 19333 http://www.s PHYSPROP
    17898 cyclohexane, CCCCCCCCCCC 41.6 19320 http://www.s PHYSPROP
    17899 eicosylcycloh CCCCCCCCCCC 48.5 19317 http://www.s PHYSPROP
    17900 cyclohexaneetOCCC1CCCCC1 -20 19315 http://www.s PHYSPROP
    17901 furan, 2,2'- d C(SSCc1ccco1 10 19306 http://www.s PHYSPROP
    17902 3,4-dimethylbCc1ccc(cc1C)c 29.5 19299 http://www.s PHYSPROP
    17903 4-methyl-[1,3CC1CCOS(=O) 5 19288 http://www.s PHYSPROP
    17904 butylboronic aCCCCB(O)O 95 19286 http://www.s PHYSPROP
    17905 mucochloric aClC=1C(OC(=O 142 19258 http://www.s PHYSPROP
    17906 c.i. disperse b O=C2c1ccccc1 192 19232 http://www.s PHYSPROP
    17907 n-formylmorpO=CN1CCOCC 21 19231 http://www.s PHYSPROP
    17908 monomethylph
    COC(=O)c1ccc 83 19207 http://www.s PHYSPROP
    17909 4-chloroazob Clc2ccc(/N=N/ 88 19167 http://www.s PHYSPROP
    17910 2,5-diaminopyNc1cnc(N)cc1 110.3 19138 http://www.s PHYSPROP
    17911 pyrimidine, 4,O=[N+]([O-])c 101.5 19136 http://www.s PHYSPROP
    17912 dis. a. 17 Cc1cc(ccc1N(C 74 19133 http://www.s PHYSPROP
    17913 dis. a. 16 Cc1cc(ccc1N(C 126 19132 http://www.s PHYSPROP
    17914 pentylcycloheCCCCCC1CCCC -57.5 19110 http://www.s PHYSPROP
    17915 1-cyclohexylhCCCCCCC1CCC -43 19109 http://www.s PHYSPROP
    17916 1-iodododecaCCCCCCCCCCC 0.3 19108 http://www.s PHYSPROP
    17917 1-iodoheptan CCCCCCCI -48.2 19100 http://www.s PHYSPROP
    17918 2,5-thiophened
    OC(=O)c1ccc( 359 19099 http://www.s PHYSPROP
    17919 propane, 1,1'-sCCCS(=O)CCC 22.5 19078 http://www.s PHYSPROP
    17920 tybamate O=C(NCCCC)OC 50 19092 http://www.s PHYSPROP
    17921 1-bromoeicosBrCCCCCCCCC 37.5 19097 http://www.s PHYSPROP
    17922 kelevan O=C(OCC)CCC(= 91 19053 http://www.s PHYSPROP
    17923 hexanoic acid BrCCCCCC(=O 35 19037 http://www.s PHYSPROP
    17924 palmitic acid, O=C(CCCCCCC 51 19028 http://www.s PHYSPROP
    17925 benzenemethan
    OC(C#C)c1ccc 22 18989 http://www.s PHYSPROP
    17926 tetracontane CCCCCCCCCCC 82 18983 http://www.s PHYSPROP
    17927 valnoctamide CCC(C(C)CC)C 113.75 18974 http://www.s PHYSPROP
    17928 dimethylnitra CN(C)[N+]([O- 58 18955 http://www.s PHYSPROP
    17929 dipropetryne CCSc1nc(nc(N 105 18941 http://www.s PHYSPROP
    17930 ethoxylated t Brc1cc(cc(Br) 107 18949 http://www.s PHYSPROP
    17931 phenol, 2,6-biCC(C)(C)c1cc( 44 18924 http://www.s PHYSPROP
    17932 2-octanol CC(O)CCCCCC 38.6 18920 http://www.s PHYSPROP x clearly out of range JCB
    17933 dl-2-octanol CC(O)CCCCCC -31.6 18920 http://www.s PHYSPROP
    17934 hydrazinecarbo
    NNC(=O)OCC 46 18903 http://www.s PHYSPROP
    17935 ethylpropylsulCCSCCC -117 18902 http://www.s PHYSPROP
    17936 pyrotataric a O=C1CC(C)C( 34 18891 http://www.s PHYSPROP
    17937 1,2-dibromodBrC(CCCCCCCC 28 18892 http://www.s PHYSPROP
    17938 4-(tert-butyl) O=[N+]([O-])c 95 18882 http://www.s PHYSPROP
    17939 n-phenylpiperc1cc(ccc1)N2 4.7 18878 http://www.s PHYSPROP
    17940 5-benzoyl-4-hOS(=O)(=O)c1c 145 18829 http://www.s PHYSPROP
    17941 1,3-cyclohept C1C=CC=CCC1 -110.4 18810 http://www.s PHYSPROP
    17942 hexanol, 6-amNCCCCCCO 57 18801 http://www.s PHYSPROP
    17943 2-methyl-1,5-C=C(C)CCC=C -128.8 18806 http://www.s PHYSPROP
    17944 benzene, 1,4- S=C=Nc1ccc(c 132 18799 http://www.s PHYSPROP
    17945 3-chlorocatec Oc1cccc(Cl)c1 48.5 18771 http://www.s PHYSPROP
    17946 3-ethyl-1-pen C=CC(CC)CC -127.5 18792 http://www.s PHYSPROP
    17947 nitroxoline [O-][N+](=O)c 180 18756 http://www.s PHYSPROP
    17948 2-amino-1,3,4Nc1nncs1 191 18755 http://www.s PHYSPROP
    17949 thiophosphoryClP(Cl)(Cl)=S -35 18729 http://www.s PHYSPROP
    17950 2-chloro-3-nitO=[N+]([O-])c 183.5 18716 http://www.s PHYSPROP
    17951 4-(tert-butyl) CC(C)(C)c1ccn -41 18724 http://www.s PHYSPROP
    17952 2,2-dimethyl- CC(C)(C)C(O)C -5 18717 http://www.s PHYSPROP
    17953 3-chloro-4-hy Oc1ccc(cc1Cl) 171 18708 http://www.s PHYSPROP
    17954 4-bromo-2-chClc1cc(Br)ccc 50.5 18707 http://www.s PHYSPROP
    17955 2-ethylbutyl aCCC(CC)COC(= -70 18704 http://www.s PHYSPROP
    17956 benzoic acid, Oc1ccc(cc1OC 64 18693 http://www.s PHYSPROP
    17957 propanoic acidCC(C)(C)C(=O -89.5 18688 http://www.s PHYSPROP
    17958 1,9-nonanedioOCCCCCCCCC 45.8 18685 http://www.s PHYSPROP
    17959 1h-indene, 2,3CC2(CC(C)(C)c 52.5 18644 http://www.s PHYSPROP
    17960 naphthalene, CC1Cc2ccccc2 -43.1 18608 http://www.s PHYSPROP
    17961 n-propylmethyCCCSC -113 18607 http://www.s PHYSPROP
    17962 isopropylcycl CC(C)C1CCCC1 -111.4 18604 http://www.s PHYSPROP
    17963 ioxynil octanoO=C(Oc1c(I)c 59.5 18586 http://www.s PHYSPROP
    17964 c.i. disperse b CNc3ccc(O)c2 217 18585 http://www.s PHYSPROP
    17965 benazolin O=C(O)CN2c1c 193 18521 http://www.s PHYSPROP
    17966 tenonitrozole O=C(Nc1ncc(s1 255.5 18505 http://www.s PHYSPROP
    17967 distearyl pentCCCCCCCCCCC 41.5 18504 http://www.s PHYSPROP
    17968 sulfamethomiCc2nc(NS(=O)( 146 18460 http://www.s PHYSPROP
    17969 disperse red 5Clc2cc(ccc2/N 192 18454 http://www.s PHYSPROP
    17970 4-methyl-1-h CC(CC)CC=C -141.5 18453 http://www.s PHYSPROP
    17971 n-methyl o-seO=C(Oc1ccccc 31.5 18452 http://www.s PHYSPROP
    17972 primocarcin O=C(CCC(N)=O 130.5 18434 http://www.s PHYSPROP
    17973 cyclopentane,CCCCCC1CCCC -83 18410 http://www.s PHYSPROP
    17974 2-pyridineme NCc1ccccn1 81 18383 http://www.s PHYSPROP
    17975 m-phenoxybenO=C(O)c2cc(O 149.5 18409 http://www.s PHYSPROP
    17976 cyclohexane, 1CC1CCC(CC)C -80.8 18378 http://www.s PHYSPROP
    17977 cyclopentane,CC1CCC(CC)C1 -108 18377 http://www.s PHYSPROP
    17978 cyclobutanecaO=C(O)C1CCC -2 18370 http://www.s PHYSPROP
    17979 5,6-dimethylcCc4c2c(ccc1cc 129.3 18311 http://www.s PHYSPROP
    17980 diethylhydroxCCN(O)CC 10 18340 http://www.s PHYSPROP
    17981 5-methylchry Cc2cc4ccccc4 118 18309 http://www.s PHYSPROP
    17982 oxomemazineCN(C)CC(C)CN 115 18281 http://www.s PHYSPROP
    17983 chlorophacin Clc1ccc(cc1)C 140 18286 http://www.s PHYSPROP
    17984 phenanthrene,CCc2cc3ccccc 62.5 18260 http://www.s PHYSPROP
    17985 n-ethyl-4-nit CCNc1ccc(cc1) 97 18227 http://www.s PHYSPROP
    17986 furaneol CC=1OC(C)C( 80.5 18218 http://www.s PHYSPROP
    17987 diundecyl pht O=C(OCCCCCC 35.5 18193 http://www.s PHYSPROP
    17988 reposal O=C1NC(=O)NC 213 18167 http://www.s PHYSPROP
    17989 2-cf3-4,5-dic FC(F)(F)c2nc1c 213.5 18149 http://www.s PHYSPROP
    17990 benzo[b]thiopOc1cccc2sccc 79.8 18134 http://www.s PHYSPROP
    17991 1,1,1,3,3,3-h ClC(Cl)(Cl)CC(C -27 18133 http://www.s PHYSPROP
    17992 phenoxyaceticO=C(O)COc1cc 98.5 18107 http://www.s PHYSPROP
    17993 acetyl sulfam COc2nccnc2N( 199 18094 http://www.s PHYSPROP
    17994 cyclazocine Oc3ccc4CC2C( 202.5 18063 http://www.s PHYSPROP
    17995 bumadizon O=C(O)C(CCCC 116 18080 http://www.s PHYSPROP
    17996 anot Cc1c(cc(cc1N) 199 18061 http://www.s PHYSPROP
    17997 3-phenyl-car NC(=O)OC(C#C 86.5 18038 http://www.s PHYSPROP
    17998 chlorhexadol ClC(Cl)(Cl)C( 103 18027 http://www.s PHYSPROP
    17999 n-me carbamaCc1cc(ccc1SC 117.5 18033 http://www.s PHYSPROP
    18000 dde CC(c1ccc(Cl)cc 56 18010 http://www.s PHYSPROP
    18001 ethanol, 2-(octOCCSCCCCCCC 0 18012 http://www.s PHYSPROP
    18002 phenesterine ClCCN(CCCl)c 90 18007 http://www.s PHYSPROP
    18003 n'-ipr-(4-clph Clc1ccc(OCC( 93.5 17998 http://www.s PHYSPROP
    18004 4h-1-benzothiO=C2CCSc1ccc 29 17983 http://www.s PHYSPROP
    18005 2,2,5-trimeth CC(C)CCC(C)(C -105.7 17976 http://www.s PHYSPROP
    18006 1-bromoheptaBrCCCCCCCCC 32 17958 http://www.s PHYSPROP
    18007 dithioerythritoSCC(O)C(O)CS 83 17939 http://www.s PHYSPROP
    18008 quinoxaline, 5Clc1c(Cl)c(Cl) 190 17951 http://www.s PHYSPROP
    18009 1,4-dithiothreiSCC(O)C(O)CS 42.5 17939 http://www.s PHYSPROP
    18010 2,3,5,6-tetrac Nc1c(Cl)c(Cl)c 107 17936 http://www.s PHYSPROP
    18011 1-propanol, 3,CS(=O)(=O)OC 115.5 17892 http://www.s PHYSPROP
    18012 p-ethylstyren CCc1ccc(C=C) -49.7 17883 http://www.s PHYSPROP
    18013 1-nonyne CCCCCCCC#C -50 17880 http://www.s PHYSPROP
    18014 1-eicosene C=CCCCCCCCC 28.5 17879 http://www.s PHYSPROP
    18015 2-iodothioph Ic1cccs1 -40 17866 http://www.s PHYSPROP
    18016 pyrimidine, 4-c1cc(ccc1)c2c 56 17868 http://www.s PHYSPROP
    18017 cyclotrisiloxa C[Si]1(O[Si](C 100 17848 http://www.s PHYSPROP
    18018 isomaltol CC(=O)c1occc 100 17845 http://www.s PHYSPROP
    18019 3,3-dimethyl- C=CC(C)(C)CC -134.3 17801 http://www.s PHYSPROP
    18020 2,3-dimethyl- C=C(C)C(C)CC -134.3 17800 http://www.s PHYSPROP
    18021 methoxypromCN(C)CCCN1c3 46 17796 http://www.s PHYSPROP
    18022 cyclopentanecO=C(O)C1CCC -7 17789 http://www.s PHYSPROP
    18023 1-methylchyr Cc4cccc2c4cc 256.5 17732 http://www.s PHYSPROP
    18024 1-chlorooctadCCCCCCCCCCC 28.6 17766 http://www.s PHYSPROP
    18025 dithianone N#CC=1SC3=C( 225 17724 http://www.s PHYSPROP
    18026 dodecane, 1,1BrCCCCCCCCC 41 17720 http://www.s PHYSPROP
    18027 asulam Nc1ccc(cc1)S 144 17707 http://www.s PHYSPROP
    18028 benzoic acid, Clc1cc(cc(Cl) 265 17704 http://www.s PHYSPROP
    18029 succinonitrile CC(C)(C#N)C(C 170.5 17700 http://www.s PHYSPROP
    18030 1,3-propanedio
    OCC(CBr)(CBr 113 17652 http://www.s PHYSPROP
    18031 barbituric acidO=C1NC(=O)N( 115 17691 http://www.s PHYSPROP
    18032 benzeneethanol
    OC(C)(C)C(C)c 46 17623 http://www.s PHYSPROP
    18033 2,2,3-trichlor ClCC(Cl)(Cl)C 65.5 17620 http://www.s PHYSPROP
    18034 oxirane, 2,3-diCC1OC1C -80 17595 http://www.s PHYSPROP
    18035 1,2,3,4,6,7,8, Clc2c1Oc3c(Oc1 330 17598 http://www.s PHYSPROP
    18036 oxirane, 2,3-dCC1OC1C -85 17595 http://www.s PHYSPROP
    18037 4-imidazolidinO=C2NCNC2(c1 183 17588 http://www.s PHYSPROP
    18038 2-isopropyl-6 CC(C)c1cccc(C -14.5 17565 http://www.s PHYSPROP
    18039 c.i. 11115 Clc2cc(ccc2/N 133 17488 http://www.s PHYSPROP
    18040 2-methylocta CC(C)CCCCCC -80.3 17558 http://www.s PHYSPROP
    18041 2-butylphenolOc1ccccc1CCC -20 17487 http://www.s PHYSPROP
    18042 c.i. disperse r [O-][N+](=O) 160 17485 http://www.s PHYSPROP
    18043 tert-butylcyc CC(C)(C)C1CC -41.2 17481 http://www.s PHYSPROP
    18044 methetoin [usO=C4c2c(c(N) 210 17479 http://www.s PHYSPROP
    18045 isocyanatocycO=C=NC1CCC -80 17475 http://www.s PHYSPROP
    18046 1,5-naphthyleO=C=Nc2cccc 130.5 17476 http://www.s PHYSPROP
    18047 2,5-dichlorot Clc1ccc(Cl)s1 -40.5 17474 http://www.s PHYSPROP
    18048 3-pyridinecarbOC(=O)c1cnc( 312 17469 http://www.s PHYSPROP
    18049 phenbutamid O=S(=O)(NC(= 131 17442 http://www.s PHYSPROP
    18050 benzoic acid, Oc1c(cc(Br)cc 228 17440 http://www.s PHYSPROP
    18051 exo-2,3-epox C1CC2CC1C3O 123 17439 http://www.s PHYSPROP
    18052 3,4-dibromot Brc1cscc1Br 4.5 17428 http://www.s PHYSPROP
    18053 2,5-dibromot Brc1ccc(Br)s1 -6 17429 http://www.s PHYSPROP
    18054 benzamide, n-Clc1ccc(cc1Cl 119 17408 http://www.s PHYSPROP
    18055 alpha-epibro BrCC1CO1 -40 17406 http://www.s PHYSPROP
    18056 hexanoic acid,CC(=O)CCCC( 13.5 17383 http://www.s PHYSPROP
    18057 iobenzamic acIc1cc(I)c(N)c 134 17355 http://www.s PHYSPROP
    18058 thiazesim hydC=CC(=O)OCC -44.6 17368 http://www.s PHYSPROP x salt - AL
    18059 sulfone, phenyO=S(=O)(C)c1c 86 17347 http://www.s PHYSPROP
    18060 2-chloro-9h-f Clc2ccc3c1ccc 125.5 17333 http://www.s PHYSPROP
    18061 1-piperidineprN#CCCN1CCC -6.8 17318 http://www.s PHYSPROP
    18062 1,1,3-trimeth CC1CCCC(C)(C -65.7 17292 http://www.s PHYSPROP
    18063 metobromuroBrc1ccc(NC(= 95 17276 http://www.s PHYSPROP
    18064 1,3,5-benzenetO=[N+]([O-])c 350 17272 http://www.s PHYSPROP
    18065 vinylnorborneC=CC2CC1C=C -80 17262 http://www.s PHYSPROP
    18066 1-piperidine eOCCN1CCCCC 17.9 17221 http://www.s PHYSPROP
    18067 bis(2-(dimeth CN(C)CCOCCN -80 17194 http://www.s PHYSPROP
    18068 dis. a. 5 CCN(CC)c1ccc( 152 17178 http://www.s PHYSPROP
    18069 benzylthiocyaN#CSCc1ccccc 43 17163 http://www.s PHYSPROP
    18070 dis. a. 15 CN(C)c2ccc(/N 164 17159 http://www.s PHYSPROP
    18071 4-formyl-2-ni O=[N+]([O-])c 141 17162 http://www.s PHYSPROP
    18072 estramustine ClCCN(CCCl)C 104.5 17134 http://www.s PHYSPROP
    18073 2,3-dichlorop Clc1c(OCC(=O) 174 17101 http://www.s PHYSPROP
    18074 ioxynil-sodiu Ic1cc(cc(I)c1 360 17073 http://www.s PHYSPROP x metal
    18075 2,5-hexanedioCC(O)CCC(C)O 43 17052 http://www.s PHYSPROP
    18076 2-heptadecanCC(=O)CCCCC 48 17031 http://www.s PHYSPROP
    18077 toliprolol CC(C)NCC(O)C 76 17050 http://www.s PHYSPROP
    18078 1-hexadecanetCCCCCCCCCCC 19 17019 http://www.s PHYSPROP
    18079 3-chlorophenyClc1cc(/N=C= -4 16972 http://www.s PHYSPROP
    18080 methyl 2,5-di Clc1ccc(Cl)cc 38.5 16951 http://www.s PHYSPROP
    18081 1,3-benzenedio
    CCc1ccc(O)cc 98.5 16931 http://www.s PHYSPROP
    18082 n-nonylcyclohCCCCCCCCCC1 -10 16908 http://www.s PHYSPROP
    18083 1-octadecanetCCCCCCCCCCC 30 16913 http://www.s PHYSPROP
    18084 naphthalene, 2CC(C)(C)c1ccc -4 16897 http://www.s PHYSPROP
    18085 diacetone acr C=CC(=O)NC(C 57.5 16896 http://www.s PHYSPROP
    18086 disperse red 1[O-][N+](=O)c 161 16894 http://www.s PHYSPROP
    18087 disperse red 1O=C2c1ccccc1 242 16893 http://www.s PHYSPROP
    18088 1,3-dimethyl- Cc1cccc(C)c1C -16.2 16887 http://www.s PHYSPROP
    18089 2-(dimethylamCN(C)CCOC(=O -30 16879 http://www.s PHYSPROP
    18090 isophorone diNCC1(C)CC(C) 10 16867 http://www.s PHYSPROP
    18091 disperse brigho1c5ccccc5nc1 219 16877 http://www.s PHYSPROP
    18092 decane, 4-metCCCCCCC(C)C -77.5 16853 http://www.s PHYSPROP
    18093 1-chloro-1,2,2FC(F)(F)C(Cl)F -199 16841 http://www.s PHYSPROP
    18094 phenol, 3-amiCc1ccc(O)cc1 157.8 16839 http://www.s PHYSPROP
    18095 undecanoic acO=C(O)CCCCC 57 16831 http://www.s PHYSPROP
    18096 formocortal CC(=O)OCC(= 181 16814 http://www.s PHYSPROP
    18097 cyclopentane,CC1CC(C)C(C) -130.8 16800 http://www.s PHYSPROP
    18098 pentamethyl Cc1c(C)c(C)c( 128 16804 http://www.s PHYSPROP
    18099 1,2,4-trimeth CC1CC(C)C(C) -132.3 16800 http://www.s PHYSPROP
    18100 g 27550 Cc1cc(O)nc(n1 172.95 16799 http://www.s PHYSPROP
    18101 cyclopentane,CC1CC(C)C(C) -132.6 16800 http://www.s PHYSPROP
    18102 dinoseb acetaO=C(C)Oc1c(cc 26 16798 http://www.s PHYSPROP
    18103 2-octyne CCCCCC#CC -61.6 16791 http://www.s PHYSPROP
    18104 1,2-dimethyl Brc1c(C)c(C)c( 262 16793 http://www.s PHYSPROP
    18105 naphthalene, Cc2cccc1CCCC -23 16790 http://www.s PHYSPROP
    18106 tetramethylthCN(C)C(=S)N(C 79.3 16753 http://www.s PHYSPROP
    18107 2-amino-3-chlO=C2c1ccccc1 199 16770 http://www.s PHYSPROP
    18108 1,3-bis(1-iso CC(C)(N=C=O) -10 16747 http://www.s PHYSPROP
    18109 4,5-dichloroveClc1cc(OC)c(c 83 16741 http://www.s PHYSPROP
    18110 pentadecanal CCCCCCCCCCC 24.5 16729 http://www.s PHYSPROP
    18111 thioacetaldehCC1SC(C)SC(C 101 16728 http://www.s PHYSPROP
    18112 2,4,6-trimethyCC1SC(C)SC(C 101 16728 http://www.s PHYSPROP
    18113 2-methyl-2-h C/C(C)=CCCC -130.4 16689 http://www.s PHYSPROP
    18114 2,4-dimethoxyNc1ccc(cc1OC 33.5 16685 http://www.s PHYSPROP
    18115 s-amylbenzenCC(CCC)c1ccc -70 16661 http://www.s PHYSPROP
    18116 sulfuryl fluori FS(F)(=O)=O -135.82 16647 http://www.s PHYSPROP
    18117 malononitrile,N#CC(C#N)=C/ 84 16648 http://www.s PHYSPROP
    18118 o-chlorobenzyClc1ccccc1/C 95.5 16644 http://www.s PHYSPROP
    18119 nitrosyl chlori ClN=O -61.5 16641 http://www.s PHYSPROP
    18120 3-fluoranthe Nc4ccc2c1ccc 116 16639 http://www.s PHYSPROP
    18121 2,3-diaminotoCc1cccc(N)c1 63.5 16633 http://www.s PHYSPROP
    18122 landrin O=C(Oc1cc(C)c 99.45 16632 http://www.s PHYSPROP
    18123 n-me-3,4,5-tr O=C(Oc1cc(C)c 109 16632 http://www.s PHYSPROP
    18124 1,4-dichloro- COc1cc(Cl)c(c 134 16623 http://www.s PHYSPROP
    18125 phenol, 4,4'-t Oc1ccc(cc1)Sc 155 16612 http://www.s PHYSPROP
    18126 n-me-3,5-dimO=C(Oc1cc(C) 99 16606 http://www.s PHYSPROP
    18127 3,5-bis(tert- O=C(Oc1cc(cc( 103 16607 http://www.s PHYSPROP
    18128 6-aminochrys Nc4cc2c(ccc1c 210.5 16579 http://www.s PHYSPROP
    18129 butanoic acid,O=C(CCC)OCC -78 16570 http://www.s PHYSPROP
    18130 azinphos ethyCCOP(=S)(OC 53 16576 http://www.s PHYSPROP
    18131 cyanophos S=P(Oc1ccc(c 14.5 16569 http://www.s PHYSPROP
    18132 isoprocarb O=C(Oc1ccccc 94 16564 http://www.s PHYSPROP
    18133 3-i-pr-5-mephO=C(Oc1cc(C)c 87 16563 http://www.s PHYSPROP
    18134 quinoline, 5,8 Cc1ccc(C)c2cc 4.5 16549 http://www.s PHYSPROP
    18135 borinic acid, OB(c1ccccc1)c 57.5 16547 http://www.s PHYSPROP
    18136 hexaethylene OCCOCCOCCO 6 16521 http://www.s PHYSPROP
    18137 fenthoate O=C(OCC)C(SP 17.5 16492 http://www.s PHYSPROP
    18138 etridazole ClC(Cl)(Cl)c1 19.9 16489 http://www.s PHYSPROP
    18139 1-piperidinec O=CN1CCCCC -30.8 16486 http://www.s PHYSPROP
    18140 3-methyl-4-niO=[N+]([O-])c 128 16475 http://www.s PHYSPROP
    18141 butane, 1,1'- CCCCOCOCCC -58.1 16443 http://www.s PHYSPROP
    18142 pentadecylamCCCCCCCCCCC 37.3 16450 http://www.s PHYSPROP
    18143 acetamide, 2,2O=C(Nc1ccccc1 96 16437 http://www.s PHYSPROP
    18144 sulfur hexaflu FS(F)(F)(F)(F)F -50.8 16425 http://www.s PHYSPROP
    18145 chlorbicyclen ClC2(Cl)C1(Cl) 105 16424 http://www.s PHYSPROP
    18146 2-butanone, 4CC(=O)CCc1cc -13 16422 http://www.s PHYSPROP
    18147 benz(a)anthraCc2c4ccccc4c 141 16414 http://www.s PHYSPROP
    18148 formothion COP(=S)(OC)S 25.5 16412 http://www.s PHYSPROP
    18149 barbituric aci O=C1NC(=O)NC 157.5 16406 http://www.s PHYSPROP
    18150 chlorflurecol O=C(OC)C3(O)c 139 16404 http://www.s PHYSPROP
    18151 karsil Clc1ccc(NC(= 106.5 16401 http://www.s PHYSPROP
    18152 1,3-dimethylcyC[C@H]1CC[C -133.7 16396 http://www.s PHYSPROP
    18153 2-methylphenCc1cc2ccc3cc 58 16391 http://www.s PHYSPROP
    18154 heptanoyl chl CCCCCCC(Cl)= -83.8 16383 http://www.s PHYSPROP
    18155 picolinic acid, O=C(OCC)c1cc 1 16377 http://www.s PHYSPROP
    18156 9-methyl-9h-fCC3c1ccccc1c 46.5 16369 http://www.s PHYSPROP
    18157 2-nitro-5-chloO=[N+]([O-])c 139 16358 http://www.s PHYSPROP
    18158 2-chloro-5-nitOC(=O)c1cc(cc 166.5 16359 http://www.s PHYSPROP
    18159 ethylene glycoO=C(OCCOC(=O) 40 16356 http://www.s PHYSPROP
    18160 2-propenoic acO=C(C=C)OCC -45 16338 http://www.s PHYSPROP
    18161 3-methylbenzCc1cc2ccc3cc 156.5 16333 http://www.s PHYSPROP
    18162 4-nitro-((4-( CN(C)c2ccc(/N 236 16304 http://www.s PHYSPROP
    18163 benz a anthraO=C3c2c(ccc1 170 16332 http://www.s PHYSPROP
    18164 trimethoxy silCO[SiH](OC)O -115 16295 http://www.s PHYSPROP
    18165 (4-nitropheny[O-][N+](=O)c 133 16301 http://www.s PHYSPROP
    18166 c.i. solvent ye CCN(CC)c1ccc 97.5 16286 http://www.s PHYSPROP
    18167 1,4,5,8-tetra Nc3ccc(N)c2C( 285 16272 http://www.s PHYSPROP
    18168 c.i. disperse b O=C2c1ccccc1 187 16273 http://www.s PHYSPROP
    18169 1,4-bis(methyO=C2c1ccccc1 220 16271 http://www.s PHYSPROP
    18170 1-chloronona CCCCCCCCCCl -39.4 16268 http://www.s PHYSPROP
    18171 1h-imidazole, CC(=O)n1ccnc 102 16257 http://www.s PHYSPROP
    18172 9h-fluorene-9-O=C(O)C3(O)c1 152 16253 http://www.s PHYSPROP
    18173 dicapthon Clc1cc(ccc1OP 52.5 16252 http://www.s PHYSPROP
    18174 3,5-dichloropyClc1cncc(Cl)c1 66 16237 http://www.s PHYSPROP
    18175 1,2-dimethylcCC1CCCC1C -117.6 221116 http://www.s PHYSPROP
    18176 1,2-dimethylcyCC1CCCC1C -54 13842 http://www.s PHYSPROP
    18177 c.i. solvent ye OCCN(CCO)c1c 134 16231 http://www.s PHYSPROP
    18178 benzenesulfonO=S(=O)(Nc1n 192 16218 http://www.s PHYSPROP
    18179 2h-1-benzopyrCc1ccc2C=CC( 128 16215 http://www.s PHYSPROP
    18180 2h-1-benzopyrCC1=Cc2cccc 91 16214 http://www.s PHYSPROP
    18181 4,4'-dichlorodClc2ccc(Oc1cc 30 16210 http://www.s PHYSPROP
    18182 2-(2-hydroxy- Cc1cc(c(O)cc1 132 16197 http://www.s PHYSPROP
    18183 oxythioquinoxCc1ccc2nc3SC 170 16193 http://www.s PHYSPROP
    18184 2,3,5,6-tetrac Clc1c([N+]([O- 103 16191 http://www.s PHYSPROP
    18185 o-isopropylbenCC(C)c1ccccc 64 16184 http://www.s PHYSPROP
    18186 n-phenyl-n-prCC(=O)N(CCC) 49 16183 http://www.s PHYSPROP
    18187 1-tridecene C=CCCCCCCCC -13 16180 http://www.s PHYSPROP
    18188 lauronitrile CCCCCCCCCCC 4 16177 http://www.s PHYSPROP
    18189 11-aminoundeO=C(O)CCCCC 191 16168 http://www.s PHYSPROP
    18190 3,4-dimethylqCc1c2ccccc2n 73.5 16176 http://www.s PHYSPROP
    18191 6-aminohexane
    N#CCCCCCN -31.4 16164 http://www.s PHYSPROP
    18192 4-methyl-2,6-Clc1cc(C)cc(Cl 39 16162 http://www.s PHYSPROP
    18193 2,2,2-trichlor CCN(CC)C(=O)C 27 16157 http://www.s PHYSPROP
    18194 7-methyl-1-ocCC(C)CCCCCC 64.5 16158 http://www.s PHYSPROP
    18195 2-(diethylaminO=C(C=C)OCC -60 16150 http://www.s PHYSPROP
    18196 n-tert-butylf CC(C)(C)NC=O 16 16146 http://www.s PHYSPROP
    18197 1-chlorotetra CCCCCCCCCCC 4.9 16144 http://www.s PHYSPROP
    18198 captafol ClC(Cl)C(Cl) 160.5 16139 http://www.s PHYSPROP
    18199 3,4-dimephenO=C(Oc1cc(C) 79.5 16141 http://www.s PHYSPROP
    18200 12-methylbenCc2c4ccccc4c 138 16129 http://www.s PHYSPROP
    18201 tri-sec-butan CCC(O)CN(CC( 41 16127 http://www.s PHYSPROP
    18202 3-chloro-4-hy Oc1ccc(C=O)c 139 16125 http://www.s PHYSPROP
    18203 2-(tert-butyl CC(C)(C)c1cc( 51.5 16109 http://www.s PHYSPROP
    18204 2,3,6-trimeth Cc1ccc(C)c(O) 58 16119 http://www.s PHYSPROP
    18205 cyclohexanone,
    CC1CCCC(C)(C -31.8 16105 http://www.s PHYSPROP
    18206 2,3,5,6-tetrac Clc1cc(Cl)c(Cl 90.5 16096 http://www.s PHYSPROP
    18207 2,6-dichloropyClc1cccc(Cl)n1 88 16095 http://www.s PHYSPROP
    18208 2,3-dichloropyClc1cccnc1Cl 66 16094 http://www.s PHYSPROP
    18209 5-phenyleicosCCCCC(CCCCC 30.2 16089 http://www.s PHYSPROP
    18210 4-phenyleicosCCCC(CCCCCC 31.4 16088 http://www.s PHYSPROP
    18211 3-phenyleicosCCC(CCCCCCC 29.3 16087 http://www.s PHYSPROP
    18212 1-phenyleicosCCCCCCCCCCC 44 16081 http://www.s PHYSPROP
    18213 2-phenyleicosCC(CCCCCCCC 29 16080 http://www.s PHYSPROP
    18214 9-phenyleicosCCCCCCCCC(C 17.9 16079 http://www.s PHYSPROP
    18215 1,8-nonadiyneC#CCCCCCC#C -27.3 16075 http://www.s PHYSPROP
    18216 1,6-heptadienC=CCCCC=C -85 16074 http://www.s PHYSPROP
    18217 1,6-heptadienC=CCCCC=C -129 16074 http://www.s PHYSPROP
    18218 ut-632 O=C(OCC1CC2 -37 16058 http://www.s PHYSPROP
    18219 benzene, 1-(1CC(C)c1ccc(cc -30.6 16061 http://www.s PHYSPROP
    18220 benzo[a]pyrenCc4c5ccccc5c 216 16046 http://www.s PHYSPROP
    18221 8-methylbenzCc4cccc3cc1c( 156.5 16044 http://www.s PHYSPROP
    18222 9-methylbenzCc3ccc4cc1c(c 152 16041 http://www.s PHYSPROP
    18223 10-methyl-benCc2ccc3cc4cc 183.3 16040 http://www.s PHYSPROP
    18224 3-methoxy-4- Oc1ccc(cc1OC 41 16039 http://www.s PHYSPROP
    18225 quinoxaline, 2Cc1nc2ccccc2 105 16036 http://www.s PHYSPROP
    18226 1-fluorobutanCCCCF -134 16020 http://www.s PHYSPROP
    18227 2-methyl-4-b Cc1cc(Br)ccc1 64.7 16011 http://www.s PHYSPROP
    18228 4-butoxybenzoi
    CCN(CC)CCOC( 146 15997 http://www.s PHYSPROP
    18229 4-acetoxybenzO=C(C)Oc1ccc 192.5 15983 http://www.s PHYSPROP
    18230 thiazole, 4,5- CC1=NCCS1 -101 15985 http://www.s PHYSPROP
    18231 benzoic acid, 3Ic1cc(cc(I)c1I 292.5 15975 http://www.s PHYSPROP
    18232 propyl benzoaO=C(OCCC)c1c -51.6 15965 http://www.s PHYSPROP
    18233 2,5-pyrrolidin O=C1CCC(=O) 26 15961 http://www.s PHYSPROP
    18234 pentanochlor Cc1ccc(NC(=O) 85 15945 http://www.s PHYSPROP
    18235 1,4-benzodioxCOCCCNCC1CO 183.5 15947 http://www.s PHYSPROP
    18236 3-(4-hydroxy- Oc1ccc(cc1OC 65 15941 http://www.s PHYSPROP
    18237 oxyclozanide Clc2c(C(=O)Nc1 210 15904 http://www.s PHYSPROP
    18238 prothoate CCOP(=S)(OCC 28.5 15901 http://www.s PHYSPROP
    18239 5-phenylpentaO=C(O)CCCCc1 57.5 15886 http://www.s PHYSPROP
    18240 1,5-diaminon Nc2cccc1c2cc 190 15851 http://www.s PHYSPROP
    18241 1-naphthylamiCc2ccc1ccccc 32 15862 http://www.s PHYSPROP
    18242 1,4-naphthal Nc1ccc(N)c2c 120 15850 http://www.s PHYSPROP
    18243 nonanonitrile CCCCCCCCC#N -34.2 15846 http://www.s PHYSPROP
    18244 (nitrilotris(m OP(=O)(O)CN( 90.3 15833 http://www.s PHYSPROP x clearly out of range JCB
    18245 styrene, 2,4-dCc1cc(C)ccc1 -64 15829 http://www.s PHYSPROP
    18246 octachloronapClc2c1c(Cl)c(Cl 197.5 15827 http://www.s PHYSPROP
    18247 1-propene, 3,3C=CC(Cl)(Cl)Cl -30 15825 http://www.s PHYSPROP
    18248 dienochlor ClC1(C(Cl)=C(C 122 15823 http://www.s PHYSPROP
    18249 5h-dibenzo(a,O=C2c3ccccc3 88.5 15816 http://www.s PHYSPROP
    18250 phenol, 2-(1,1CC(C)(C)c1ccc 31 15815 http://www.s PHYSPROP
    18251 1-naphthalenaNc2cccc1CCCC 38 15808 http://www.s PHYSPROP
    18252 propanoic acidCCCCCCCOC(= -50.9 15807 http://www.s PHYSPROP
    18253 1-naphthalenaCNc2cccc1ccc 174 15804 http://www.s PHYSPROP
    18254 4-methylocta CC(CCC)CCCC -113.3 15802 http://www.s PHYSPROP
    18255 3-methylocta CC(CC)CCCCC -107.6 15801 http://www.s PHYSPROP
    18256 quinoxaline, 2Clc1nc2ccccc2 153 15796 http://www.s PHYSPROP
    18257 mofebutazon O=C2NN(c1ccc 102.5 15776 http://www.s PHYSPROP
    18258 2,4-dimethyl- C=C(C)CC(C)C -124.1 15794 http://www.s PHYSPROP
    18259 n-isopropylac CC(C)NC(=O)C 64 15774 http://www.s PHYSPROP
    18260 aminorex NC1=NCC(O1)c 136.5 15767 http://www.s PHYSPROP
    18261 1,3-dimethylcC[C@@H]1CC -90.1 15766 http://www.s PHYSPROP
    18262 naphthalene, 1Clc2cc(Cl)cc1 62.3 15755 http://www.s PHYSPROP
    18263 2,3-dimethyl- O=C2c1ccccc1 127 15752 http://www.s PHYSPROP
    18264 2,6-dimethylaO=C(C)Nc1c(C 183 15753 http://www.s PHYSPROP
    18265 octylbenzene CCCCCCCCc1cc -36 15747 http://www.s PHYSPROP
    18266 2-methyl-1h-iCC1=Cc2ccccc 80 15727 http://www.s PHYSPROP
    18267 2,3,4,5,6-pentClc1c(Cl)c(Cl)n 125.5 15724 http://www.s PHYSPROP
    18268 naphthalene, CC(C)COc1ccc 31 15722 http://www.s PHYSPROP
    18269 octabromodibBrc2c1Oc3c(Oc 376 15719 http://www.s PHYSPROP
    18270 1,2,4,6,7,9-h Brc2c1Oc3c(Oc1 385 15718 http://www.s PHYSPROP
    18271 fluometuron O=C(Nc1cc(ccc 164 15702 http://www.s PHYSPROP
    18272 butane, 1,1'-suCCCCS(=O)CC 32.6 15708 http://www.s PHYSPROP
    18273 dicryl Clc1ccc(NC(=O 128 15700 http://www.s PHYSPROP
    18274 lenacil O=C1C=3CCCC 316 15699 http://www.s PHYSPROP
    18275 norea CN(C)C(=O)N 177 15696 http://www.s PHYSPROP
    18276 cycluron CN(C)C(=O)N 138 15694 http://www.s PHYSPROP
    18277 3-cyclohexeneOCC1(CO)CC= 88.5 15684 http://www.s PHYSPROP
    18278 fluorenone oxON=C3/c1cccc 195.5 15683 http://www.s PHYSPROP
    18279 metofoline Clc1ccc(cc1) 110.5 15678 http://www.s PHYSPROP
    18280 m-bromoacetO=C(C)c1cc(Br 7.5 15644 http://www.s PHYSPROP
    18281 methyl 2,4-di Oc1cc(O)ccc1 119.5 15663 http://www.s PHYSPROP
    18282 1,2-benzenedio
    Oc1c(cccc1O) 47 15640 http://www.s PHYSPROP
    18283 4-isopropylca Oc1ccc(cc1O) 78 15639 http://www.s PHYSPROP
    18284 4-chlorcatechOc1cc(Cl)ccc1 90.5 15638 http://www.s PHYSPROP
    18285 2-chlorobenzoClC(Cl)(Cl)c1c 29.4 15636 http://www.s PHYSPROP
    18286 4,4'-dimethoxCOc1ccc(cc1)c 175 15626 http://www.s PHYSPROP
    18287 1,3,7-trimeth Cc1ccc2cc(C)c 12 15619 http://www.s PHYSPROP
    18288 benzene, 1-chClc1ccc(N=C=S 46 15622 http://www.s PHYSPROP
    18289 1-phenylpent CCCCCCCCCCC 22 15618 http://www.s PHYSPROP
    18290 clorexolone NS(=O)(=O)c1 267 15615 http://www.s PHYSPROP
    18291 4-benzylpyrid c1ccccc1Cc2c 12.4 15603 http://www.s PHYSPROP
    18292 ethanol, 2-ch NC(=O)OCCCl 75.5 15601 http://www.s PHYSPROP
    18293 2-phenylacetaO=C(C)Nc2ccc 121 15593 http://www.s PHYSPROP
    18294 3-nitrobiphenO=[N+]([O-])c 62 15596 http://www.s PHYSPROP
    18295 cyclohexane, 1ClC1(Cl)CCCC -47 15573 http://www.s PHYSPROP
    18296 bromophos Clc1cc(OP(=S) 53.5 15572 http://www.s PHYSPROP
    18297 epn S=P(OCC)(Oc1c 36 15571 http://www.s PHYSPROP
    18298 1,4-butanediyO=C(OCCCCOC( 226.28 15540 http://www.s PHYSPROP
    18299 4-bromopyrazBrc1cnnc1 94.5 15530 http://www.s PHYSPROP
    18300 benzene, 1-chCC(C)c1ccccc1 -74.4 15532 http://www.s PHYSPROP
    18301 5-bromopentan
    BrCCCCC(=O) 39 15526 http://www.s PHYSPROP
    18302 methyl phenoO=C(COc1cccc 245 15523 http://www.s PHYSPROP
    18303 2,6-dichloron Clc1ccc2cc(Cl 140.5 15524 http://www.s PHYSPROP
    18304 benperidol Fc1ccc(cc1)C 170.9 15521 http://www.s PHYSPROP
    18305 n-methylindolO=C2c1ccccc1 131.5 15517 http://www.s PHYSPROP
    18306 pimozide Fc1ccc(cc1)C 216 15520 http://www.s PHYSPROP
    18307 clothiapine CN1CCN(CC1)C 119 15510 http://www.s PHYSPROP
    18308 benzoic acid, Oc1ccccc1C(= -5.9 15495 http://www.s PHYSPROP
    18309 o-bromobipheBrc2ccccc2c1c 1.5 15494 http://www.s PHYSPROP
    18310 butanoic acid,CCCC(=O)OCC -80 15490 http://www.s PHYSPROP
    18311 4-chlorobipheClc1ccc(cc1)c 78.8 15489 http://www.s PHYSPROP
    18312 3-chlorobipheClc1cc(ccc1)c 16 15488 http://www.s PHYSPROP
    18313 4-decanol CCCCCCC(O)C -11 15486 http://www.s PHYSPROP
    18314 2h-1-benzopyra
    Clc1ccc2OC(= 165 15487 http://www.s PHYSPROP
    18315 dipentylamineCCCCCNCCCC -7.85 15482 http://www.s PHYSPROP
    18316 decachlorobipClc1c(c(Cl)c(Cl 305.8 15484 http://www.s PHYSPROP
    18317 1-iododecaneCCCCCCCCCCI -16.3 15480 http://www.s PHYSPROP
    18318 2,4-dichloro- Clc1cc(Cl)c(O 107.5 15479 http://www.s PHYSPROP
    18319 naphthalene, 1Clc1cccc2ccc( 63.5 15476 http://www.s PHYSPROP
    18320 1,8-dichloron Clc1cccc2cccc 89 15477 http://www.s PHYSPROP
    18321 1,2-dichloron Clc1c2ccccc2c 36 15475 http://www.s PHYSPROP
    18322 4,4'-dichlorobClc1ccc(cc1)c2 149.3 15474 http://www.s PHYSPROP
    18323 dibutyl oxalat O=C(OCCCC)C -30.5 15472 http://www.s PHYSPROP
    18324 3,3'-dichlorobClc1cc(ccc1)c2 29 15473 http://www.s PHYSPROP
    18325 benzene, 1,1' Brc2ccc(Oc1cc 60.5 15471 http://www.s PHYSPROP
    18326 2,4-dimethylaO=C(C)Nc1ccc 129.3 15469 http://www.s PHYSPROP
    18327 1,3-diethyl-5 CCc1cc(C)cc(C -74.1 15468 http://www.s PHYSPROP
    18328 diethyl pimelaO=C(CCCCCC( -24 15466 http://www.s PHYSPROP
    18329 diethyl suberaO=C(CCCCCCC 5.9 15467 http://www.s PHYSPROP
    18330 pentylbenzen CC(C)CCc1ccc -75 15460 http://www.s PHYSPROP
    18331 2(1h)-pyridineS=C1C=CC=CN 89.5 15445 http://www.s PHYSPROP
    18332 buthiazide NS(=O)(=O)c2 221.5 15442 http://www.s PHYSPROP
    18333 propylcyclopeCCCC1CCCC1 -117.3 15438 http://www.s PHYSPROP
    18334 2-bromobenzon
    N#Cc1ccccc1B 55.5 15440 http://www.s PHYSPROP
    18335 cyclopentane,CCCCC1CCCC1 -108 15437 http://www.s PHYSPROP
    18336 acetophenone,COc1cccc(OC) 69 15435 http://www.s PHYSPROP
    18337 styrene, 2,5-dCc1ccc(C)cc1 -35 15433 http://www.s PHYSPROP
    18338 4-bromostyreC=Cc1ccc(Br)c 7.7 15431 http://www.s PHYSPROP
    18339 2-bromostyreC=Cc1ccccc1B -52.5 15432 http://www.s PHYSPROP
    18340 1,3-dioxane-4,O=C1CC(=O)OC 94 15418 http://www.s PHYSPROP
    18341 methiocarb Cc1cc(cc(C)c 120 15417 http://www.s PHYSPROP
    18342 aminocarb O=C(Oc1cc(C) 93.5 15416 http://www.s PHYSPROP
    18343 3-butyn-2-ol C#CC(C)O -3 15411 http://www.s PHYSPROP
    18344 2-isopropylnaCC(C)c1ccc2cc 14.5 15410 http://www.s PHYSPROP
    18345 amiloride Clc1nc(C(=O) 241 15403 http://www.s PHYSPROP
    18346 bamifylline CCN(CCO)CCn2 80 15401 http://www.s PHYSPROP
    18347 octyldimethylCN(C)CCCCCC -57 15396 http://www.s PHYSPROP
    18348 1-tetradecan CCCCCCCCCCC 83.1 15389 http://www.s PHYSPROP
    18349 n-nonylamineCCCCCCCCCN -1 15387 http://www.s PHYSPROP
    18350 2,6-dichlorob O=C(N)c1c(Cl) 197.5 15359 http://www.s PHYSPROP
    18351 p-bromophenyl
    Brc1ccc(N=C=S 60.5 15317 http://www.s PHYSPROP
    18352 4-hydroxy-9-f Oc3cccc2c3c1 250 15323 http://www.s PHYSPROP
    18353 sulfasymazineO=S(=O)(Nc1nc 187 15316 http://www.s PHYSPROP
    18354 benzene, 1,2- Clc1c(OC)cccc 32 15310 http://www.s PHYSPROP
    18355 2,1,3-benzothiClc1cc(Cl)c(Cl 122 15301 http://www.s PHYSPROP
    18356 medronic acidO=P(O)(O)CP( 199.5 15308 http://www.s PHYSPROP
    18357 siduron O=C(NC1CCCC 135 15300 http://www.s PHYSPROP
    18358 chloroxuron Clc2ccc(Oc1cc 151 15299 http://www.s PHYSPROP
    18359 perlapine CN1CCN(CC1)C 137 15291 http://www.s PHYSPROP
    18360 2-bromohept BrC(C)CCCCC 47 15278 http://www.s PHYSPROP
    18361 p-bromophenyBrc1ccc(NC(N 226 15262 http://www.s PHYSPROP
    18362 etoglucid C(OCCOCC1C -13 15246 http://www.s PHYSPROP
    18363 chlorbufam Clc1cc(NC(=O 45.5 15261 http://www.s PHYSPROP
    18364 1h-indol-5-ol Oc1cc2ccnc2c 107.5 15244 http://www.s PHYSPROP
    18365 4-(bis(2-chlor O=C(O)CC(N)c1 182.5 15242 http://www.s PHYSPROP
    18366 2-tert-butylh CC(C)(C)c1cc( 128 15235 http://www.s PHYSPROP
    18367 5-decyne CCCCC#CCCCC -73 15222 http://www.s PHYSPROP
    18368 palustric acid CC(C)C2=CC=3 164.5 15232 http://www.s PHYSPROP
    18369 fluorene, 9-b BrC3c1ccccc1 103.5 15216 http://www.s PHYSPROP
    18370 4-octyne CCCC#CCCC -101 15221 http://www.s PHYSPROP
    18371 1-ethylcycloh CCC1(O)CCCC 34.5 15213 http://www.s PHYSPROP
    18372 benzonitrile, O=[N+]([O-])c 140.75 15209 http://www.s PHYSPROP
    18373 nitrapyrin ClC(Cl)(Cl)c1c 63 15205 http://www.s PHYSPROP
    18374 2,4,5-t, ethyl Clc1cc(OCC(=O 64 15196 http://www.s PHYSPROP
    18375 1,3,5-triazine c1ccccc1Oc3n 233.5 15177 http://www.s PHYSPROP
    18376 dipropalin [O-][N+](=O)c 80 15171 http://www.s PHYSPROP
    18377 picloram Nc1c(Cl)c(nc( 218.5 15170 http://www.s PHYSPROP
    18378 trietazine Clc1nc(NCC)n 101 15157 http://www.s PHYSPROP
    18379 benzoic acid, COc1c(cc(cc1 83 15161 http://www.s PHYSPROP
    18380 2-hydroxyethylOCCSSCCO 26 15117 http://www.s PHYSPROP
    18381 perchloropropCl/C(Cl)=C(Cl)C -72.9 15113 http://www.s PHYSPROP
    18382 benzonitrile, COc1c(cc(cc1 93.8 15105 http://www.s PHYSPROP
    18383 2-(1,1-dimethCC(C)(C)c1cc( 22.3 15097 http://www.s PHYSPROP
    18384 p-chlorophenyl
    Clc1ccc(CC(=O 106.5 15093 http://www.s PHYSPROP
    18385 m-nitrophenylO=[N+]([O-])c 118.5 15089 http://www.s PHYSPROP
    18386 m-chloropheny
    Clc1cc(CC(=O) 78.75 15092 http://www.s PHYSPROP
    18387 2-(chloromethC=C(CCl)CCl -14 15073 http://www.s PHYSPROP
    18388 m-cyanobenzoi
    OC(=O)c1cccc 219 15088 http://www.s PHYSPROP
    18389 2-ethylbenzimCCc1nc2ccccc 175 15028 http://www.s PHYSPROP
    18390 octadecylami CCCCCCCCCCC 52.9 15016 http://www.s PHYSPROP
    18391 methanone, 2-O=C(c1ccc(cc 48.5 15020 http://www.s PHYSPROP
    18392 chlornitrofen Clc2cc(Cl)cc(C 105.5 15011 http://www.s PHYSPROP
    18393 1-heptadecanCCCCCCCCCCC 49 15014 http://www.s PHYSPROP
    18394 tetrafluoroterFc1c(C#N)c(F) 198 15008 http://www.s PHYSPROP
    18395 nitrofen Clc2cc(Cl)ccc 70 15010 http://www.s PHYSPROP
    18396 1,4-dichloron Clc1ccc(Cl)c2 67.5 14995 http://www.s PHYSPROP
    18397 pentachloroanClc1c(OC)c(Cl) 108 14993 http://www.s PHYSPROP
    18398 1,5-dichloron Clc2cccc1c2cc 107 14994 http://www.s PHYSPROP
    18399 3-ethylhydrocNS(=O)(=O)c2 269.5 14989 http://www.s PHYSPROP
    18400 2-pyridinaminCc1cccc(N)n1 41 14991 http://www.s PHYSPROP
    18401 benzenamine,Nc1c(cc(cc1Br 153.5 14979 http://www.s PHYSPROP
    18402 pentane, 3-b BrC(CC)CC -126.2 14966 http://www.s PHYSPROP
    18403 1,1'-biphenyl,CCc2ccccc2c1 -6 14969 http://www.s PHYSPROP
    18404 2,2'-(1,4-phenc1cc(ccc1c2nc 245 14960 http://www.s PHYSPROP
    18405 3,4-dichlorobeClc1ccc(CO)cc 36 14956 http://www.s PHYSPROP
    18406 2,2'-biphenol Oc2ccccc2c1c 109 14959 http://www.s PHYSPROP
    18407 azacyclonol OC(c1ccccc1) 160.5 14952 http://www.s PHYSPROP
    18408 n-tetradecylc CCCCCCCCCCC 24 14944 http://www.s PHYSPROP
    18409 m-methoxyphen
    COc1cc(CC(=O 72 14948 http://www.s PHYSPROP
    18410 dodecylcyclo CCCCCCCCCCC 12.5 14943 http://www.s PHYSPROP
    18411 n-decylcyclohCCCCCCCCCCC -1.7 14942 http://www.s PHYSPROP
    18412 1-cyclohexyloCCCCCCCCC1C -20 14941 http://www.s PHYSPROP
    18413 thiophene, 2,3Cc1scc(C)c1C -26.2 14939 http://www.s PHYSPROP
    18414 thiophene, te CC1CCCS1 -100.7 14940 http://www.s PHYSPROP
    18415 silane, ethyld CC[SiH](Cl)Cl -107 14937 http://www.s PHYSPROP
    18416 5h-dibenzo(a,ON=C1c3ccccc 169.5 14933 http://www.s PHYSPROP
    18417 s-triazine-2,4 O=C2N(C(=O)N 285 14928 http://www.s PHYSPROP
    18418 pyrimidine, teClc1c(Cl)nc(Cl 69 14924 http://www.s PHYSPROP
    18419 2-thiazolamineN=C1NCCS1 85.3 14923 http://www.s PHYSPROP
    18420 benzenemethan
    OCc1ccc(Cl)cc 59.5 14918 http://www.s PHYSPROP
    18421 2-amino-5-ni O=C(c1cc(ccc1 163 14916 http://www.s PHYSPROP
    18422 benzene, 1,1'-Cc1ccc(cc1)S( 95 14915 http://www.s PHYSPROP
    18423 2-methyl-4(3hO=C2N=C(C)Nc 232 14909 http://www.s PHYSPROP
    18424 dichloromethyClC(Cl)C(=O)C( 2.1 14908 http://www.s PHYSPROP
    18425 epithiazide NS(=O)(=O)c2c 206.5 14906 http://www.s PHYSPROP
    18426 cyclopentene,CC1CC=CC1 -160.8 14893 http://www.s PHYSPROP
    18427 1,3-dimethylcC[C@@H]1CC -134 14891 http://www.s PHYSPROP
    18428 cyclopropanecO=C(O)C1CC1 18.5 14890 http://www.s PHYSPROP
    18429 thiazole, 5-et C=Cc1scnc1C -15 14889 http://www.s PHYSPROP
    18430 2-ethyl-1,4-d Cc1ccc(C)cc1C -53.7 14888 http://www.s PHYSPROP
    18431 9,10-anthraceO=C3c1ccccc1 290 14887 http://www.s PHYSPROP
    18432 2-amino-6-meCOc1ccc2NC(= 166 14869 http://www.s PHYSPROP
    18433 o-phenyl n,n' O=P(Oc1ccccc 102 14880 http://www.s PHYSPROP
    18434 monolinuron Clc1ccc(NC(= 81.5 14868 http://www.s PHYSPROP
    18435 isopropyl car NC(=O)OC(C)C 93 14867 http://www.s PHYSPROP
    18436 phenol, 2-(2-pOc1ccccc1CC= -6 14864 http://www.s PHYSPROP
    18437 2,3,7,8-tetrac Clc1cc2Oc3cc( 305 14865 http://www.s PHYSPROP
    18438 methyl pentylCCCCCSC -94 14860 http://www.s PHYSPROP
    18439 isoquinoline, COc1cc2CNCC 264 14863 http://www.s PHYSPROP
    18440 octanedioic acO=C(CCCCCCC -3.1 14851 http://www.s PHYSPROP
    18441 heptadecanoicO=C(CCCCCCC 30 14849 http://www.s PHYSPROP
    18442 methyl tridec O=C(CCCCCCC 6.5 14848 http://www.s PHYSPROP
    18443 1-methylfluorCc2cccc1c3cc 85 14844 http://www.s PHYSPROP
    18444 n-decane CCCCCCCCCC -29.7 14840 http://www.s PHYSPROP
    18445 quinoline, 2,3 Cc1cc2ccccc2 68.5 14832 http://www.s PHYSPROP
    18446 isoquinoline, Cc2nccc1cccc 10 14833 http://www.s PHYSPROP
    18447 cyclododecanoOC1CCCCCCCC 77.5 14836 http://www.s PHYSPROP
    18448 dichlorodiethyCC[Si](Cl)(Cl)C -96.5 14830 http://www.s PHYSPROP
    18449 1,1-dichlorof CC(Cl)(Cl)F -103.5 14829 http://www.s PHYSPROP
    18450 bromociclen [ClC2(Cl)C1(Cl) 77 14826 http://www.s PHYSPROP
    18451 phosphinic aciO=P(O)(c1cccc 194 14810 http://www.s PHYSPROP
    18452 3,6-dichloropiClc1ccc(Cl)nc 151 14797 http://www.s PHYSPROP
    18453 laudanosine COc1ccc(cc1O 89 14792 http://www.s PHYSPROP
    18454 chloridazon O=C2C(Cl)=C( 205 14790 http://www.s PHYSPROP
    18455 morpholine, 4-CC(=O)N1CCO 14.5 14787 http://www.s PHYSPROP
    18456 bromoxynil ocBrc1cc(cc(Br 45.5 14777 http://www.s PHYSPROP
    18457 bromoxynil Brc1cc(cc(Br) 190 14775 http://www.s PHYSPROP
    18458 nitroxynil O=[N+]([O-])c 137.5 14776 http://www.s PHYSPROP
    18459 ioxynil Ic1cc(C#N)cc( 212.5 14774 http://www.s PHYSPROP
    18460 naphthalene, Cc1ccc2CCCCc -40 14761 http://www.s PHYSPROP
    18461 isobutylcyclo CC(C)CC1CCC -95 14755 http://www.s PHYSPROP
    18462 methyl terephCOC(=O)c1ccc 222 14760 http://www.s PHYSPROP
    18463 cyclohexane, 1CC1CCCC(C)C -66.9 14754 http://www.s PHYSPROP
    18464 butylcyclohexCCCCC1CCCCC -74.7 14753 http://www.s PHYSPROP
    18465 cyclohexane, 1CC1CCCC(C)C -85.7 14754 http://www.s PHYSPROP
    18466 n-propylcyclo CCCC1CCCCC1 -94.9 14752 http://www.s PHYSPROP
    18467 ethylcyclohexCCC1CCCCC1 -111.3 14751 http://www.s PHYSPROP
    18468 cyclohexene, CC=1CCCCC=1 -84.1 14729 http://www.s PHYSPROP
    18469 cv 399 Cc1nc(N)nc(O 259.5 14716 http://www.s PHYSPROP
    18470 metaxalone Cc1cc(cc(C)c 122 14709 http://www.s PHYSPROP
    18471 propanenitrileN#CCCOCCC# -26.3 14704 http://www.s PHYSPROP
    18472 1-heptanol, 6 CC(C)CCCCCO -106 14702 http://www.s PHYSPROP
    18473 isooctyl alcoh CC(C)CCCCCO -106 14702 http://www.s PHYSPROP
    18474 azaperone Fc1ccc(cc1)C 74 14695 http://www.s PHYSPROP
    18475 2-tridecanol CC(O)CCCCCC 23 14701 http://www.s PHYSPROP
    18476 1,2-dichloro-1ClCC(Cl)(F)F -101.2 14694 http://www.s PHYSPROP
    18477 ethanone, 1-( CC(=O)c1cc2c 76 14690 http://www.s PHYSPROP
    18478 2-bromoethylBrCCC1CCCCC -57 14693 http://www.s PHYSPROP
    18479 ethylcyclopenCCC1CCCC1 -138.4 14686 http://www.s PHYSPROP
    18480 n,n-dimethyldC[N+]([O-])( 130.5 14688 http://www.s PHYSPROP
    18481 1-heptanethioCCCCCCCS -43 14680 http://www.s PHYSPROP
    18482 1,1-dimethylcCC1(C)CCCC1 -69.8 14679 http://www.s PHYSPROP
    18483 p-butylphenolOc1ccc(CCCC) 22 14678 http://www.s PHYSPROP
    18484 naphthalene, CCCCc2cccc1c -19.8 14673 http://www.s PHYSPROP
    18485 methyl t-butylCC(C)(C)OC -108.6 14672 http://www.s PHYSPROP
    18486 butanesulton O=S1(=O)CCC 13.5 14670 http://www.s PHYSPROP
    18487 (+)-fenchol CC12CCC(C1)C 43.5 14665 http://www.s PHYSPROP
    18488 bicyclo 2.2.1 hCC12CCC(C1)C 48 14665 http://www.s PHYSPROP
    18489 propanedioic aCC(C)(C(=O)O -30.4 14641 http://www.s PHYSPROP
    18490 nereistoxin CN(C)C1CSSC1 177.2 14661 http://www.s PHYSPROP
    18491 tetrahydro-2hC1CCCCS1 19 14628 http://www.s PHYSPROP
    18492 1-azabicyclo 2OC2CN1CCC2 221 14640 http://www.s PHYSPROP
    18493 dymanthine CN(C)CCCCCC 22.89 14626 http://www.s PHYSPROP
    18494 2-amino-5-metCc1cnc(N)cc1 76.5 14609 http://www.s PHYSPROP
    18495 2-pyridinaminCc1cccnc1N 33.5 14608 http://www.s PHYSPROP
    18496 daminozide O=C(NN(C)C)C 154.5 14593 http://www.s PHYSPROP
    18497 propane, 1,2,2FC(F)(F)C(Cl)(C -4.3 14597 http://www.s PHYSPROP
    18498 propoxypheneCN(C)CC(C)C(O 75.5 14592 http://www.s PHYSPROP
    18499 1,1'-biphenyl,Ic1ccc(cc1)c2 113.5 14585 http://www.s PHYSPROP
    18500 (1,1'-biphenyl)N#Cc1ccc(cc1) 238 14584 http://www.s PHYSPROP
    18501 5-hexenoic acC=CCCCC(=O) -37 14571 http://www.s PHYSPROP
    18502 alpha-hydroxyOC1(CCCCC1)c 63.5 14582 http://www.s PHYSPROP
    18503 3,6-dimethyl Cc2ccc3ccc1cc 145 14567 http://www.s PHYSPROP
    18504 phenylphospho
    OP(O)(=O)c1c 164.5 14560 http://www.s PHYSPROP
    18505 isonicotinic acO=C(OCC)c1cc 23 14556 http://www.s PHYSPROP
    18506 1-propoxy-2-pCC(O)COCCC -80 14551 http://www.s PHYSPROP
    18507 cyclohexanol, OC1CCCCC1Cl 29 14539 http://www.s PHYSPROP
    18508 4-methoxy-2-nO=[N+]([O-])c 79 14550 http://www.s PHYSPROP
    18509 heptadecane, CC(C)CCCCCC 5.7 14530 http://www.s PHYSPROP
    18510 4,6-dimethylpCc1cc(C)ncn1 25 14522 http://www.s PHYSPROP
    18511 benzeneaceticCC(C)Cc1ccc(c 86 14516 http://www.s PHYSPROP
    18512 thiophene, tetCC1CCC(C)S1 -89 14513 http://www.s PHYSPROP
    18513 heptanoic acidFC(F)(C(F)(F)C 34 14509 http://www.s PHYSPROP
    18514 3-methyl-2-thCC(C)SC -101.5 14512 http://www.s PHYSPROP
    18515 benzene, 1-fl S=C=Nc1ccc(F 27 14507 http://www.s PHYSPROP
    18516 4-cyclopentyl Oc1ccc(cc1)C 65 14468 http://www.s PHYSPROP
    18517 2,3-dimethoxyCOc1cccc(c1O 123 14470 http://www.s PHYSPROP
    18518 cyclodecanol OC1CCCCCCCC 40.5 14436 http://www.s PHYSPROP
    18519 ketone, 2,4-diCc1ncc(C)c1C 137.5 14433 http://www.s PHYSPROP
    18520 9,10-diphenylc1cccc4c1c(c2 246 14430 http://www.s PHYSPROP
    18521 formyl fluoridFC=O -142.2 14424 http://www.s PHYSPROP
    18522 naftalofos O=P(OCC)(OCC 177 14419 http://www.s PHYSPROP
    18523 2-piperidinee OCCC1CCCCN 69 14415 http://www.s PHYSPROP
    18524 9h-carbazole, C=Cn3c1ccccc 65 14414 http://www.s PHYSPROP
    18525 9h-carbazole, Cn3c1ccccc1c 89.34 14413 http://www.s PHYSPROP
    18526 fluanisone Fc1ccc(cc1)C 68 14410 http://www.s PHYSPROP
    18527 2-benzothiazoCc1cccc2SC(= 138 14403 http://www.s PHYSPROP
    18528 dimethyl trid O=C(CCCCCCC 36 14392 http://www.s PHYSPROP
    18529 5-indanol Oc1ccc2CCCc2 58 14390 http://www.s PHYSPROP
    18530 3-acetylthiop CC(=O)c1ccsc 60 14388 http://www.s PHYSPROP
    18531 acetylsalicyli O=C(C)Oc2ccc 83 14382 http://www.s PHYSPROP
    18532 pyridine, trim Cc1ccc(C)c(C) 37 14372 http://www.s PHYSPROP
    18533 2,8-dimethylqCc1cccc2ccc(C 27 14373 http://www.s PHYSPROP
    18534 dimethyl isop COC(=O)c1ccc 67.5 14360 http://www.s PHYSPROP
    18535 1-phenyltetraCCCCCCCCCCC 16 14358 http://www.s PHYSPROP
    18536 1-nonanethiolCCCCCCCCCS -20.1 14349 http://www.s PHYSPROP
    18537 n-hexadecylb CCCCCCCCCCC 27 14357 http://www.s PHYSPROP
    18538 i-nicotinamid NC(=O)c1ccnc 156 14346 http://www.s PHYSPROP
    18539 [1,1'-biphenylNc2ccccc2c1c 81 14347 http://www.s PHYSPROP
    18540 heptadecyl al CCCCCCCCCCC 53.8 14348 http://www.s PHYSPROP
    18541 3-methyl-1h-pCc1ccnn1 36.5 14345 http://www.s PHYSPROP
    18542 cyclopropyl k ON=C(/C1CC1 76.5 14344 http://www.s PHYSPROP
    18543 2-acetyl-4-meO=C(C)c1cc(C 50 14340 http://www.s PHYSPROP
    18544 2,4-dibromof Brc1cc(Br)c(F) 69 14310 http://www.s PHYSPROP
    18545 oxirane, butylCCCCC1CO1 94 14311 http://www.s PHYSPROP
    18546 benzene, 2-brClc1cc(Br)c(Cl 35 14309 http://www.s PHYSPROP
    18547 2,4,5-trihydr Oc1cc(C(=O)C 154.5 14286 http://www.s PHYSPROP
    18548 3,5-di-tert-bu CC(C)(C)c1cc( 207.5 14285 http://www.s PHYSPROP
    18549 n,s-diacetylc CC(=O)NCCSC( 32.5 14276 http://www.s PHYSPROP
    18550 dinoterb O=[N+]([O-])c 126 14274 http://www.s PHYSPROP
    18551 trifenmorph c1ccccc1C(N2 175 14273 http://www.s PHYSPROP
    18552 2h-1-benzopyrCC(C)CCCC(C) -3 14266 http://www.s PHYSPROP
    18553 tylocrebrine COc3ccc2c1CN 220 14240 http://www.s PHYSPROP
    18554 1,2,3-propanetOC(=O)CC(CC( 166 14220 http://www.s PHYSPROP
    18555 o-chlorostyre C=Cc1ccccc1C -63.1 14205 http://www.s PHYSPROP
    18556 hydrogen fluoF -83.55 14214 http://www.s PHYSPROP
    18557 isodecyloctylpO=C(OCCCCCCC 98 14202 http://www.s PHYSPROP
    18558 isodecyl acryl C=CC(=O)OCC -100 14200 http://www.s PHYSPROP
    18559 (1s)-(-)-beta- CC2(C)C1CCC( -61 14198 http://www.s PHYSPROP
    18560 beta-pinene CC2(C)C1CCC( -61.5 14198 http://www.s PHYSPROP
    18561 dinsed O=S(=O)(NCCNS 190 14197 http://www.s PHYSPROP
    18562 5-chlorosalicyOc2ccc(Cl)cc2 211 14179 http://www.s PHYSPROP
    18563 tribromsalan Oc1c(cc(Br)cc 227 14178 http://www.s PHYSPROP
    18564 6-methoxyquiCOc1ccc2nccc 26.5 14170 http://www.s PHYSPROP
    18565 1-methyl-2-chOc1cccc(Cl)c1 86 14166 http://www.s PHYSPROP
    18566 phenol, 3-chl Oc1cc(Cl)c(C) 55.5 14163 http://www.s PHYSPROP
    18567 2-methyl-4-chCc1cc(Cl)ccc1 51 14165 http://www.s PHYSPROP
    18568 dibromsalan [Oc2ccc(Br)cc2 241.5 14152 http://www.s PHYSPROP
    18569 euprocin CC(C)CCOc1cc 152 14081 http://www.s PHYSPROP
    18570 3-methyl-6-peOc1cc(C)ccc1 24 14076 http://www.s PHYSPROP
    18571 6-n-amyl-m-crOc1cc(C)ccc1 24 14076 http://www.s PHYSPROP
    18572 2-ethylhexyl CCC(CCCC)COP -54 14040 http://www.s PHYSPROP
    18573 phenazocine Oc3ccc4CC2C( 181 14031 http://www.s PHYSPROP
    18574 methdilazine CN1CCC(C1)CN 87.5 14009 http://www.s PHYSPROP
    18575 benzene, 1,1'-[O-][N+](=O)c 160.5 13988 http://www.s PHYSPROP
    18576 zolimidine CS(=O)(=O)c1c 243 13985 http://www.s PHYSPROP
    18577 c.i. disperse v O=C2c1ccccc1 193 13983 http://www.s PHYSPROP
    18578 ethebenecid O=S(=O)(N(CC 193 13941 http://www.s PHYSPROP
    18579 indole, 5-benzc1c(ccc2nccc 102 13959 http://www.s PHYSPROP
    18580 5h-dibenzo a, O=C1c3ccccc3 30 13927 http://www.s PHYSPROP
    18581 5h-dibenzo(a,ClC2c3ccccc3 106.5 13925 http://www.s PHYSPROP
    18582 5h-dibenzo(a,OC2c3ccccc3C 92 13926 http://www.s PHYSPROP
    18583 9-anthracenecN#Cc2c3ccccc 175 13924 http://www.s PHYSPROP
    18584 3-methyl diphCc2cc(Nc1cccc 30 13910 http://www.s PHYSPROP
    18585 sulfamido-3-cO=S(N)(=O)c1c 257 13909 http://www.s PHYSPROP
    18586 n-2-pyridinyl n1ccccc1Nc2c 90.5 13888 http://www.s PHYSPROP
    18587 (1,1'-biphenylNc1cc(ccc1O)c 200 13903 http://www.s PHYSPROP
    18588 1,2-benzenediCCOc1ccc(N)c 71.5 13875 http://www.s PHYSPROP
    18589 3,4-dihydrox Oc1ccc(cc1O) 115.5 13873 http://www.s PHYSPROP
    18590 d-fenchone CC2(C)C(=O)C 6.1 13869 http://www.s PHYSPROP
    18591 fenchone CC2(C)C(=O)C 5 13869 http://www.s PHYSPROP
    18592 (1r)-(-)-fench CC2(C)C(=O)C 5 13869 http://www.s PHYSPROP
    18593 benzonitrile, N#Cc1ccc(F)cc 34.8 13861 http://www.s PHYSPROP
    18594 methyl phenylCS(=O)c1ccccc 32 13860 http://www.s PHYSPROP
    18595 4-aminobenzeNc1ccc(S)cc1 46 13854 http://www.s PHYSPROP
    18596 2-cyclohexen-CC=1CCCC(=O -21 13855 http://www.s PHYSPROP
    18597 2-acetylfuran CC(=O)c1ccco 33 13849 http://www.s PHYSPROP
    18598 cyclopentanonON=C1CCCC1 57.8 13844 http://www.s PHYSPROP
    18599 methylene cy C=C1CCCCC1 -106.7 13846 http://www.s PHYSPROP
    18600 cyclobutanon O=C1CCC1 -50.9 13840 http://www.s PHYSPROP
    18601 n-methyl pro CCC(=O)NC -30.9 13816 http://www.s PHYSPROP
    18602 2-acetamidoetCC(=O)NCCS 6.5 13829 http://www.s PHYSPROP
    18603 2,2,3,4-tetra CC(C)C(C)C(C) -121 13808 http://www.s PHYSPROP
    18604 lauryl gallate Oc1cc(cc(O)c 96.5 13777 http://www.s PHYSPROP
    18605 aflatoxin g1 O=C2Oc1c4C5 245 13775 http://www.s PHYSPROP
    18606 decabromodipBrc2c(Oc1c(Br) 305 13764 http://www.s PHYSPROP
    18607 aflatoxin b1 O=C2Oc1c4C5 268.5 13758 http://www.s PHYSPROP
    18608 clobenzepam CN(C)CCN2c3c 165.5 13752 http://www.s PHYSPROP
    18609 benzamide, 3,Clc2ccc(NC(=O 161 13743 http://www.s PHYSPROP
    18610 1h-indene-1,3Brc1ccc(cc1) 138 13729 http://www.s PHYSPROP
    18611 bis(4-chlorophClc2ccc(SSc1cc 68 13721 http://www.s PHYSPROP
    18612 barbituric acidO=C1NC(=O)NC 131.5 13723 http://www.s PHYSPROP
    18613 (-)-beta-cary C=C2CCC3OC3 62.5 13711 http://www.s PHYSPROP
    18614 4-benzoylanil O=C(c1ccc(N)c 122.5 13707 http://www.s PHYSPROP
    18615 n-benzyloxycaO=C(O)CNC(=O 121 13710 http://www.s PHYSPROP
    18616 naphthalene, CCCCc1ccc2cc -5 13700 http://www.s PHYSPROP
    18617 cycloate CCN(C(=O)SC 11.5 13698 http://www.s PHYSPROP
    18618 2,2'-bipyridin Cc1cc(ncc1)c2 175 13699 http://www.s PHYSPROP
    18619 2-bromo-9h-f Brc1ccc2c3cc 113.5 13697 http://www.s PHYSPROP
    18620 3,5-dimethoxyCOc1cc(cc(OC 185.5 13693 http://www.s PHYSPROP
    18621 p-cyclohexylpOc1ccc(cc1)C 133 13689 http://www.s PHYSPROP
    18622 butyranilide O=C(Nc1ccccc 97 13685 http://www.s PHYSPROP
    18623 1-ethylnaphthCCc2cccc1ccc -13.9 13677 http://www.s PHYSPROP
    18624 n-methyl-m-toO=C(Oc1cc(C) 76.5 13684 http://www.s PHYSPROP
    18625 1h-indole-2,3-Cc2cccc1c2NC 267 13675 http://www.s PHYSPROP
    18626 butyl phenyl eCCCCOc1ccccc -19.4 13673 http://www.s PHYSPROP
    18627 n-butylanilineCCCCNc1ccccc -14.4 13672 http://www.s PHYSPROP
    18628 methyl p-chloClc1ccc(cc1)C 43.5 13669 http://www.s PHYSPROP
    18629 isoquinolone-Cc1cc2ccccc2 68 13668 http://www.s PHYSPROP
    18630 2-naphthalenol
    Oc1ccc2CCCCc 57 13667 http://www.s PHYSPROP
    18631 1,2-cyclobutanO=C(O)C1CCC 131 13659 http://www.s PHYSPROP
    18632 pyrazine, tetr Cc1nc(C)c(C)n 85 13658 http://www.s PHYSPROP
    18633 glutarimide, 3CC1(C)CC(=O) 145 13654 http://www.s PHYSPROP
    18634 2-phenylpropaOCC(C)c1cccc -13 13657 http://www.s PHYSPROP
    18635 cyclohexane, n[O-][N+](=O) -34 13647 http://www.s PHYSPROP
    18636 4-dimethylamiCN(C)c1ccncc 112 13646 http://www.s PHYSPROP
    18637 4-acetylpyridiCC(=O)c1ccnc 16 13644 http://www.s PHYSPROP
    18638 4-methyldiox CC1CCOCO1 -44.5 13631 http://www.s PHYSPROP
    18639 3-pyridinol, 6 Oc1cnc(C)cc1 169 13637 http://www.s PHYSPROP
    18640 azocine, octa C1CCCCCCN1 29 13638 http://www.s PHYSPROP
    18641 4-bromopyridBrc1ccncc1 0.5 13630 http://www.s PHYSPROP
    18642 cyclopentanonO=C1CCCC1C -75 13627 http://www.s PHYSPROP
    18643 2,2-dioxide-1,O=S1(=O)CCC 31.5 13626 http://www.s PHYSPROP
    18644 1-tetradeceneCCCCCCCCCCC -12 13622 http://www.s PHYSPROP
    18645 cyclobutane, C=C1CCC1 -134.7 13624 http://www.s PHYSPROP
    18646 eicosanoic aciO=C(CCCCCCC 54.5 13621 http://www.s PHYSPROP
    18647 n-undecane CCCCCCCCCCC -25.6 13619 http://www.s PHYSPROP
    18648 dodecanamid NC(=O)CCCCC 110 13618 http://www.s PHYSPROP
    18649 5-chloropentaClCCCCC(=O)O 18 13606 http://www.s PHYSPROP
    18650 pentanedioic aO=C(CCCC(=O -42.5 13605 http://www.s PHYSPROP
    18651 octanoic acid,O=C(CCCCCCC -30.6 13592 http://www.s PHYSPROP
    18652 5-ethyl-l-glut NC(CCC(=O)OC 191 13604 http://www.s PHYSPROP
    18653 tripropyl-bor CCCB(CCC)CC -56 13588 http://www.s PHYSPROP
    18654 tillam O=C(SCCC)N(C -22 13579 http://www.s PHYSPROP
    18655 1-propanamine
    CC(C)CN(CC(C) -21.8 13586 http://www.s PHYSPROP
    18656 acetamide, n-CC(=O)N(C)C( -25 13578 http://www.s PHYSPROP
    18657 dimethoxon COP(=O)(OC)S -28 13574 http://www.s PHYSPROP
    18658 prednisolone CC(C)(C)C(=O 233 13570 http://www.s PHYSPROP
    18659 pyritinol Oc1c(CO)c(cn 219 13561 http://www.s PHYSPROP
    18660 boric acid, tri O(B(Oc1ccccc1 99.5 13555 http://www.s PHYSPROP
    18661 1,4-naphthoquO=C3c1ccccc1 215 13535 http://www.s PHYSPROP
    18662 dichlofluanid CN(C)S(=O)(=O 106 13520 http://www.s PHYSPROP
    18663 bucetin CCOc1ccc(cc1 160 13507 http://www.s PHYSPROP
    18664 n-nonylbenze CCCCCCCCCc1c -24 13503 http://www.s PHYSPROP
    18665 pyridine, 4- ( [O-][N+](=O)c 71 13506 http://www.s PHYSPROP
    18666 benzene, 1,1'-C(CCc1ccccc1) 6 13502 http://www.s PHYSPROP
    18667 1-phenylhept CCCCCCCc1ccc -48 13492 http://www.s PHYSPROP
    18668 phenylhydroqOc2ccc(O)cc2 102.5 13493 http://www.s PHYSPROP
    18669 1(2h)-naphthaCOc2ccc1c(CC 78 13490 http://www.s PHYSPROP
    18670 n-hexylbenze CCCCCCc1cccc -61 13487 http://www.s PHYSPROP
    18671 naphthalene, Cc1cc2CCCCc2 10 13483 http://www.s PHYSPROP
    18672 trans-cyclohexOC(=O)C1CCC( 312.5 10466934 http://www.s PHYSPROP
    18673 propanenitrileN#CCCNc1ccc 52.5 13478 http://www.s PHYSPROP
    18674 benzoic acid, OC(=O)c1ccc( 143.5 13476 http://www.s PHYSPROP
    18675 1-methyl-4-p CCCc1ccc(C)cc -63.6 13473 http://www.s PHYSPROP
    18676 1-methyl-3-p CCCc1cccc(C)c -82.5 13472 http://www.s PHYSPROP
    18677 1-methyl-2-p CCCc1ccccc1C -60.3 13471 http://www.s PHYSPROP
    18678 p-chlorostyre C=Cc1ccc(Cl)c 15.9 13465 http://www.s PHYSPROP
    18679 2-acetylpyrrolCC(=O)c1cccn 90 13459 http://www.s PHYSPROP
    18680 thiirane, methCC1CS1 -91 13453 http://www.s PHYSPROP
    18681 [1,3,2]dioxathO=S1(=O)OCC 99 13456 http://www.s PHYSPROP
    18682 octane, 2,7-diCC(C)CCCCC(C -54.9 13451 http://www.s PHYSPROP
    18683 heptane, 2,6- CC(C)CCCC(C) -102.9 13450 http://www.s PHYSPROP
    18684 2-butynedinitrN#CC#CC#N 20.5 13449 http://www.s PHYSPROP
    18685 2,2,5,5-tetra CC(C)(C)CCC(C -12.6 13448 http://www.s PHYSPROP
    18686 2,2-dimethylhCC(C)(C)CCCC -113 13443 http://www.s PHYSPROP
    18687 2,2,4,4-tetra CC(C)(C)CC(C) -66.5 13439 http://www.s PHYSPROP
    18688 butanoic acid,CC(C)(C)CC(= 6.5 13438 http://www.s PHYSPROP
    18689 2,3,5-trimeth CC(C)CC(C)C(C -127.9 13426 http://www.s PHYSPROP
    18690 1,5-hexadieneC=CC(O)C(O)C 15 13423 http://www.s PHYSPROP
    18691 propanedioic aO=C(C)NC(C(= 96.3 13422 http://www.s PHYSPROP
    18692 2,4-dimethyl- CC(C)C(CC)C(C -122.4 13421 http://www.s PHYSPROP
    18693 acetic acid hy CC(=O)NN 67 13420 http://www.s PHYSPROP
    18694 3-methyl-3-etCC(CC)(CC)CC -90.9 13400 http://www.s PHYSPROP
    18695 3,3-diethylpe CCC(CC)(CC)C -33.1 13402 http://www.s PHYSPROP
    18696 phosphine, tr Cc1ccc(cc1)P( 149 13352 http://www.s PHYSPROP
    18697 endosulfan sulClC2=C(Cl)C3( 181 13338 http://www.s PHYSPROP
    18698 phosphonic diO=P(N(C)C)(N( 167.5 13341 http://www.s PHYSPROP
    18699 1,3,5-triazine-C=CCN1C(=O) 20.5 13329 http://www.s PHYSPROP
    18700 heptachlor epClC3=C(Cl)C4( 160 13328 http://www.s PHYSPROP
    18701 benzamide, n-Clc2ccccc2NC( 99 13316 http://www.s PHYSPROP
    18702 pyrrolnitrin Clc2cncc2c1cc 124.5 13314 http://www.s PHYSPROP
    18703 desmetryne CSc1nc(NC)nc 85 13302 http://www.s PHYSPROP
    18704 benzoic acid, Clc1c(c(Cl)c(C 209.3 13294 http://www.s PHYSPROP
    18705 benzene, 1,4-bCC(C)(C)c1ccc( 79.5 13293 http://www.s PHYSPROP
    18706 benzenepropano
    O=C(O)CC(C)(C 60 13289 http://www.s PHYSPROP
    18707 p-acetylacet O=C(C)c1ccc(c 112 13287 http://www.s PHYSPROP
    18708 3-phenylpyridc1cc(ccc1)c2c 164 13285 http://www.s PHYSPROP
    18709 2(3h)-furanonO=C1CCC(O1)c 36.5 13283 http://www.s PHYSPROP
    18710 benzothiazoleClc1cc2nc(C)s 69 13273 http://www.s PHYSPROP
    18711 5-methoxyindCOc1cc2ccnc2 57 13272 http://www.s PHYSPROP
    18712 2,3,5,6-tetrac Cc1c(Cl)c(Cl)c 93.5 13270 http://www.s PHYSPROP
    18713 2,4,6-pyrimid Nc1cc(N)nc(N 250 13263 http://www.s PHYSPROP
    18714 gamma-2,6-diCC1=CC(=O)C= 132 13262 http://www.s PHYSPROP
    18715 3-methyl-n-ox[O-][n+]1cccc 39 13258 http://www.s PHYSPROP
    18716 4-methyl-n-ox[O-][n+]1ccc( 39 13257 http://www.s PHYSPROP x clearly out of range JCB
    18717 pentadecanoicO=C(O)CCCCC 52.3 13249 http://www.s PHYSPROP
    18718 pyrrole-2-car O=Cc1cccn1 46.5 13254 http://www.s PHYSPROP
    18719 triethoxysilan CCO[SiH](OCC -170 13230 http://www.s PHYSPROP
    18720 1-chlorodeca CCCCCCCCCCC -31.3 13248 http://www.s PHYSPROP
    18721 methylphospho
    CP(=O)(O)O 108.5 13220 http://www.s PHYSPROP
    18722 flumedroxoneFC(F)(F)C3CC 206.5 13204 http://www.s PHYSPROP
    18723 penamecillin CC(=O)OCOC(= 107 13198 http://www.s PHYSPROP
    18724 dinobuton CC(CC)c1cc(cc 61 13186 http://www.s PHYSPROP
    18725 benzacine hydOC(C(=O)OCCN 187 13171 http://www.s PHYSPROP x salt - AL
    18726 7,9-dimethylbCc1c3ccc4cccc 159 13160 http://www.s PHYSPROP
    18727 sulfaethoxypyO=S(=O)(Nc1c 183 13158 http://www.s PHYSPROP
    18728 2,4-dinitro-n [O-][N+](=O)c 159 13153 http://www.s PHYSPROP
    18729 xenbucin CCC(C(=O)O)c1 124 13142 http://www.s PHYSPROP
    18730 diphenamid O=C(C(c1ccccc 135 13133 http://www.s PHYSPROP
    18731 methidathion O=C1SC(=NN1 39 13115 http://www.s PHYSPROP
    18732 benzene, 1-nit[O-][N+](=O)c 56 13125 http://www.s PHYSPROP
    18733 1h-indole, 2-pc1cccc3c1cc(c 190.5 13105 http://www.s PHYSPROP
    18734 azacyclotride O=C1CCCCCC 151.5 13099 http://www.s PHYSPROP
    18735 9-phenanthreNc2cc3ccccc3 138.3 13102 http://www.s PHYSPROP
    18736 cyolane O=P(OCC)(/N 41 13098 http://www.s PHYSPROP
    18737 diphenyl sulfoO=S(c1ccccc1) 71.2 13090 http://www.s PHYSPROP
    18738 benzene, 1,2, Clc1c(OC)c(OC) 90 13088 http://www.s PHYSPROP
    18739 1h-carbazole, C2CCCc3nc1cc 120 13075 http://www.s PHYSPROP
    18740 alpha-naphthyCC(=O)c2cccc 34 13074 http://www.s PHYSPROP
    18741 1h-pyrrole-2,5O=C2C=CC(=O) 90.5 13073 http://www.s PHYSPROP
    18742 2-phenoxyprop
    CC(Oc1ccccc1 117.5 13069 http://www.s PHYSPROP
    18743 benzonitrile, O=[N+]([O-])c 99 13066 http://www.s PHYSPROP
    18744 4-phenylpyridc1cc(ccc1)c2c 77.5 13062 http://www.s PHYSPROP
    18745 2-ethylnaphthCCc1ccc2cccc -7.4 13063 http://www.s PHYSPROP
    18746 2h-1-benzopyrOC1=Cc2cccc 154 13061 http://www.s PHYSPROP
    18747 2,3,4,5-tetrac Clc1c(cc(Cl)c( 84 13060 http://www.s PHYSPROP
    18748 1,2-diaminon Nc1c2ccccc2c 98.5 13059 http://www.s PHYSPROP
    18749 4-ethylaceto CCc1ccc(cc1)C -20.6 13053 http://www.s PHYSPROP
    18750 2-phenyl-2-imc1ccc(cc1)C2 96.5 13050 http://www.s PHYSPROP
    18751 benzoylhydrazO=C(NN)c1ccc 148.5 13048 http://www.s PHYSPROP
    18752 2-azacyclo-n O=C1CCCCCC 78 13043 http://www.s PHYSPROP
    18753 2,3,5,6-tetra Oc1c(Cl)c(Cl)c 115 13047 http://www.s PHYSPROP
    18754 1,3-dimethyl- Cc1cc(C)cc(CC -84.3 13038 http://www.s PHYSPROP
    18755 4-ethyl-1,2-d Cc1ccc(CC)cc1 -66.9 13040 http://www.s PHYSPROP
    18756 s-orthopheny Oc1nc2ccccc2 139 13036 http://www.s PHYSPROP
    18757 2-aminobenziNc1nc2ccccc2 230 13035 http://www.s PHYSPROP
    18758 1,2-benzenediCOc1cccc(O)c 42.8 13033 http://www.s PHYSPROP
    18759 1,2-dimethyl- CCc1cccc(C)c1 -49.5 13032 http://www.s PHYSPROP
    18760 2,3,6-trichlor Oc1c(Cl)ccc(Cl 58 13029 http://www.s PHYSPROP
    18761 2,3,5-trichlor Oc1cc(Cl)cc(Cl 62 13030 http://www.s PHYSPROP
    18762 ethanone, 1-(1CC(=O)C=1CC 73 13023 http://www.s PHYSPROP
    18763 cyclohexanecar
    N#CC1(O)CCC 35 13021 http://www.s PHYSPROP
    18764 2-methyl-n-ox[O-][n+]1cccc 49 13013 http://www.s PHYSPROP
    18765 cyclohexane, COC1CCCCC1 -74.4 13018 http://www.s PHYSPROP
    18766 1,2-cyclohexaOC1CCCCC1O 102.5 13012 http://www.s PHYSPROP
    18767 2-cyclohexeneO=C1C=CCCC1 -53 13005 http://www.s PHYSPROP
    18768 1,2-cyclohexanOC1CCCCC1O 100 13012 http://www.s PHYSPROP
    18769 oxirane, ethenC=CC1CO1 -135 12997 http://www.s PHYSPROP
    18770 octadecane, 1C=COCCCCCCC 30 12996 http://www.s PHYSPROP
    18771 docosanoic aciO=C(CCCCCCC 54 12995 http://www.s PHYSPROP
    18772 1-dodecanamin
    CCCCCCCCCCC 69.5 12994 http://www.s PHYSPROP
    18773 n-dodecylami CCCCCCCCCCC 28.3 12994 http://www.s PHYSPROP
    18774 3-decanone CCCCCCCC(=O 2.5 12987 http://www.s PHYSPROP
    18775 3-hexyne CCC#CCC -103 12979 http://www.s PHYSPROP
    18776 3-butyn-1-ol C#CCCO -63.6 12977 http://www.s PHYSPROP
    18777 6-undecanoneCCCCCC(=O)C 14.5 12972 http://www.s PHYSPROP
    18778 propane, 2-(e CC(C)OC=C -140 12969 http://www.s PHYSPROP
    18779 butanedioic acO=C(CCC(=O) -5.9 12961 http://www.s PHYSPROP
    18780 2-butenoic aciCC(C)=C/C(=O 114 12958 http://www.s PHYSPROP x clearly out of range JCB
    18781 n-(hydroxymetC=CC(=O)NCO 74.5 12955 http://www.s PHYSPROP
    18782 1,1,1,3,3,3-h FC(F)(F)C(O)C( -4 12941 http://www.s PHYSPROP
    18783 1-butyne, 3,3 C#CC(C)(C)C -78.2 12924 http://www.s PHYSPROP
    18784 methacryloyl C=C(C)C(Cl)=O -60 12940 http://www.s PHYSPROP
    18785 terbutryn CSc1nc(NCC)nc 104 12874 http://www.s PHYSPROP
    18786 2-phenylbenztc1cccc2sc(nc1 115 12864 http://www.s PHYSPROP
    18787 diphenyl disulS(Sc1ccccc1)c 62 12861 http://www.s PHYSPROP
    18788 quinoline, 2-m[O-][N+](=O)c 140 12858 http://www.s PHYSPROP
    18789 naphthalene, [O-][N+](=O)c 81.5 12857 http://www.s PHYSPROP
    18790 2,6-dimethylqCc1ccc2nc(C)c 60 12840 http://www.s PHYSPROP
    18791 2,3,4,5,6-pen Clc1c(C)c(Cl)c( 224.8 12838 http://www.s PHYSPROP
    18792 1,2-dimethyli Cc2cc1ccccc1 56.5 12834 http://www.s PHYSPROP
    18793 benzene, (prop
    CCCSc1ccccc1 -45 12833 http://www.s PHYSPROP
    18794 benzoyl chloriCc1ccc(cc1)C( -3 12831 http://www.s PHYSPROP
    18795 2,4-dichlorob O=Cc1ccc(Cl)c 72 12830 http://www.s PHYSPROP
    18796 1,3-dimethyl- Cc1cc(C)ccc1C -62.9 12829 http://www.s PHYSPROP
    18797 p-chlorobenzyOCc1ccc(Cl)cc 75 12823 http://www.s PHYSPROP
    18798 p-aminobenzon
    N#Cc1ccc(N)c 84 12822 http://www.s PHYSPROP
    18799 m-cyanophenoN#Cc1cc(O)cc 80 12821 http://www.s PHYSPROP
    18800 benzonitrile, N#Cc1ccccc1C 46.3 12818 http://www.s PHYSPROP
    18801 n-methylpyrroO=C1CCCN1C -24 12814 http://www.s PHYSPROP
    18802 1-decene CCCCCCCCC=C -66.3 12809 http://www.s PHYSPROP
    18803 pentane, 1,1'-CCCCCSCCCCC -51.3 12810 http://www.s PHYSPROP
    18804 decene (mixtuCCCCCCCCC=C -94 12809 http://www.s PHYSPROP x Value clearly out of range EC
    18805 2-methylnonaCC(C)CCCCCC -74.6 12807 http://www.s PHYSPROP
    18806 n,n-diethyl-2 CCN(CC)CCCl 210.5 12794 http://www.s PHYSPROP
    18807 1-propene-1,1,N#CC(C#N)=C 171.5 12787 http://www.s PHYSPROP
    18808 sulfazamet Nc1ccc(cc1)S( 195 12761 http://www.s PHYSPROP
    18809 altrenogest O=C1C=C2CCC 120 12759 http://www.s PHYSPROP
    18810 2,4-bis((3-me CSc1nc(NCCC 55 12741 http://www.s PHYSPROP
    18811 lormetazepamClc3ccccc3C2= 206 12750 http://www.s PHYSPROP
    18812 diphenyl phosOP(=O)(Oc1cc 67.5 12722 http://www.s PHYSPROP
    18813 benzenepropano
    O=[N+]([O-])c 72 12721 http://www.s PHYSPROP
    18814 4-nitro-n-phe [O-][N+](=O)c 135.3 12712 http://www.s PHYSPROP
    18815 ametryne CSc1nc(NCC)n 88 12705 http://www.s PHYSPROP
    18816 3-methylphenCc2ccc3ccc1c 65 12700 http://www.s PHYSPROP
    18817 1-methylphenCc3cccc2c3cc 123 12699 http://www.s PHYSPROP
    18818 phenanthrene,Cc3cccc2ccc1 53.5 12698 http://www.s PHYSPROP
    18819 benzyl phenyl C(Sc1ccccc1)c 43.5 12697 http://www.s PHYSPROP
    18820 phenol, 4-pheOc2ccc(Oc1cc 84 12696 http://www.s PHYSPROP
    18821 (4-benzyl)chl Clc2ccc(Cc1cc 7.5 12695 http://www.s PHYSPROP
    18822 1-acetoxynap CC(=O)Oc2ccc 44.5 12691 http://www.s PHYSPROP
    18823 p-nitrophenyl O=C(C)Oc1ccc( 78 12687 http://www.s PHYSPROP
    18824 hydrazine, (peFc1c(F)c(F)c(F 75 12681 http://www.s PHYSPROP
    18825 adamantanecar
    O=C(O)C13CC2 174.5 12680 http://www.s PHYSPROP
    18826 2,6-dibromo-4Brc1cc(cc(Br) 207 12676 http://www.s PHYSPROP
    18827 naphthalene, C=Cc1ccc2ccc 66 12675 http://www.s PHYSPROP
    18828 phenyl cyclohc1cc(ccc1)C2 7.3 12674 http://www.s PHYSPROP
    18829 1,3,5-triazine-CN1C(=O)N(C) 176.5 12670 http://www.s PHYSPROP
    18830 2-methyl 8-quOc1cccc2ccc( 73.8 12669 http://www.s PHYSPROP
    18831 carbic anhydr O=C1OC(=O)C 164.5 12668 http://www.s PHYSPROP
    18832 4-piperidinoneO=C1CC(C)(C) 36 12665 http://www.s PHYSPROP
    18833 2,6,7-trioxa-1 CCC12COP(OC 53.7 12655 http://www.s PHYSPROP
    18834 2,6-diaminotoNc1cccc(N)c1 106 12650 http://www.s PHYSPROP
    18835 cyclohexanoneO=C1CCCCC1C 23 12648 http://www.s PHYSPROP
    18836 cyclohexane, 1ClC1CCCCC1Cl -1.5 12647 http://www.s PHYSPROP
    18837 1,3-dithiolaneS=C1SCCS1 35 12641 http://www.s PHYSPROP
    18838 hexamethylene
    O=C=N/CCCC -67 12637 http://www.s PHYSPROP
    18839 1h-imidazole, Cc1cncn1 56 12640 http://www.s PHYSPROP
    18840 1-undecene C=CCCCCCCCC -49.2 12635 http://www.s PHYSPROP
    18841 undecene (mixC=CCCCCCCCC -77 12635 http://www.s PHYSPROP
    18842 2-nonanone CCCCCCCC(C) -7.5 12632 http://www.s PHYSPROP
    18843 1,12-dodecaneO=C(O)CCCCC 127 12630 http://www.s PHYSPROP
    18844 diethyl glutar O=C(CCCC(=O -24.1 12610 http://www.s PHYSPROP
    18845 8-pentadecanCCCCCCCC(=O 43 12609 http://www.s PHYSPROP
    18846 3-pentanone, CC(C)(C)C(=O) -25.2 12600 http://www.s PHYSPROP
    18847 butanoic acid,CC(C)(C)C(=O 90.5 12598 http://www.s PHYSPROP
    18848 3-buten-2-oneC=C(C)C(C)=O -54 12591 http://www.s PHYSPROP
    18849 propane, 1,1,1CC(Cl)C(Cl)(Cl) -64 12579 http://www.s PHYSPROP
    18850 tributylphosp CCCCP(=O)(CC 64 12586 http://www.s PHYSPROP
    18851 1,1,1,2-tetraf FCC(F)(F)F -101 12577 http://www.s PHYSPROP
    18852 aceperone Fc1ccc(cc1)C 98.5 12570 http://www.s PHYSPROP
    18853 triphenylphosO=P(c1ccccc1) 156.5 12549 http://www.s PHYSPROP
    18854 9-phenyl-9h-f c1cccc3c1c2c 147 12545 http://www.s PHYSPROP
    18855 9,10-dimethylCc2c1ccccc1c( 183 12532 http://www.s PHYSPROP
    18856 9-methylanth Cc2c3ccccc3c 81.5 12524 http://www.s PHYSPROP
    18857 indole-3-acetiO=C(OCC)Cc2c 44.5 12523 http://www.s PHYSPROP
    18858 benzene, 1,1'-CC(C)(c1ccccc 29 12521 http://www.s PHYSPROP
    18859 9,10-dihydro c1ccc2CCc3cc 34.5 12515 http://www.s PHYSPROP
    18860 mandelic acid,OC(C(=O)OCC) 35 12508 http://www.s PHYSPROP
    18861 benzenesulfony
    Cc1cc(C)cc(C) 56 12504 http://www.s PHYSPROP
    18862 1-phenylcycl c1cc(ccc1)C= -11 12501 http://www.s PHYSPROP
    18863 pentafluorothFc1c(F)c(F)c(F -24 12500 http://www.s PHYSPROP
    18864 pentafluorophFc1c(F)c(F)c(F 32.8 12499 http://www.s PHYSPROP
    18865 benzene, 2-ethCc1cc(C)cc(C) -37 12494 http://www.s PHYSPROP
    18866 piperidine, 2, CC1(C)CCCC(C 28 12493 http://www.s PHYSPROP x all sources on Google -59C JCB
    18867 benzene, 3-buC=CCCc1ccccc -70 12491 http://www.s PHYSPROP
    18868 benzenamine,CC(C)Nc1cccc -10 12490 http://www.s PHYSPROP
    18869 p-cyanophenoN#Cc1ccc(O)c 111.5 12478 http://www.s PHYSPROP
    18870 2-amino-4,6-dCc1cc(C)nc(N) 152 12480 http://www.s PHYSPROP
    18871 formamide, n-O=CNC1CCCC 39.5 12476 http://www.s PHYSPROP
    18872 benzene, (metCSCc1ccccc1 -30 12475 http://www.s PHYSPROP
    18873 2,5-furandioneO=C1OC(=O)C 96 12469 http://www.s PHYSPROP
    18874 3-chlorobenzon
    N#Cc1cc(Cl)cc 41 12474 http://www.s PHYSPROP
    18875 1,2-cyclohexaO=C1CCCCC1 40 12465 http://www.s PHYSPROP
    18876 cyclopropyl mCC(=O)C1CC1 -68.3 12463 http://www.s PHYSPROP
    18877 1-eicosyne C#CCCCCCCCC 36 12460 http://www.s PHYSPROP
    18878 1-bromo-n-triBrCCCCCCCCC 6.2 12459 http://www.s PHYSPROP
    18879 1-decyne CCCCCCCCC#C -44 12456 http://www.s PHYSPROP
    18880 decane, 1-(et C=COCCCCCCC -41 12458 http://www.s PHYSPROP
    18881 2-butyn-1-ol CC#CCO -2.2 12450 http://www.s PHYSPROP
    18882 2-methyl-1-p C=C(C)CCC -135.7 12446 http://www.s PHYSPROP
    18883 1-pentene, 4, CC(C)(C)CC=C -136.6 12444 http://www.s PHYSPROP
    18884 1-chloro-2-fl ClCCF -50 12443 http://www.s PHYSPROP
    18885 butanamide, nCN(C)C(=O)CC -40 12433 http://www.s PHYSPROP
    18886 octylmalonic aO=C(O)C(CCCC 116 12432 http://www.s PHYSPROP
    18887 3,4-dichloro- C=CC(Cl)CCl -61 12431 http://www.s PHYSPROP
    18888 3-methyl-1-p C=CC(C)CC -153 12429 http://www.s PHYSPROP
    18889 2-ethyl-1-but C=C(CC)CC -131.5 12430 http://www.s PHYSPROP
    18890 propanamide,CN(C)C(=O)CC -45 12425 http://www.s PHYSPROP
    18891 propane, 1-chCC(C)(C)CCl -20 12416 http://www.s PHYSPROP
    18892 hexaethyl tet CCOP(=O)(OP( -40 12420 http://www.s PHYSPROP
    18893 bensulide O=S(=O)(NCCS 34.4 12397 http://www.s PHYSPROP
    18894 2,4,6-tri(tert CC(C)(C)c1cc(c 131 12368 http://www.s PHYSPROP
    18895 tolyfluanide CN(C)S(=O)(=O 96 12364 http://www.s PHYSPROP
    18896 phosmet COP(=S)(OC)S 72 12367 http://www.s PHYSPROP
    18897 sulfamoxole Cc2nc(NS(=O)( 193 12361 http://www.s PHYSPROP
    18898 4-((4-nitroph [O-][N+](=O)c 215 12362 http://www.s PHYSPROP
    18899 benzoic acid, FC(F)(F)c1cc(c 92.5 12356 http://www.s PHYSPROP x All other sources support 140-144 - EC
    18900 1,3,4-oxadiazoc1ccc(cc1)c2n 139 12355 http://www.s PHYSPROP
    18901 2-amino-5-ch Nc2ccc(Cl)cc2 99 12339 http://www.s PHYSPROP
    18902 2,6-bis(t-buty CC(C)(C)C1=C 66 12336 http://www.s PHYSPROP
    18903 1,3,5-triisop CC(C)c1cc(cc( -7.4 12329 http://www.s PHYSPROP
    18904 delta-dodecalO=C1CCCC(CC -12 12314 http://www.s PHYSPROP
    18905 6-nitropiperon[O-][N+](=O) 93.5 12310 http://www.s PHYSPROP
    18906 cyclohexylpheO=C(c1ccccc1 56 12307 http://www.s PHYSPROP
    18907 1-naphthaleneO=Cc1c2ccccc 83 12291 http://www.s PHYSPROP
    18908 cyclopentene,FC1(F)C(Cl)=C( -105.8 12287 http://www.s PHYSPROP
    18909 octachlorocycClC1(Cl)C(Cl)=C 40 12286 http://www.s PHYSPROP
    18910 ethanone, 1-(1CC(=O)c2cnc1 192.3 12275 http://www.s PHYSPROP
    18911 diethadione CCC1(CC)COC 97.5 12271 http://www.s PHYSPROP
    18912 5-methyl-2-niO=[N+]([O-])c 53 12263 http://www.s PHYSPROP
    18913 pentamethylbCc1cc(C)c(C)c 54.5 12259 http://www.s PHYSPROP
    18914 3-ethyl-5-metCCc1cc(C)cc(O 51.6 12250 http://www.s PHYSPROP
    18915 5-nitro-2-fur O=Cc1ccc(o1)[ 35.5 12249 http://www.s PHYSPROP
    18916 2,3,5-trimeth Cc1cc(C)cc(O) 93.5 12244 http://www.s PHYSPROP
    18917 2,6-dichlorob O=C1C=C(Cl)C 123 12246 http://www.s PHYSPROP
    18918 cyclobutene, FC1=C(F)C(F)( -60 12242 http://www.s PHYSPROP
    18919 cyclooctanol OC1CCCCCCC1 25.1 12241 http://www.s PHYSPROP
    18920 isopropylcycl CC(C)C1CCCC -89.4 12239 http://www.s PHYSPROP
    18921 2-methyl-5-ni[O-][N+](=O)c 253 12236 http://www.s PHYSPROP
    18922 2(3h)-furanonO=C1CCC(CC) -18 12232 http://www.s PHYSPROP
    18923 2(1h)-pyridin O=C1C=CC=CN 31 12231 http://www.s PHYSPROP
    18924 2-bromochlorClc1ccccc1Br -12.3 12230 http://www.s PHYSPROP
    18925 pyridine, 1-ox[O-][n+]1cccc 65.5 12229 http://www.s PHYSPROP
    18926 pyridine, 1,2, C1C=CCCN1 -48 12226 http://www.s PHYSPROP
    18927 1h-imidazole, Cc1nccn1 144 12225 http://www.s PHYSPROP
    18928 cyclopentene,CC1=CCCC1 -126.5 12222 http://www.s PHYSPROP
    18929 1-bromoundeBrCCCCCCCCC -9 12221 http://www.s PHYSPROP
    18930 di-n-pentylethCCCCCOCCCC -69 12220 http://www.s PHYSPROP
    18931 2-decanone CC(=O)CCCCC 14 12218 http://www.s PHYSPROP
    18932 distearyl thio O=C(OCCCCCC 66 12215 http://www.s PHYSPROP
    18933 dodecanedioicO=C(O)CCCCC 128 12213 http://www.s PHYSPROP
    18934 1-hexyne C#CCCCC -131.9 12209 http://www.s PHYSPROP
    18935 10-undecenoicO=C(CCCCCCC -38 12206 http://www.s PHYSPROP
    18936 hfc-236fa (cf3FC(F)(F)CC(F)( -94.2 12199 http://www.s PHYSPROP
    18937 4-methyl-1-p CC(C)CC=C -153.6 12201 http://www.s PHYSPROP
    18938 hadacidin O=C(O)CN(O) 119.5 12194 http://www.s PHYSPROP
    18939 acetamide, 2,2ClC(Cl)C(N)=O 99.4 12173 http://www.s PHYSPROP
    18940 glutaric acid, CC(C)(CCC(O) 84 12160 http://www.s PHYSPROP
    18941 tetramethoxy CO[Si](OC)(O -2 12161 http://www.s PHYSPROP
    18942 hexamethylphCN(C)P(=O)(N( 7.2 12158 http://www.s PHYSPROP
    18943 methyl phosphCP(Cl)(Cl)=O 36 12150 http://www.s PHYSPROP
    18944 pentane, dodeFC(F)(C(F)(F)C( -100 12154 http://www.s PHYSPROP
    18945 delta-valerol O=C1CCCCN1 39.5 12144 http://www.s PHYSPROP
    18946 2,4,6-trifluoroFc1nc(F)nc(F) -38 12143 http://www.s PHYSPROP
    18947 diketene C=C1CC(=O)O -6.5 12140 http://www.s PHYSPROP
    18948 2h-pyran-2-onCC1=CC(C)=CC 51.5 12141 http://www.s PHYSPROP
    18949 2-azacyclooct O=C1CCCCCC 36.5 12136 http://www.s PHYSPROP
    18950 2h-pyran-2-onCOC=1C=C(C) 86 12130 http://www.s PHYSPROP
    18951 ethenetetracarN#CC(C#N)=C 199 12114 http://www.s PHYSPROP
    18952 tolcyclamide O=C(NC1CCCCC 175 12107 http://www.s PHYSPROP
    18953 1-fluoroheptaCCCCCCCF -73 12099 http://www.s PHYSPROP
    18954 1-docosanol CCCCCCCCCCC 72.5 12100 http://www.s PHYSPROP
    18955 thozalinone CN(C)C1=NC(= 134.5 12082 http://www.s PHYSPROP
    18956 2,3-diaminop Nc2ccc1nc3cc 264 12085 http://www.s PHYSPROP
    18957 tetracosane CCCCCCCCCCC 54 12072 http://www.s PHYSPROP
    18958 dihydroequili Oc3cc4CC=C2C 174.5 12075 http://www.s PHYSPROP
    18959 nonadecanoicO=C(O)CCCCC 69.4 12071 http://www.s PHYSPROP
    18960 heptanedinitriN#CCCCCCC# -31.4 12070 http://www.s PHYSPROP
    18961 1,3-dioxalane C1COCO1 -95 12066 http://www.s PHYSPROP
    18962 4-methylpentaCC(C)CCC(=O) -33 12067 http://www.s PHYSPROP
    18963 benzylacetonitN#CCCc1ccccc -1 12061 http://www.s PHYSPROP
    18964 4-propylphenoOc1ccc(CCC)c 22 12060 http://www.s PHYSPROP
    18965 5-nitro-2-furoOC(=O)c1ccc(o 186 12057 http://www.s PHYSPROP
    18966 isovanillic aci Oc1cc(ccc1OC 251.5 12055 http://www.s PHYSPROP
    18967 phosphonous CdlP(Cl)c1ccccc -51 12053 http://www.s PHYSPROP
    18968 o-propylphenoOc1ccccc1CCC 7 12050 http://www.s PHYSPROP
    18969 dimetilan O=C(N(C)C)n1 69.5 12052 http://www.s PHYSPROP
    18970 acetyl benzoyCC(=O)OOC(=O 37 12048 http://www.s PHYSPROP
    18971 disulfide, dib O=C(SSC(=O)c1 134.5 12049 http://www.s PHYSPROP
    18972 4-methyl-1,1' Cc1ccc(cc1)c2 49.5 12047 http://www.s PHYSPROP
    18973 3-methylbipheCc1cccc(c1)c2 4.5 12045 http://www.s PHYSPROP
    18974 2-methylbipheCc2ccccc2c1cc -0.2 12044 http://www.s PHYSPROP
    18975 dinitrophenyl [O-][N+](=O)C 172 12043 http://www.s PHYSPROP
    18976 aminometradiO=C1N(CC=C) 143 12033 http://www.s PHYSPROP
    18977 1,1':2',1'':2'' c1cccc(c1c2cc 118.5 12031 http://www.s PHYSPROP
    18978 allopregnane CCC2CCC3C4C 84.5 12029 http://www.s PHYSPROP
    18979 pregnane, (5.bCCC2CCC3C4C 83.5 12029 http://www.s PHYSPROP
    18980 fluoroacetamiFCC(N)=O 108 12025 http://www.s PHYSPROP
    18981 benzenesulfonCc1ccc(cc1)S( 78.5 12026 http://www.s PHYSPROP
    18982 tricosane CCCCCCCCCCC 47.6 12017 http://www.s PHYSPROP
    18983 triacontane CCCCCCCCCCC 65.8 12018 http://www.s PHYSPROP
    18984 octadecanenitCCCCCCCCCCC 41 12015 http://www.s PHYSPROP
    18985 tridecanoic acO=C(O)CCCCC 44.5 12013 http://www.s PHYSPROP
    18986 ethyl butylsul CCSCCCC -95.1 12011 http://www.s PHYSPROP
    18987 formic acid, p O=COCCCCC -73.5 12012 http://www.s PHYSPROP
    18988 1-iodohexaneCCCCCCI -74.2 12010 http://www.s PHYSPROP
    18989 4h-1,3,5-dithi CC1NC(C)SC(C 46 12001 http://www.s PHYSPROP
    18990 2,5-dimethylt Cc1ccc(C)s1 -62.6 11998 http://www.s PHYSPROP
    18991 ethyl t-butyl CC(C)(C)OCC -94 11996 http://www.s PHYSPROP
    18992 2-iodopentan CC(I)CCC -50 11997 http://www.s PHYSPROP
    18993 propanoic acidO=C(Oc1ccccc 20 11984 http://www.s PHYSPROP
    18994 1,4-cyclohexaO=C1CCC(=O) 78 11995 http://www.s PHYSPROP
    18995 benzene, 1-iodIc1ccc(cc1)[N+ 174.7 11982 http://www.s PHYSPROP
    18996 1,3-benzenedic
    O=C(OCC)c1cc 11.5 11979 http://www.s PHYSPROP
    18997 4-hydroxyisoph
    OC(=O)c1cc(c 310 11978 http://www.s PHYSPROP
    18998 2-methylpyrroCc1cccn1 -35.6 11977 http://www.s PHYSPROP
    18999 1,2,4,5-tetra Ic1cc(I)c(I)cc1I 254 11976 http://www.s PHYSPROP
    19000 1,2,4,5-tetra Brc1cc(Br)c(Br 182 11974 http://www.s PHYSPROP
    19001 1,4-benzenedic
    O=C(OCC)c1cc 44 11972 http://www.s PHYSPROP
    19002 benzaldehyde,Oc1ccc(Cl)cc 100.3 11971 http://www.s PHYSPROP
    19003 pyrrole, 1-phec1ccc(cc1)n2c 62 11970 http://www.s PHYSPROP
    19004 1,2-benzenedio
    O=C(C)Oc1ccc 64.5 11969 http://www.s PHYSPROP
    19005 trimetozine O=C(c1cc(OC) 121 11968 http://www.s PHYSPROP
    19006 benzenamine,O=[N+]([O-])c 103 11967 http://www.s PHYSPROP
    19007 4,5,6,7-tetra O=C1OC(=O)C 74 11965 http://www.s PHYSPROP
    19008 2,4,6-trichlor Clc1cc(Cl)cc(C 78.5 11961 http://www.s PHYSPROP
    19009 urea, n,n-diet CCN(CC)C(N)= 75 11962 http://www.s PHYSPROP
    19010 1,2,3,5-tetra Ic1cc(I)c(I)c(I) 148 11960 http://www.s PHYSPROP
    19011 3,4,5-trichlor Nc1cc(Cl)c(Cl) 99 11959 http://www.s PHYSPROP
    19012 1,2,3,4-tetra Ic1ccc(I)c(I)c1I 136 11955 http://www.s PHYSPROP
    19013 2,3,4-trichlor Nc1ccc(Cl)c(Cl 73 11954 http://www.s PHYSPROP
    19014 1-bromoanthrO=C3c1ccccc1 186.5 11937 http://www.s PHYSPROP
    19015 4,5,6,7-tetra O=C1OC(=O)c2c 275 11936 http://www.s PHYSPROP
    19016 benzoic acid, OS(=O)(=O)c1 141 11931 http://www.s PHYSPROP
    19017 acetic acid, d BrC(Br)C(=O) 49 11926 http://www.s PHYSPROP
    19018 urea, trimethyCN(C)C(=O)NC 75.5 11928 http://www.s PHYSPROP
    19019 tetramethylurCN(C)C(=O)N( -1.2 11930 http://www.s PHYSPROP
    19020 tetraphenylm c1ccccc1C(c2c 282 11917 http://www.s PHYSPROP
    19021 tetraethylsila CC[Si](CC)(CC -82.5 11919 http://www.s PHYSPROP
    19022 1,1,1,2-tetra ClCC(Cl)(Cl)Cl -70.2 11911 http://www.s PHYSPROP
    19023 trimethylacetoCC(C)(C)C#N 15 11909 http://www.s PHYSPROP
    19024 pivalaldehydeCC(C)(C)C=O 6 11910 http://www.s PHYSPROP
    19025 hexatriacontaCCCCCCCCCCC 76.5 11906 http://www.s PHYSPROP
    19026 n-pentatriaco CCCCCCCCCCC 75 11907 http://www.s PHYSPROP
    19027 hentriacontanCCCCCCCCCCC 67.9 11904 http://www.s PHYSPROP
    19028 tritriacontaneCCCCCCCCCCC 72 11905 http://www.s PHYSPROP
    19029 nonacosane CCCCCCCCCCC 63.7 11903 http://www.s PHYSPROP
    19030 octacosane CCCCCCCCCCC 64.5 11902 http://www.s PHYSPROP
    19031 pentacosane CCCCCCCCCCC 54 11900 http://www.s PHYSPROP
    19032 hexacosane CCCCCCCCCCC 56.4 11901 http://www.s PHYSPROP
    19033 docosane CCCCCCCCCCC 44.4 11899 http://www.s PHYSPROP
    19034 1-eicosanol CCCCCCCCCCC 66.1 11898 http://www.s PHYSPROP
    19035 heneicosane CCCCCCCCCCC 40.5 11897 http://www.s PHYSPROP
    19036 1-iodooctade CCCCCCCCCCC 34 11896 http://www.s PHYSPROP
    19037 nonadecane CCCCCCCCCCC 32.1 11895 http://www.s PHYSPROP
    19038 heptadecane CCCCCCCCCCC 22 11892 http://www.s PHYSPROP
    19039 octane, 1,1'-oCCCCCCCCOCC -7.6 11893 http://www.s PHYSPROP
    19040 1-pentadecanCCCCCCCCCCC 45.5 11891 http://www.s PHYSPROP
    19041 1-hexadecyneCCCCCCCCCCC 15 11890 http://www.s PHYSPROP
    19042 1-hexadeceneCCCCCCCCCCC 4.1 11889 http://www.s PHYSPROP
    19043 1-bromopentaBrCCCCCCCCC 19 11888 http://www.s PHYSPROP
    19044 n-pentadecanCCCCCCCCCCC 9.9 11885 http://www.s PHYSPROP
    19045 1-hexadecanolCC(=O)OCCCC -18.5 11887 http://www.s PHYSPROP
    19046 tridecanenitri CCCCCCCCCCC 9.7 11884 http://www.s PHYSPROP
    19047 n-tridecane CCCCCCCCCCC -5.3 11882 http://www.s PHYSPROP
    19048 tetradecane CCCCCCCCCCC 5.8 11883 http://www.s PHYSPROP
    19049 octanedinitril N#CCCCCCCC -3.5 11879 http://www.s PHYSPROP
    19050 1,7-heptanediOCCCCCCCO 22.5 11875 http://www.s PHYSPROP
    19051 4,5-dithiaoct CCCSSCCC -85.6 11871 http://www.s PHYSPROP
    19052 1-iodooctane CCCCCCCCI -45.7 11874 http://www.s PHYSPROP
    19053 hexane, 1,6-diICCCCCCI 9.5 11867 http://www.s PHYSPROP
    19054 1-chloroheptaCCCCCCCCl -69.5 11865 http://www.s PHYSPROP
    19055 1-octyne C#CCCCCCC -79.3 11864 http://www.s PHYSPROP
    19056 hexane, 1,6-d BrCCCCCCBr -2.3 11862 http://www.s PHYSPROP
    19057 1-bromohept BrCCCCCCC -58 11863 http://www.s PHYSPROP
    19058 2-nonanol CCCCCCCC(C) -35.5 11861 http://www.s PHYSPROP
    19059 ethyl palmitatO=C(CCCCCCC 24 11860 http://www.s PHYSPROP
    19060 cycloheptene C1CC=CCCC1 -56 11857 http://www.s PHYSPROP
    19061 pentane, 1,5-dICCCCCI 9 11848 http://www.s PHYSPROP
    19062 butyl ethyl et CCOCCCC -124 11849 http://www.s PHYSPROP
    19063 1-heptyne CCCCCC#C -81 11845 http://www.s PHYSPROP
    19064 hexanenitrile CCCCCC#N -80.3 11846 http://www.s PHYSPROP
    19065 n-amyl acetatCC(=O)OCCCC -70.8 11843 http://www.s PHYSPROP
    19066 diformylhydraO=CNNC=O 156 11837 http://www.s PHYSPROP
    19067 1,4-cyclohexaC1=CCC=CC1 -49.2 11838 http://www.s PHYSPROP
    19068 ethyl propyl eCCOCCC -127.5 11835 http://www.s PHYSPROP
    19069 methyl n-butyCCCCOC -115.5 11833 http://www.s PHYSPROP
    19070 2-thiahexane CCCCSC -97.8 11834 http://www.s PHYSPROP
    19071 butane, 1,4-diICCCCI 5.8 11832 http://www.s PHYSPROP
    19072 hexanamide CCCCCC(N)=O 101 11827 http://www.s PHYSPROP
    19073 1-iodopentan CCCCCI -85.6 11830 http://www.s PHYSPROP
    19074 hexanedioic acO=C(CCCCC(= 10.3 11824 http://www.s PHYSPROP
    19075 hexanedioic aO=C(CCCCC(= 9 11823 http://www.s PHYSPROP
    19076 2,5-dimethyl- C=C(C)CCC(=C -75.6 11818 http://www.s PHYSPROP
    19077 ethyl undecanO=C(CCCCCCC -15 11822 http://www.s PHYSPROP
    19078 1,1'-thiobiset C=CSC=C 20 11817 http://www.s PHYSPROP
    19079 propane, 1,3-dICCCI -20 11810 http://www.s PHYSPROP
    19080 2-pentyne CC#CCC -109.3 11807 http://www.s PHYSPROP
    19081 1-propylnitrat[O-][N+](=O) -100 11804 http://www.s PHYSPROP
    19082 1-pentyne CCCC#C -90 11806 http://www.s PHYSPROP
    19083 1-nitrobutane[O-][N+](=O) -81.33 11799 http://www.s PHYSPROP
    19084 o-propylcarb NC(=O)OCCC 60 11803 http://www.s PHYSPROP
    19085 butanoic acid,ClCCCC(=O)O 16 11797 http://www.s PHYSPROP
    19086 pentanamide CCCCC(N)=O 106 11795 http://www.s PHYSPROP
    19087 n-butyl hexanO=C(CCCCC)O -64.3 11791 http://www.s PHYSPROP
    19088 propyl hexanoO=C(CCCCC)O -68.7 11790 http://www.s PHYSPROP
    19089 hexanedioic acOC(=O)CCC(C) 101 11789 http://www.s PHYSPROP
    19090 4-chloropyrid Clc1ccncc1 -43.5 11785 http://www.s PHYSPROP
    19091 4-hydroxypyriOc1ccncc1 149.8 11787 http://www.s PHYSPROP
    19092 3-bromopyridBrc1cccnc1 -27.3 11783 http://www.s PHYSPROP
    19093 3-methylglutarCC(CC(O)=O)C 87 11781 http://www.s PHYSPROP
    19094 2,4,6-heptaneCC(=O)CC(=O) 49 11782 http://www.s PHYSPROP
    19095 1,3,5-triiodo Ic1cc(I)cc(I)c1 184.2 11779 http://www.s PHYSPROP
    19096 3,5-dichloroanNc1cc(Cl)cc(Cl 52 11778 http://www.s PHYSPROP
    19097 3,5-dibromopOc1cc(Br)cc(B 81 11777 http://www.s PHYSPROP
    19098 2-pentanol acCC(=O)OC(C)C -100 11775 http://www.s PHYSPROP
    19099 1,3,5-tribrom Brc1cc(Br)cc(B 122.8 11776 http://www.s PHYSPROP
    19100 1,3-dicyanob N#Cc1cccc(C# 162 11773 http://www.s PHYSPROP
    19101 3-iodophenol Ic1cccc(O)c1 118 11769 http://www.s PHYSPROP
    19102 2,4-dihydroxyOc1ccnc(O)c1 278 11770 http://www.s PHYSPROP
    19103 benzenamine,Ic1cccc(N)c1 33 11768 http://www.s PHYSPROP
    19104 benzene, 1-io Cc1cc(I)ccc1 -27.2 11765 http://www.s PHYSPROP
    19105 furan, 2,5-dimCc1ccc(C)o1 -62.8 11763 http://www.s PHYSPROP
    19106 2,5-dimethylpCc1ccc(C)n1 7.7 11762 http://www.s PHYSPROP
    19107 2,4-dimethyl- CC(C)SC(C)C -78.1 11761 http://www.s PHYSPROP
    19108 2-pentene, 2, CC(C)=C/C(C)C -127.7 11757 http://www.s PHYSPROP
    19109 diacetamide CC(=O)NC(C)= 79 11760 http://www.s PHYSPROP
    19110 ethylnitrate [O-][N+](=O) -94.6 11756 http://www.s PHYSPROP
    19111 isopropyl for CC(C)OC=O -80 11755 http://www.s PHYSPROP
    19112 2-nitroethano[O-][N+](=O) -80 11751 http://www.s PHYSPROP
    19113 ethylurea NC(=O)NCC 92.5 11753 http://www.s PHYSPROP
    19114 2-chloropentaCC(Cl)CCC -80 11744 http://www.s PHYSPROP
    19115 methoxyaceticO=C(O)COC 7.7 11750 http://www.s PHYSPROP
    19116 2-methyl-2-p C/C(C)=CCC -135 11742 http://www.s PHYSPROP
    19117 butanenitrile, CC(C)CC#N -101 11743 http://www.s PHYSPROP
    19118 2-methyl-2-heCC(C)(O)CCCC -50.4 11741 http://www.s PHYSPROP
    19119 dimethyldisulfCSSC -85 11731 http://www.s PHYSPROP
    19120 3,3-dimethyl- CC(C)(C)CCO -60 11732 http://www.s PHYSPROP
    19121 ethyl methyl sCCSC -105.9 11729 http://www.s PHYSPROP
    19122 methylnitrite CON=O -16 11730 http://www.s PHYSPROP
    19123 n-formylhydraNNC=O 55 11728 http://www.s PHYSPROP
    19124 methylisocyanCN=C=O -45 11727 http://www.s PHYSPROP
    19125 ethane, 1,2-diICCI 83 11723 http://www.s PHYSPROP
    19126 n-hydroxymetNC=NO 114.5 11726 http://www.s PHYSPROP
    19127 glycerol, 1-nit[O-][N+](=O) 61 11711 http://www.s PHYSPROP
    19128 amyl propionaO=C(CC)OCCC -73.1 11716 http://www.s PHYSPROP
    19129 1,4-diiodobenIc1ccc(I)cc1 131.5 11708 http://www.s PHYSPROP
    19130 benzene, 1-io Cc1ccc(I)cc1 36.5 11707 http://www.s PHYSPROP
    19131 4-decanone CCCCCCC(=O) -9 11703 http://www.s PHYSPROP
    19132 urea, n,n'-dietCCNC(=O)NCC 112.5 11694 http://www.s PHYSPROP
    19133 1,2,3-propanetO=[N+]([O-]) 26 11700 http://www.s PHYSPROP
    19134 diazoacetic esN#N=CC(=O)O -22 11692 http://www.s PHYSPROP
    19135 1,4-benzenedO=Cc1ccc(C=O 117 11673 http://www.s PHYSPROP
    19136 methylbutyra CCCC(=O)OC -85.8 11680 http://www.s PHYSPROP
    19137 1,4-benzenediN#Cc1ccc(C#N 224 11672 http://www.s PHYSPROP
    19138 benzene, 1,4- ClCc1ccc(CCl) 100 11671 http://www.s PHYSPROP
    19139 benzonitrile, N#Cc1ccc(Cl)c 95 11663 http://www.s PHYSPROP
    19140 4-bromobenzon
    N#Cc1ccc(Br)c 114 11662 http://www.s PHYSPROP
    19141 p-ethyltoluen Cc1ccc(CC)cc1 -62.3 11660 http://www.s PHYSPROP
    19142 p-methylstyreCc1ccc(C=C)cc -34.1 11661 http://www.s PHYSPROP
    19143 hydrazine, (4 NNc1ccc(Br)c 108 11658 http://www.s PHYSPROP
    19144 phenylpropyl CCCOc1ccccc1 -27 11655 http://www.s PHYSPROP
    19145 p-ethoxyphenCCOc1ccc(O)c 66.5 11651 http://www.s PHYSPROP
    19146 4-methylpheny
    S=C=Nc1ccc(C 25.5 11650 http://www.s PHYSPROP
    19147 cyclohexyl aceO=C(C)OC1CC -65 11647 http://www.s PHYSPROP
    19148 2-propanol, 1 OC(COc1ccccc 81.5 11641 http://www.s PHYSPROP
    19149 benzenamine,Nc2ccc(CCc1cc
    4 137 11640 http://www.s PHYSPROP
    19150 o-benzyl carb NC(=O)OCc1cc 88 11638 http://www.s PHYSPROP
    19151 2-benzyl benzc1cccc2nc(nc1 187 11634 http://www.s PHYSPROP
    19152 tricaproin O=C(CCCCC)O -60 11633 http://www.s PHYSPROP
    19153 isovanillin Oc1cc(ccc1OC 114 11629 http://www.s PHYSPROP
    19154 3-ethoxybenzoCCOc1cc(ccc1 137 11628 http://www.s PHYSPROP
    19155 3-nitrophenylaO=[N+]([O-])c 63 11627 http://www.s PHYSPROP
    19156 m-hydroxyphen
    Oc1cc(CC(=O) 132 11624 http://www.s PHYSPROP
    19157 m-hydroxyacetOc1cccc(NC(C 147 11626 http://www.s PHYSPROP
    19158 caprylanilide O=C(Nc1ccccc 95 11620 http://www.s PHYSPROP
    19159 3-benzylpyrid c1ccccc1Cc2c 34 11615 http://www.s PHYSPROP
    19160 benzene, 1,1'-O=S(Cc1ccccc 134 11618 http://www.s PHYSPROP
    19161 4-nitro diphen[O-][N+](=O)c 61 11613 http://www.s PHYSPROP
    19162 4,4'-dihydrox Oc2ccc(Cc1ccc 162.5 11614 http://www.s PHYSPROP
    19163 acetic acid, chO=C(Oc1ccccc 44.5 11611 http://www.s PHYSPROP
    19164 propionanilid O=C(Nc1ccccc 105.5 11610 http://www.s PHYSPROP
    19165 benzonitrile, N#Cc1cccc(C) -23 11607 http://www.s PHYSPROP
    19166 m-ethylphenoCCc1cc(O)ccc -4 11604 http://www.s PHYSPROP
    19167 m-ethyltoluenCc1cccc(CC)c1 -95.5 11603 http://www.s PHYSPROP
    19168 benzyl iodide ICc1ccccc1 24.5 11601 http://www.s PHYSPROP
    19169 p-ethoxybenzoCCOc1ccc(cc1 198 11596 http://www.s PHYSPROP
    19170 4-dimethylamiCN(C)c1ccc(cc 242.5 11595 http://www.s PHYSPROP
    19171 4-nitrobenza O=[N+]([O-])c 200 11594 http://www.s PHYSPROP
    19172 1-nitro-4-cya O=[N+]([O-])c 147.5 11593 http://www.s PHYSPROP
    19173 4-ethylbenzoicCCc1ccc(cc1) 112.5 11589 http://www.s PHYSPROP
    19174 4-iodobenzoicOC(=O)c1ccc(I 270 11588 http://www.s PHYSPROP
    19175 methyl p-nitr O=[N+]([O-])c 95 11586 http://www.s PHYSPROP
    19176 4-chlorobenz O=C(N)c1ccc(C 174 11587 http://www.s PHYSPROP
    19177 methyl p-ami Nc1ccc(cc1)C 110.5 11585 http://www.s PHYSPROP
    19178 3-cyano-1-nit O=[N+]([O-])c 116 11582 http://www.s PHYSPROP
    19179 benzoic acid, Brc1ccc(cc1)C 81 11584 http://www.s PHYSPROP
    19180 benzene, 1-(chO=[N+]([O-])c 46 11581 http://www.s PHYSPROP
    19181 3-formylbenzoOC(=O)c1cccc 174 11580 http://www.s PHYSPROP
    19182 4-formylbenzoOC(=O)c1cccc 247 11580 http://www.s PHYSPROP x wrong isomer JCB
    19183 2,5-dinitrotol Cc1cc(ccc1[N+ 52.5 11578 http://www.s PHYSPROP
    19184 3,4-dimethylbCc1ccc(cc1C) 165 11576 http://www.s PHYSPROP
    19185 methyl 3-bro Brc1cc(ccc1)C 32 11573 http://www.s PHYSPROP
    19186 3,5-dinitrotol O=[N+]([O-])c 93 11570 http://www.s PHYSPROP
    19187 3,5-dinitroani O=[N+]([O-])c 163 11571 http://www.s PHYSPROP
    19188 2,6-dichloro-4Clc1cc(cc(Cl)c 127 11569 http://www.s PHYSPROP
    19189 benzoic acid, Ic1cc(cc(I)c1 237 11568 http://www.s PHYSPROP
    19190 benzene, 1,3-dClc1cc(cc(Cl)c 65.4 11567 http://www.s PHYSPROP
    19191 benzoic acid, Nc1cc(cc(N)c1 228 11565 http://www.s PHYSPROP
    19192 m-isopropylphCC(C)c1cc(O)c 26 11562 http://www.s PHYSPROP
    19193 3-iodobenzoicOC(=O)c1cc(I) 188.3 11563 http://www.s PHYSPROP
    19194 piperidine, 1- CC(=O)N1CCC -13.4 11561 http://www.s PHYSPROP
    19195 benzenesulfiniO=S(O)c1cccc 84 11560 http://www.s PHYSPROP
    19196 benzoyl bromBrC(=O)c1cccc -24 11559 http://www.s PHYSPROP
    19197 2-phenyl isop CC(O)(C)c1ccc 36 11556 http://www.s PHYSPROP
    19198 triethylsilane CC[SiH](CC)CC -157 11555 http://www.s PHYSPROP
    19199 diethylcyanamN#CN(CC)CC -80.6 11553 http://www.s PHYSPROP
    19200 3-ethylpentanCCC(CC)CC -118.6 11551 http://www.s PHYSPROP
    19201 propanoic acidCC(=O)C(=O)O -50 11544 http://www.s PHYSPROP
    19202 benzoic acid, Oc1ccc(cc1OC 44 11541 http://www.s PHYSPROP
    19203 4-hydroxy-3-nO=[N+]([O-])c 230 11538 http://www.s PHYSPROP
    19204 2-benzylmalo O=C(O)C(Cc1c 121 11536 http://www.s PHYSPROP
    19205 trimecain O=C(Nc1c(C)c 44 11533 http://www.s PHYSPROP
    19206 pyrrolidone O=C1CCCN1 23 11530 http://www.s PHYSPROP
    19207 ethanamine, nCCN(C)CC -196 11527 http://www.s PHYSPROP
    19208 3-methylpyrroCc1ccnc1 -48.4 11528 http://www.s PHYSPROP
    19209 3-chloropentaCCC(Cl)CC -105 11521 http://www.s PHYSPROP
    19210 carbonic acid,O=C(OC)OC 3 11526 http://www.s PHYSPROP
    19211 2,5-furandionO=C1C=C(C)C 7.5 11517 http://www.s PHYSPROP
    19212 1-methyluraciO=C1C=CN(C) 237 11514 http://www.s PHYSPROP
    19213 dithiooxalic acS=C(OCC)C(=S 27 11515 http://www.s PHYSPROP
    19214 5-methyl-2-chCc1ccc(Cl)c(O 56 11513 http://www.s PHYSPROP
    19215 phenol, 2-chl Cc1ccc(Cl)c(O 45.5 11513 http://www.s PHYSPROP
    19216 benzenamine,Cc1cc(Cl)c(N) 7 11512 http://www.s PHYSPROP
    19217 benzene, 1,4- Brc1ccc(Br)c(C 5.6 11511 http://www.s PHYSPROP
    19218 2,4-dibromoanBrc1cc(Br)c(N 79.5 11509 http://www.s PHYSPROP
    19219 2,4-dibromopBrc1cc(Br)c(O 38 11510 http://www.s PHYSPROP
    19220 1,2,4-tribrom Brc1cc(Br)c(Br 44.5 11507 http://www.s PHYSPROP
    19221 2-iodoaniline Ic1ccccc1N 56.5 11500 http://www.s PHYSPROP
    19222 1,2-diiodobenIc1ccccc1I 27 11499 http://www.s PHYSPROP
    19223 benzothiazole,Clc1nc2ccccc2 24 11492 http://www.s PHYSPROP
    19224 2-methylthiobCSc1nc2ccccc 44 11494 http://www.s PHYSPROP
    19225 benzoxazole, Clc1nc2ccccc 7 11491 http://www.s PHYSPROP
    19226 2h-inden-2-onO=C1Cc2ccccc 59 11488 http://www.s PHYSPROP
    19227 2-methylbenaCc1nc2ccccc2 176.5 11489 http://www.s PHYSPROP
    19228 furoic acid, et CCOC(=O)c1cc 34.5 11485 http://www.s PHYSPROP
    19229 1h-benzimidazCc1cc2ncnc2c 115.5 11484 http://www.s PHYSPROP
    19230 5-methylindolCc1cc2ccnc2c 60 11483 http://www.s PHYSPROP
    19231 2,4 diaminoanNc1cc(N)ccc1 67.5 11481 http://www.s PHYSPROP
    19232 o-hydroxyacetOc1ccccc1NC( 208 11477 http://www.s PHYSPROP
    19233 o-hydroxyphen
    Oc1ccccc1CC( 148 11476 http://www.s PHYSPROP
    19234 o-chlorophenoClc1ccccc1OC 148.5 11475 http://www.s PHYSPROP
    19235 benzoyl t-butyCC(C)(C)OOC( 8 11472 http://www.s PHYSPROP
    19236 n-methyl-n-n O=NN(C)c1ccc 14.7 11463 http://www.s PHYSPROP
    19237 benzoic acid, O=C(Oc1ccc(C) 71.5 11468 http://www.s PHYSPROP
    19238 benzoyl hydraO=C(NN)c1ccc 115 11461 http://www.s PHYSPROP
    19239 n-methylbenzO=C(NC)c1ccc 82 11460 http://www.s PHYSPROP
    19240 benzeneacetoni
    O=C(C#N)c1cc 32.5 11459 http://www.s PHYSPROP
    19241 7-nitroquinoli[O-][N+](=O)c 132.5 11452 http://www.s PHYSPROP
    19242 naphthalene, c1cc3ccccc3cc 58 11454 http://www.s PHYSPROP
    19243 6-nitroquinoli[O-][N+](=O)c 153.5 11451 http://www.s PHYSPROP
    19244 4-methoxybipCOc1ccc(cc1)c 90 11449 http://www.s PHYSPROP
    19245 2-naphthaleneN#Cc1ccc2ccc 66 11450 http://www.s PHYSPROP
    19246 9,10-dihydroac1ccc2Cc3ccc 111 11446 http://www.s PHYSPROP
    19247 2-methylanth Cc1ccc2cc3cc 209 11442 http://www.s PHYSPROP
    19248 2-aminoanthrNc1ccc2cc3cc 238.8 11443 http://www.s PHYSPROP
    19249 naphthalene, c1cc(cc2ccccc 103.5 11440 http://www.s PHYSPROP
    19250 3,3'-dimethyl Cc1cccc(c1)c2 9 11437 http://www.s PHYSPROP
    19251 2-chloroquinoClc1ccc2ccccc 38 11434 http://www.s PHYSPROP
    19252 7-methylquinoCc1cc2ncccc2 39 11433 http://www.s PHYSPROP
    19253 2-(phenylmethO=C(O)c2cccc 118 11430 http://www.s PHYSPROP
    19254 3-methylquinoCc1cc2ccccc2 16.5 11432 http://www.s PHYSPROP
    19255 2-nitrobenzyl O=[N+]([O-])c 74 11429 http://www.s PHYSPROP
    19256 2-nitro-benzylO=[N+]([O-])c 51 11427 http://www.s PHYSPROP
    19257 1-nitro-2-cya O=[N+]([O-])c 108 11428 http://www.s PHYSPROP
    19258 1,1-diphenyleCC(c1ccccc1)c -17.9 11424 http://www.s PHYSPROP
    19259 urea, n,n'-dimCN(C(=O)N(C)c 122 11423 http://www.s PHYSPROP
    19260 benzoylformicO=C(C(=O)O)c 66 11421 http://www.s PHYSPROP
    19261 n,n-dimethyl O=C(N(C)C)c1 44 11422 http://www.s PHYSPROP
    19262 acridine, 9-meCc1c3ccccc3n 118 11419 http://www.s PHYSPROP
    19263 5-aminoquinolNc1cccc2nccc 110 11417 http://www.s PHYSPROP
    19264 8-methylquinoCc1cccc2cccn -80 11416 http://www.s PHYSPROP
    19265 benzene, 1-chClCc1ccccc1Cl -17 11412 http://www.s PHYSPROP
    19266 o-cyanophenoN#Cc1ccccc1O 98 11413 http://www.s PHYSPROP
    19267 o-methylstyreCc1ccccc1C=C -68.5 11410 http://www.s PHYSPROP
    19268 5-chloro-2-ni O=[N+]([O-])c 41 11407 http://www.s PHYSPROP
    19269 1-ethyl-2-metCc1ccccc1CC -80.8 11409 http://www.s PHYSPROP
    19270 benzoic acid, Cc1cc(C)ccc1 90 11404 http://www.s PHYSPROP
    19271 benzoic acid, Cc1ccc(C)cc1 132 11399 http://www.s PHYSPROP
    19272 2,4-dibromobeOC(=O)c1ccc(B 174 11403 http://www.s PHYSPROP
    19273 2,5-dibromobeOC(=O)c1cc(Br 157 11398 http://www.s PHYSPROP
    19274 o-nitrophenyl O=C(C)Oc1cccc 40.5 11397 http://www.s PHYSPROP
    19275 benzeneacetoni
    O=[N+]([O-]) 84 11395 http://www.s PHYSPROP
    19276 benzene, 1-etCCOc1ccccc1[ 2.2 11396 http://www.s PHYSPROP
    19277 1-anthracena Nc2cccc1cc3c 116 11392 http://www.s PHYSPROP
    19278 1-methylanth Cc2cccc1cc3c 85.5 11391 http://www.s PHYSPROP
    19279 1,2-dino2 4-mO=[N+]([O-])c 58.3 11390 http://www.s PHYSPROP
    19280 2,4-dinitrobenO=[N+]([O-])c 182 11387 http://www.s PHYSPROP
    19281 benzene, 1-met
    O=[N+]([O-])c 104 11385 http://www.s PHYSPROP
    19282 benzenamine,CN(C)c1ccccc1 -20 11384 http://www.s PHYSPROP
    19283 2,3,4-trihydroOc1ccc(C(=O) 221 11381 http://www.s PHYSPROP
    19284 benzoic acid, O=[N+]([O-])c 170 11380 http://www.s PHYSPROP
    19285 2,4-dichloro-6Oc1c(cc(Cl)cc1 122 11378 http://www.s PHYSPROP
    19286 2,6-dinitro-p- O=[N+]([O-])c 78 11379 http://www.s PHYSPROP
    19287 n,n-dimethyl-oCc1ccccc1N(C -60 11376 http://www.s PHYSPROP
    19288 2-nitrothioph [O-][N+](=O)c 46.5 11373 http://www.s PHYSPROP
    19289 2,4,6-triiodopIc1cc(I)c(O)c(I 159.8 11369 http://www.s PHYSPROP
    19290 2-methyl-3-etCC(C)C(CC)CC -114.9 11370 http://www.s PHYSPROP
    19291 2-nitro-1-buta[O-][N+](=O)C -47 11371 http://www.s PHYSPROP
    19292 2-nitrofuran [O-][N+](=O)c 30 11372 http://www.s PHYSPROP
    19293 pentaiodobenIc1cc(I)c(I)c(I) 172 11363 http://www.s PHYSPROP
    19294 3,4,5-trichlor Oc1cc(Cl)c(Cl) 101 11366 http://www.s PHYSPROP
    19295 phenol, 2,4-d Cc1cc(Br)cc(B 58 11368 http://www.s PHYSPROP
    19296 pentabromobBrc1cc(Br)c(Br 160.5 11361 http://www.s PHYSPROP
    19297 pentabromopBrc1c(O)c(Br)c 229.5 11359 http://www.s PHYSPROP
    19298 benzene, 1,3,5Cc1c(c(C)cc(C 85.3 11356 http://www.s PHYSPROP
    19299 butanedioic acOC(=O)C(C)C( 140.5 11355 http://www.s PHYSPROP
    19300 2,6-dibromopBrc1cccc(Br)c 56.5 11354 http://www.s PHYSPROP
    19301 2,6-dichloroanClc1cccc(Cl)c 39 11353 http://www.s PHYSPROP
    19302 benzene, 1,2,3Ic1cccc(I)c1I 116 11352 http://www.s PHYSPROP
    19303 1,3-benzenediOc1cccc(O)c1 120 11350 http://www.s PHYSPROP
    19304 indole-3-ol,acCC(=O)Oc2cnc 129 11348 http://www.s PHYSPROP
    19305 1,2,3-tribrom Brc1cccc(Br)c 87.5 11349 http://www.s PHYSPROP
    19306 2-nitrofluoren[O-][N+](=O)c 157 11338 http://www.s PHYSPROP
    19307 8-nitroquinoli[O-][N+](=O)c 90 11337 http://www.s PHYSPROP
    19308 5-nitroquinoli[O-][N+](=O)c 74 11336 http://www.s PHYSPROP
    19309 1-methyl-2(h)O=C2C=Cc1cc 74 11327 http://www.s PHYSPROP
    19310 2,4'-dinitro-b O=[N+]([O-])c 93.5 11332 http://www.s PHYSPROP
    19311 naphthalene, 1[O-][N+](=O)c 148 11325 http://www.s PHYSPROP
    19312 2,4,6-trinitroaCOc1c(cc(cc1[ 69 11324 http://www.s PHYSPROP
    19313 1,3-benzenedic
    OC(=O)c1cccc 244.5 11319 http://www.s PHYSPROP
    19314 2,6-dinitrotol Cc1c(cccc1[N+ 66 11320 http://www.s PHYSPROP
    19315 naphthalene, 1[O-][N+](=O)c 219 11310 http://www.s PHYSPROP
    19316 martius yello [O-][N+](=O)c 131 11309 http://www.s PHYSPROP
    19317 1-naphthaleneCN(C)c2cccc1c 70 11308 http://www.s PHYSPROP
    19318 1,1'-biphenyl,Cc2ccccc2c1c 19.5 11304 http://www.s PHYSPROP
    19319 naphthalene, c1cc(c2ccccc2 45 11302 http://www.s PHYSPROP
    19320 2-hydroxyant Oc2ccc3C(=O) 306 11303 http://www.s PHYSPROP
    19321 benzene, hexaCCc1c(CC)c(CC 129 11298 http://www.s PHYSPROP
    19322 1,1'-binaphth c3cccc4cccc(c 160 11296 http://www.s PHYSPROP
    19323 2,3-dimethylbOC(=O)c1cccc 146 11289 http://www.s PHYSPROP
    19324 3-nitro-o-tolu Cc1c(cccc1N)[ 92 11290 http://www.s PHYSPROP
    19325 3-nitrophthal [O-][N+](=O) 214 11286 http://www.s PHYSPROP
    19326 triphenylphosc1ccccc1P(c2c 80 11283 http://www.s PHYSPROP
    19327 triphenylaminc1ccccc1N(c2c 127 11282 http://www.s PHYSPROP
    19328 3-methyl-2,4,6O=[N+]([O-])c 109.5 11279 http://www.s PHYSPROP
    19329 acenaphthylen[O-][N+](=O)c 103 11276 http://www.s PHYSPROP
    19330 pentafluorobeFc1c(c(F)c(F)c 101 11277 http://www.s PHYSPROP
    19331 anthragallol O=C3c1ccccc1 313 11275 http://www.s PHYSPROP
    19332 9-phenylanth c1cccc2cc4ccc 156 11273 http://www.s PHYSPROP
    19333 anthracene, 9-[O-][N+](=O)c 146 11274 http://www.s PHYSPROP
    19334 naphthalene, 1[O-][N+](=O)c 173 11271 http://www.s PHYSPROP
    19335 (1,1'-binaphthOc4ccc1ccccc 215.5 11269 http://www.s PHYSPROP
    19336 2,3,4-trinitro O=[N+]([O-])c 112 11270 http://www.s PHYSPROP
    19337 2,3-dinitrotol O=[N+]([O-])c 60 11268 http://www.s PHYSPROP
    19338 2,6-dichloro- O=[N+]([O-])c1 72.5 11266 http://www.s PHYSPROP
    19339 2-nitroresorci O=[N+]([O-])c 82 11267 http://www.s PHYSPROP
    19340 di-i-propylni CC(C)N(N=O)C 48 11265 http://www.s PHYSPROP
    19341 ethylmalonic O=C(O)C(CC)C 114 11263 http://www.s PHYSPROP
    19342 propanoic aci BrC(CBr)C(=O 66.5 11253 http://www.s PHYSPROP
    19343 phenol, 4-(1- CC(C)(c1ccc(O 75 11249 http://www.s PHYSPROP
    19344 benzenamine,Nc1cc(ccc1)S(
    3 171.5 11248 http://www.s PHYSPROP
    19345 prednylidene OCC(=O)C4(O) 234 11247 http://www.s PHYSPROP
    19346 methyl trichloClC(Cl)(Cl)C( -17.5 11246 http://www.s PHYSPROP
    19347 1,1-dimethyluCN(C)C(N)=O 183.5 11244 http://www.s PHYSPROP
    19348 2-propenoic acC=C(Cl)C(=O) 66 11242 http://www.s PHYSPROP
    19349 3-methyl-2-b CC(C)C(C)N -50 11238 http://www.s PHYSPROP
    19350 methylnitrate[O-][N+](=O) -82.5 11231 http://www.s PHYSPROP
    19351 methylcyclob CC1CCC1 -161.5 11232 http://www.s PHYSPROP
    19352 ethyl dimethyCCN(C)C -140 11230 http://www.s PHYSPROP
    19353 urea, methyl- NC(=O)NC 103 11227 http://www.s PHYSPROP
    19354 o-methyl car NC(=O)OC 54 11229 http://www.s PHYSPROP
    19355 1-bromo-2-pr CC(=O)CBr -36.5 11223 http://www.s PHYSPROP
    19356 3-methyl-1,2-C=C=C(C)C -113.6 11222 http://www.s PHYSPROP
    19357 3-methyl-3-heCC(O)(CC)CCC -83 11218 http://www.s PHYSPROP
    19358 3-ethyl-3-pen CCC(O)(CC)CC -12.5 11210 http://www.s PHYSPROP
    19359 propyl sulfoneCCCS(=O)(=O) 29.5 11217 http://www.s PHYSPROP
    19360 2-ethyl-2-nitr O=[N+]([O-])C 57.5 11204 http://www.s PHYSPROP
    19361 benzene, 1,1',BrC(c1ccccc1) 153 11200 http://www.s PHYSPROP
    19362 4',5'-dibromofBrc4c5Oc1c(B 285 11198 http://www.s PHYSPROP
    19363 1,1,1-trinitro O=[N+]([O-])C 57 11197 http://www.s PHYSPROP
    19364 2,2-dimethyl bCC(C)(CC)C(= -14 11193 http://www.s PHYSPROP
    19365 1,1,1,2,2,3,3 ClC(Cl)C(Cl)(Cl 29.4 11187 http://www.s PHYSPROP
    19366 2,2,3,3-tetra CC(C)(C)C(C)(C 100.7 11185 http://www.s PHYSPROP
    19367 2,3,3,-trimethCC(C)(C)C(C)( 17 11186 http://www.s PHYSPROP
    19368 2-methyl-2-niCC(C)(C)[N+]( 26.23 11182 http://www.s PHYSPROP
    19369 a-hydroxy-i-buO=C(O)C(C)(C 82.5 11181 http://www.s PHYSPROP
    19370 2,3-dimethyl- CC(C)C(C)(C)O -14 11180 http://www.s PHYSPROP
    19371 2,3,3-trimeth C=C(C)C(C)(C) -109.9 11179 http://www.s PHYSPROP
    19372 ethanesulfonicCCS(=O)(=O)O -17 11178 http://www.s PHYSPROP
    19373 propane, 2,2-dCC(C)(Cl)Cl -33.8 11170 http://www.s PHYSPROP
    19374 1,2-dibromo- CC(C)C(Br)Br 10.5 11173 http://www.s PHYSPROP
    19375 methane, dibrBrC(Br)(Cl)Cl 38 11169 http://www.s PHYSPROP
    19376 methylcyclop CC1CC1 -177.3 11167 http://www.s PHYSPROP
    19377 n-methylhydr CNO 87.5 11157 http://www.s PHYSPROP
    19378 methyl isocya[C-]#[N+]C -45 11156 http://www.s PHYSPROP
    19379 bromoetheneBrC=C -137.8 11151 http://www.s PHYSPROP
    19380 chlorofluoro ClCF -133 11153 http://www.s PHYSPROP
    19381 fluoromethanCF -141.8 11148 http://www.s PHYSPROP
    19382 octadecane CCCCCCCCCCC 28.2 11145 http://www.s PHYSPROP
    19383 heptacosane CCCCCCCCCCC 59.5 11146 http://www.s PHYSPROP
    19384 2-tridecanoneCC(=O)CCCCC 30.5 11132 http://www.s PHYSPROP
    19385 diallyl sulfide C=CCSCC=C -85 11128 http://www.s PHYSPROP
    19386 n-butylformatO=COCCCC -91.5 11125 http://www.s PHYSPROP
    19387 1-heptene CCCCCC=C -119.7 11121 http://www.s PHYSPROP
    19388 1,3-cyclohexaC1=CC=CCC1 -89 11117 http://www.s PHYSPROP
    19389 propane, 1,1'-CC(C)CSCC(C) -105.5 11119 http://www.s PHYSPROP
    19390 1-fluoropentaCCCCCF -120 11115 http://www.s PHYSPROP
    19391 1,5-hexadieneC=CCCC=C -140.7 11110 http://www.s PHYSPROP
    19392 o-butyl carba NC(=O)OCCCC 53 11108 http://www.s PHYSPROP
    19393 1-hexene C=CCCCC -139.7 11109 http://www.s PHYSPROP
    19394 isooctane CC(C)CCCCC -105 11106 http://www.s PHYSPROP
    19395 butylurea NC(=O)NCCCC 97 11107 http://www.s PHYSPROP
    19396 2-methylhept CC(C)CCCCC -108.9 11106 http://www.s PHYSPROP
    19397 1,2-pentadienC=C=CCC -137.3 11100 http://www.s PHYSPROP
    19398 2,5-dimethyl CC(C)CCC(C)C -91 11104 http://www.s PHYSPROP
    19399 1,4-pentadienC=CCC=C -148.8 11099 http://www.s PHYSPROP
    19400 2-hexanone CC(=O)CCCC -55.5 11095 http://www.s PHYSPROP
    19401 levulinic acid CC(=O)CCC(=O 33 11091 http://www.s PHYSPROP
    19402 2-methylhexaCC(C)CCCC -118.2 11094 http://www.s PHYSPROP
    19403 butanoic acid,O=C(CC(C)=O -35.6 11088 http://www.s PHYSPROP
    19404 iodobenzene Ic1ccccc1 -31.3 11087 http://www.s PHYSPROP
    19405 cyclohexene, CC1CC=CCC1 -115.5 11084 http://www.s PHYSPROP
    19406 1-methylcycl CC=1CCCCC=1 -120.4 11086 http://www.s PHYSPROP
    19407 3,5-dichlorop Oc1cc(Cl)cc(Cl 68 11083 http://www.s PHYSPROP
    19408 phenol, 3-amiNc1cccc(O)c1 123 11080 http://www.s PHYSPROP
    19409 3,5-dimethylpCc1cncc(C)c1 -6.6 11077 http://www.s PHYSPROP
    19410 1,3-dimethylcyCC1CCCC(C)C1 -75.6 11076 http://www.s PHYSPROP
    19411 benzene, 1-brIc1cccc(Br)c1 -9.3 11073 http://www.s PHYSPROP
    19412 2(3h)-furanonCC1=CCC(=O) 18 11071 http://www.s PHYSPROP
    19413 propanoic aci BrCCC(=O)O 62.5 11066 http://www.s PHYSPROP
    19414 3-methyl-1-buCC(C)CC=O -51 11065 http://www.s PHYSPROP
    19415 2,2-dimethyl CC(C)(C)CCCC -121.1 11064 http://www.s PHYSPROP
    19416 1,1-dimethyl CC1(C)CCCCC1 -33.3 11062 http://www.s PHYSPROP
    19417 1-methylcycloCC1(O)CCCCC 25 11063 http://www.s PHYSPROP
    19418 2-pentanone, CC(C)(C)CC(C) -64 11059 http://www.s PHYSPROP
    19419 2-methyl-2-peCC(C)(O)CCC -103 11056 http://www.s PHYSPROP
    19420 propane, 2-is CC(C)(C)/N=C 10.5 11057 http://www.s PHYSPROP
    19421 2,2-dimethylpCC(C)(C)CCC -123.8 11055 http://www.s PHYSPROP
    19422 1,2-butadieneC=C=CC -136.2 11051 http://www.s PHYSPROP
    19423 octanol (isomeCCC(O)CCCCC -16 11043 http://www.s PHYSPROP
    19424 n-butyl propi CCC(=O)OCCC -89 11045 http://www.s PHYSPROP
    19425 3-octanol CCC(O)CCCCC -45 11043 http://www.s PHYSPROP
    19426 2,5-dimethylpCc1cnc(C)cc1 -16 11042 http://www.s PHYSPROP
    19427 4-methylcycl O=C1CCC(C)C -40.6 11041 http://www.s PHYSPROP
    19428 1,4-dimethylcCC1CCC(C)CC1 -36.9 11039 http://www.s PHYSPROP
    19429 1,4-dimethylcyCC1CCC(C)CC1 -87.4 11039 http://www.s PHYSPROP
    19430 1,4-dimethylcCC1CCC(C)CC1 -87 11039 http://www.s PHYSPROP
    19431 4-bromoiodobIc1ccc(Br)cc1 92 11038 http://www.s PHYSPROP
    19432 butyl octanoaO=C(CCCCCCC -42.9 11033 http://www.s PHYSPROP
    19433 3-methylhept CC(CC)CCCC -100 11035 http://www.s PHYSPROP
    19434 4-octanol, (.+-CCCC(O)CCCC -40.7 11031 http://www.s PHYSPROP
    19435 4-methylhept CC(CCC)CCC -121 11028 http://www.s PHYSPROP
    19436 4-heptanol CCCC(O)CCC -41.2 11029 http://www.s PHYSPROP
    19437 3-hexanone CCC(=O)CCC -55.5 11025 http://www.s PHYSPROP
    19438 1,4-benzenedOCc1ccc(CO)c 117.5 11022 http://www.s PHYSPROP
    19439 3-methylhexaCC(CC)CCC -119 11023 http://www.s PHYSPROP
    19440 n-benzylacet CC(=O)NCc1cc 61 11016 http://www.s PHYSPROP
    19441 p-methyl benzCc1ccc(CO)cc 61.5 11021 http://www.s PHYSPROP
    19442 trolnitrate ph O=[N+]([O-]) 108 11015 http://www.s PHYSPROP
    19443 3,4-dichlorop Clc1ccc(OCC(= 139 11011 http://www.s PHYSPROP
    19444 m-chloropheno
    Clc1cc(OCC(= 110 11013 http://www.s PHYSPROP
    19445 diphenylaminc1ccccc1Nc2c 52.9 11003 http://www.s PHYSPROP
    19446 3-chloroacetanClc1cc(NC(C)= 80 11009 http://www.s PHYSPROP
    19447 m-ethylanilin CCc1cc(N)ccc1 -64 10991 http://www.s PHYSPROP
    19448 a-chloroacetanO=C(Nc1ccccc 87 11001 http://www.s PHYSPROP
    19449 4-pyridinemetOCc1ccncc1 53 10988 http://www.s PHYSPROP
    19450 nitrosobenze O=Nc1ccccc1 68.5 10989 http://www.s PHYSPROP
    19451 p-acetylbenzoiOC(=O)c1ccc( 208 10986 http://www.s PHYSPROP
    19452 m-methoxyben
    COc1cc(ccc1) 107 10977 http://www.s PHYSPROP
    19453 p-bromobenzoi
    OC(=O)c1ccc(B 254.5 10980 http://www.s PHYSPROP
    19454 3,5-dinitroph O=[N+]([O-])c 125.1 10975 http://www.s PHYSPROP
    19455 phenol, 3-(1,1CC(C)(C)c1cc( 42.3 10966 http://www.s PHYSPROP
    19456 m-bromobenzo
    OC(=O)c1cc(Br 155 10972 http://www.s PHYSPROP
    19457 bis(2-methylpCc2ccccc2/N= 55.5 10961 http://www.s PHYSPROP
    19458 allethrin O=C2CC(OC(=O 4 10958 http://www.s PHYSPROP
    19459 succinimide O=C1CCC(=O) 126.5 10955 http://www.s PHYSPROP
    19460 3-pentanol CCC(O)CC -69 10947 http://www.s PHYSPROP
    19461 4h-1,2,4-triaz Nn1cnnc1 82.5 10951 http://www.s PHYSPROP
    19462 benzenamine,Cc1cc(Br)ccc1 59.5 10943 http://www.s PHYSPROP
    19463 benzenamine,Cc1cc(Br)c(N) 26 10942 http://www.s PHYSPROP
    19464 methylcycloheCC1CCCCC1O -50 10938 http://www.s PHYSPROP
    19465 3,4-dimethylpCc1ccncc1C -11 10937 http://www.s PHYSPROP
    19466 benzene, 1-brIc1ccccc1Br 9.5 10935 http://www.s PHYSPROP
    19467 1,2-dimethylcyCC1CCCCC1C -49.9 10936 http://www.s PHYSPROP
    19468 2,7-naphthaleOc1cc2cc(O)c 193 10919 http://www.s PHYSPROP
    19469 2,2'-bis(azon c3cccc4ccc(/N 208 10917 http://www.s PHYSPROP
    19470 2,7-dimethylnCc1cc2cc(C)cc 97 10918 http://www.s PHYSPROP
    19471 2-naphthaleneO=C(O)Cc1ccc 142 10915 http://www.s PHYSPROP
    19472 2-nitronaphth[O-][N+](=O)c 79 10914 http://www.s PHYSPROP
    19473 2,6-dimethylnCc1ccc2cc(C)c 112 10909 http://www.s PHYSPROP
    19474 acetamide, n-CCOc1ccccc1N 79 10905 http://www.s PHYSPROP
    19475 2,3-dimethylnCc1cc2ccccc2 105 10908 http://www.s PHYSPROP
    19476 3-phenylphenOc1cc(ccc1)c2 78 10903 http://www.s PHYSPROP
    19477 chlorazine Clc1nc(nc(n1) 27 10902 http://www.s PHYSPROP
    19478 2-aminoquinolNc1ccc2ccccc 131.5 10901 http://www.s PHYSPROP
    19479 6-hdroxyquinoOc1ccc2ncccc 195 10896 http://www.s PHYSPROP
    19480 3-aminoquinolNc1cc2ccccc2 91.5 10897 http://www.s PHYSPROP
    19481 6-aminoquinolNc1ccc2ncccc 114 10895 http://www.s PHYSPROP
    19482 2-bromonaphtBrc1ccc2ccccc 59 10894 http://www.s PHYSPROP
    19483 o-methoxybenz
    COc1ccccc1C( 101 10892 http://www.s PHYSPROP
    19484 diloxanide CN(c1ccc(O)cc 175 10889 http://www.s PHYSPROP
    19485 n-methylacetaCN(C(C)=O)c1 103 10886 http://www.s PHYSPROP
    19486 6h-purin-6-onO=C1N=C(N)Nc 370 10883 http://www.s PHYSPROP
    19487 8-aminoquinolNc1cccc2cccn 70 10881 http://www.s PHYSPROP
    19488 iodoalphionic Ic2cc(CC(c1cc 164 10872 http://www.s PHYSPROP
    19489 3,4-dinitroph O=[N+]([O-])c 134 10870 http://www.s PHYSPROP
    19490 3-hydroxyflav O=C1c3ccccc3 171.5 10871 http://www.s PHYSPROP
    19491 2-nitroaceto O=[N+]([O-])c 28.5 10868 http://www.s PHYSPROP
    19492 1,2-diisoprop CC(C)c1ccccc1 -57 10867 http://www.s PHYSPROP
    19493 anthrarobin Oc2c3ccc(O)c( 208 10865 http://www.s PHYSPROP
    19494 o-bromonitro O=[N+]([O-])c 43 10864 http://www.s PHYSPROP
    19495 phenol, 2,3,4 Brc1c(C)c(O)c( 208 10859 http://www.s PHYSPROP
    19496 2,3-dichlorop Oc1cccc(Cl)c1 58 10857 http://www.s PHYSPROP
    19497 1,3-dimethylnCc2cc(C)cc1cc -6 10850 http://www.s PHYSPROP
    19498 1,6-dimethylnCc2cccc1cc(C) -16.9 10851 http://www.s PHYSPROP
    19499 n-(2-bromoethO=C2c1ccccc1 82.5 10848 http://www.s PHYSPROP
    19500 1,7-dimethylnCc1cccc2ccc(C -13.9 10849 http://www.s PHYSPROP
    19501 1,2-dimethylnCc1c2ccccc2c 1.6 10841 http://www.s PHYSPROP
    19502 2,6-dinitroph O=[N+]([O-])c 63.5 10837 http://www.s PHYSPROP
    19503 1-bromo-2-hyOc2ccc1ccccc 84 10840 http://www.s PHYSPROP
    19504 menadiol diacCC(=O)Oc1cc( 113 10835 http://www.s PHYSPROP
    19505 9-bromophenaBrc2cc3ccccc3 64.5 10834 http://www.s PHYSPROP
    19506 2,3,4-trimeth COc1c(OC)c(c 100.5 10833 http://www.s PHYSPROP
    19507 coumithoate CCOP(=S)(OCC 88.25 10832 http://www.s PHYSPROP
    19508 1,5-dimethylnCc2cccc1c2cc 82 10831 http://www.s PHYSPROP
    19509 1,4-dimethylnCc1ccc(C)c2cc 7.6 10829 http://www.s PHYSPROP
    19510 2-methyl-6-n O=[N+]([O-])c 96 10824 http://www.s PHYSPROP
    19511 phenindamineCN2CC=3C(c1c 91 10817 http://www.s PHYSPROP
    19512 hemimellitic aOC(=O)c1c(cc 200 10814 http://www.s PHYSPROP
    19513 chlorotrianiseCOc1ccc(cc1)C 115 10815 http://www.s PHYSPROP
    19514 1h-purine-2,6O=C2c1n(C)c( 176 10812 http://www.s PHYSPROP
    19515 1,8-dimethylnCc1cccc2cccc( 65 10813 http://www.s PHYSPROP
    19516 6-methylsalicyOC(=O)c1c(C) 173 10805 http://www.s PHYSPROP
    19517 21-acetoxypr CC(=O)OCC(= 184.5 10802 http://www.s PHYSPROP
    19518 2,4-dimethyl- CC(C)C(=O)C(C -69 10797 http://www.s PHYSPROP
    19519 2,3,4-trimeth C/C(C)=C(/C)C -113.4 10796 http://www.s PHYSPROP
    19520 2-bromo-3-met
    CC(C)C(Br)C(= 44 10794 http://www.s PHYSPROP
    19521 2,3,4-trimeth CC(C)C(C)C(C) -109.2 10795 http://www.s PHYSPROP
    19522 isoserine O=C(O)C(O)C 235 10793 http://www.s PHYSPROP
    19523 2-hydroxy-buty
    O=C(O)C(O)CC 44.2 10792 http://www.s PHYSPROP
    19524 2,3-dichloroprClCC(Cl)C(=O) 50 10789 http://www.s PHYSPROP
    19525 3-methyl-2-b CC(C)C(C)=O -93.1 10777 http://www.s PHYSPROP
    19526 2,2,3-trimeth CC(CC)C(C)(C) -112.2 10781 http://www.s PHYSPROP
    19527 2,3-dimethyl- C/C(C)=C(/C)C -74.6 10776 http://www.s PHYSPROP
    19528 2,3-dimethyl- C=C(C)C(C)C -157.3 10775 http://www.s PHYSPROP
    19529 2-methyl-1-b C=C(C)CC -137.5 10766 http://www.s PHYSPROP
    19530 3-methyl-1-b C=CC(C)C -168.5 10765 http://www.s PHYSPROP
    19531 3,3-dimethyl CC(C)(CC)CCC -126.1 10759 http://www.s PHYSPROP
    19532 3,3-dimethylpCC(C)(CC)CC -134.9 10755 http://www.s PHYSPROP
    19533 tri-m-cresyl Cc1cc(ccc1)OP 25.5 10758 http://www.s PHYSPROP
    19534 methane, brom
    O=[N+]([O-])C 17.5 10747 http://www.s PHYSPROP
    19535 2,3,3-trimeth C=C(C)C(C)(C) -69 10743 http://www.s PHYSPROP
    19536 3,3-dimethyl- C=CC(C)(C)C -115.2 10737 http://www.s PHYSPROP
    19537 2,3,3-trimeth CC(C)C(C)(C)C -100.9 10742 http://www.s PHYSPROP
    19538 propane, 2-io CC(C)(C)I -38.2 10733 http://www.s PHYSPROP
    19539 carbon tetrabBrC(Br)(Br)Br 90.1 10732 http://www.s PHYSPROP
    19540 acetyl fluorid CC(F)=O -84 10731 http://www.s PHYSPROP
    19541 2-chloroprop C=C(C)Cl -137.4 10730 http://www.s PHYSPROP
    19542 1-propene, 2- BrC(=C)C -126 10729 http://www.s PHYSPROP
    19543 1,1-dibromoe BrC(Br)C -63 10728 http://www.s PHYSPROP
    19544 tetracosanoic O=C(O)CCCCC 84.2 10724 http://www.s PHYSPROP
    19545 urea, 2-propenNC(=O)NCC=C 85 10708 http://www.s PHYSPROP
    19546 hexadecamethy
    C[Si]1(C)O[Si] 31.5 10697 http://www.s PHYSPROP
    19547 octamethylcycC[Si]1(C)O[Si] 17.5 10696 http://www.s PHYSPROP
    19548 methyl thiocyN#CSC -5 10695 http://www.s PHYSPROP
    19549 methyl isothi CN=C=S 36 10694 http://www.s PHYSPROP
    19550 4-aminobenzaO=Cc1ccc(N)c 71.5 10685 http://www.s PHYSPROP
    19551 1,4-cyclohexanOC1CCC(O)CC 143 10689 http://www.s PHYSPROP
    19552 benzylhydraziNNCc1ccccc1 26 10684 http://www.s PHYSPROP
    19553 neotran Clc2ccc(OCOc1 70.5 10682 http://www.s PHYSPROP
    19554 tetradecanoic O=C(CCCCCCC 56.5 10675 http://www.s PHYSPROP
    19555 hexadecanoic O=C(CCCCCCC
    a 66.5 10674 http://www.s PHYSPROP
    19556 tristearin O=C(CCCCCCC 55 10673 http://www.s PHYSPROP
    19557 neburon Clc1ccc(NC(=O 102 10672 http://www.s PHYSPROP
    19558 3-nitrophenolO=[N+]([O-])c 96.8 10664 http://www.s PHYSPROP
    19559 n-methylepin Oc1ccc(cc1O) 149 10666 http://www.s PHYSPROP
    19560 phenobutiodilO=C(O)C(CC)Oc 124.5 10656 http://www.s PHYSPROP
    19561 methyl propioCCC(=O)OC -87.5 10653 http://www.s PHYSPROP
    19562 2-methyl-1,4 O=C1C=CC(=O) 69 10651 http://www.s PHYSPROP
    19563 benzene, 2,4- COc1ccc(Cl)cc 28.5 10648 http://www.s PHYSPROP
    19564 methyl oxalatO=C(OC)C(=O 54.3 10649 http://www.s PHYSPROP
    19565 5-nitro-2-prop[O-][N+](=O)c 49 10647 http://www.s PHYSPROP
    19566 guaiacol carb COc2ccccc2OC 89 10633 http://www.s PHYSPROP
    19567 n,n-di-b-chlorClCCN(CCCl)c1 45 10637 http://www.s PHYSPROP
    19568 o-nitrobenzal O=[N+]([O-])c 43.5 10630 http://www.s PHYSPROP
    19569 furan, 2-ch(ohO=C(C(O)c1cc 135.5 10629 http://www.s PHYSPROP
    19570 diphenyl met CN(c1ccccc1)c -7.5 10627 http://www.s PHYSPROP
    19571 2-hydroxy-4- O=C(C)c1ccc( 52.5 10621 http://www.s PHYSPROP
    19572 2-nitroacetaniO=C(C)Nc1cccc 94 10619 http://www.s PHYSPROP
    19573 trimellitic an O=C(O)c1ccc2 162 10618 http://www.s PHYSPROP
    19574 2-nitrobenzoicO=[N+]([O-])c 147.5 10616 http://www.s PHYSPROP
    19575 1-isothiocyan S=C=Nc2cccc1 58 10609 http://www.s PHYSPROP
    19576 1-nitro-2-nap [O-][N+](=O)c 104 10604 http://www.s PHYSPROP
    19577 amisometradiO=C1N(CC(=C) 175 10600 http://www.s PHYSPROP
    19578 o-thymotic acCC(C)c1ccc(C) 127 10584 http://www.s PHYSPROP
    19579 perinaphthen O=C3C=Cc2ccc 154 10582 http://www.s PHYSPROP
    19580 spiro[isobenz O=C(O)c4cccc 295.5 10581 http://www.s PHYSPROP
    19581 barbituric acidO=C1NC(=O)NC 181 10554 http://www.s PHYSPROP
    19582 methyl isobutCC(C)C(=O)OC -84.7 10571 http://www.s PHYSPROP
    19583 tepa O=P(N1CC1)( 41 10550 http://www.s PHYSPROP
    19584 dotriacontaneCCCCCCCCCCC 69.7 10542 http://www.s PHYSPROP
    19585 1-iodohexadeCCCCCCCCCCC 22 10541 http://www.s PHYSPROP
    19586 n-hexadecaneCCCCCCCCCCC 18.1 10540 http://www.s PHYSPROP
    19587 agrocybin NC(=O)C#CC# 140 10538 http://www.s PHYSPROP
    19588 tetradecanoic O=C(O)CCCCC 53.9 10539 http://www.s PHYSPROP
    19589 di-n-butyl sulfCCCCSCCCC -79.7 10536 http://www.s PHYSPROP
    19590 cycloheptatri C1=CC=CC=CC -79.5 10534 http://www.s PHYSPROP
    19591 diisoamyl sulf CC(C)CCSCCC( -74.6 10525 http://www.s PHYSPROP
    19592 1-chlorohexa CCCCCCCl -94 10526 http://www.s PHYSPROP
    19593 1-butanamine,CC(C)CCNCCC( -44 10523 http://www.s PHYSPROP
    19594 (3-methyl-2-bN=C(N)NCC=C( 62.5 10518 http://www.s PHYSPROP
    19595 1-chloropentaCCCCCCl -99 10512 http://www.s PHYSPROP
    19596 glycine, n-acetCC(=O)NCC(= 206 10507 http://www.s PHYSPROP
    19597 carbamic acidNC(=O)OCC(C) 67 10508 http://www.s PHYSPROP
    19598 ethyl thiocyanN#CSCC -85.5 10503 http://www.s PHYSPROP
    19599 malonaldehydO=CCC=O 72 10499 http://www.s PHYSPROP
    19600 n-butyl iodideCCCCI -103 10497 http://www.s PHYSPROP
    19601 3-chloropropioClCCC#N -51 10498 http://www.s PHYSPROP
    19602 4-methylpentaCC(C)CCC#N -51 10491 http://www.s PHYSPROP
    19603 isobutyl form CC(C)COC=O -95.8 10492 http://www.s PHYSPROP
    19604 14-heptacosa CCCCCCCCCCC 77.5 10490 http://www.s PHYSPROP
    19605 chlorocycloheClC1CCCCC1 -44 10487 http://www.s PHYSPROP
    19606 1h-pyrrole-2, O=C1C=CC(=O 94 10471 http://www.s PHYSPROP
    19607 butanoic acid,CC(N)CC(=O)O 193 10469 http://www.s PHYSPROP
    19608 2-butenoic aciCC(C)=C/C(=O 69.5 10468 http://www.s PHYSPROP
    19609 butanamide, 3CC(C)CC(N)=O 137 10467 http://www.s PHYSPROP
    19610 butyramide CCCC(N)=O 114.8 10464 http://www.s PHYSPROP
    19611 ethyl chloroc ClC(=O)OCC -80.6 10465 http://www.s PHYSPROP
    19612 hexamethylcycC[Si]1(C)O[Si] 64.5 10452 http://www.s PHYSPROP
    19613 decamethylcycC[Si]1(C)O[Si] -38 10451 http://www.s PHYSPROP
    19614 dodecamethylC[Si]1(C)O[Si] -3 10449 http://www.s PHYSPROP
    19615 hexadecamethC[Si](C)(C)O[Si -78 10450 http://www.s PHYSPROP
    19616 2,2,4-trimeth CC(C)CC(C)(C) -107.3 10445 http://www.s PHYSPROP
    19617 ammonium foO=CON 116 10442 http://www.s PHYSPROP
    19618 1-chloroprop CCCCl -122.8 10437 http://www.s PHYSPROP
    19619 aminoacetonitN#CCN 101 10439 http://www.s PHYSPROP
    19620 ethyl methyl CCOC -113 10441 http://www.s PHYSPROP
    19621 4-iodophenol Ic1ccc(O)cc1 93.5 10432 http://www.s PHYSPROP
    19622 2-methylpropyCCC(=O)OCC(C -71.4 10433 http://www.s PHYSPROP
    19623 pentyl butyra O=C(CCC)OCC -73.2 10428 http://www.s PHYSPROP
    19624 benzenamine,Ic1ccc(N)cc1 67.5 10431 http://www.s PHYSPROP
    19625 hexadecanoic CCCCCCCCCCC 54 10427 http://www.s PHYSPROP
    19626 9-heptadecanCCCCCCCCC(= 53 10425 http://www.s PHYSPROP
    19627 12-tricosanonCCCCCCCCCCC 70.2 10426 http://www.s PHYSPROP
    19628 hexanoic acid,O=C(CCCCC)O -47 10424 http://www.s PHYSPROP
    19629 ethyl valerateCCCCC(=O)OC -91.2 10420 http://www.s PHYSPROP
    19630 2,4,6-cyclohe O=C1C=CC=CC -7 10419 http://www.s PHYSPROP
    19631 cyclohexanamiN(=C=NC1CCC 34.5 10408 http://www.s PHYSPROP
    19632 p-chloroacetanClc1ccc(NC(C) 179 10411 http://www.s PHYSPROP
    19633 benzyl sulfideC(SCc1ccccc1) 49.5 10407 http://www.s PHYSPROP
    19634 benzalaniline C(=N/c1ccccc1 54 10400 http://www.s PHYSPROP
    19635 phenyl glyceroOCC(O)COc1cc 67.5 10399 http://www.s PHYSPROP
    19636 4,4'-diamino Nc2ccc(/N=N/c 250.5 10398 http://www.s PHYSPROP
    19637 benzene, 1,1'-Cc2ccc(CCc1cc 85 10397 http://www.s PHYSPROP
    19638 benzylurea NC(=O)NCc1cc 148 10396 http://www.s PHYSPROP
    19639 bis(2-chloroe CCN(CCCl)CCC -34 10391 http://www.s PHYSPROP
    19640 trioctonoin O=C(CCCCCCC 10 10393 http://www.s PHYSPROP
    19641 disulfide, bis( [O-][N+](=O)c 84 10385 http://www.s PHYSPROP
    19642 1,4-benzenediNc1ccc(cc1)Nc 158 10384 http://www.s PHYSPROP
    19643 hydrazinecarbO=C(Nc1ccccc 128 10380 http://www.s PHYSPROP
    19644 2,6-dibromoqBrC1=CC(=NCl 83 10378 http://www.s PHYSPROP
    19645 tropacocaine CN3C1CCC3CC( 49 10377 http://www.s PHYSPROP
    19646 l-tyrosine, 3, Brc1cc(cc(Br) 245 10376 http://www.s PHYSPROP
    19647 2-amino-4-anilNc2ncnc(Nc1c 235.5 10375 http://www.s PHYSPROP
    19648 p-(benylsulfo O=S(=O)(Nc1c 229.5 10368 http://www.s PHYSPROP
    19649 ethynyl benzeC#Cc1ccccc1 -44.8 10364 http://www.s PHYSPROP
    19650 cumic acid CC(C)c1ccc(cc 117.5 10363 http://www.s PHYSPROP
    19651 benzoylhydrazO=C(NN)c1ccc( 164 10359 http://www.s PHYSPROP
    19652 p-toluenesulfiCc1ccc(cc1)S( 86.5 10361 http://www.s PHYSPROP
    19653 benzoic acid, Nc1cc(ccc1O) 143 10358 http://www.s PHYSPROP
    19654 m-cymene Cc1cccc(c1)C( -63.7 10355 http://www.s PHYSPROP
    19655 2-chloro-4-meCc1cc(nc(Cl)n 87 10356 http://www.s PHYSPROP
    19656 glybuthiazole O=S(=O)(Nc1nn 222 10354 http://www.s PHYSPROP
    19657 butyl malonic CCCCC(C(=O)O 104.5 10344 http://www.s PHYSPROP
    19658 4,6-dinitro-o- O=[N+]([O-])c 86.6 10343 http://www.s PHYSPROP
    19659 2-methyl-2-imCC1=NCCN1 107 10341 http://www.s PHYSPROP
    19660 aleuritic acid OC(CCCCCCCC 100.5 10334 http://www.s PHYSPROP
    19661 2-methylfuranCc1ccco1 -87.5 10340 http://www.s PHYSPROP
    19662 tropolone OC1=CC=CC=C 50.8 10333 http://www.s PHYSPROP
    19663 1,2,4-trihydroOc1cc(O)c(O)c 140.5 10331 http://www.s PHYSPROP
    19664 dmtt (dazomeS=C1SCN(C)C 106 10332 http://www.s PHYSPROP
    19665 d-2-deoxyriboO=CCC(O)C(O 91 10330 http://www.s PHYSPROP
    19666 2-chloroacetanClc1ccccc1NC 89 10322 http://www.s PHYSPROP
    19667 2-iodophenol Ic1ccccc1O 43 10328 http://www.s PHYSPROP
    19668 benzoic acid nO=C(NNc1cccc 168 10319 http://www.s PHYSPROP
    19669 2-chloro-1-phO=C(CCl)c1ccc 56.5 10303 http://www.s PHYSPROP
    19670 mandelonitril OC(C#N)c1ccc -10 10304 http://www.s PHYSPROP
    19671 acetylsalicylsaO=C(C)Oc2ccc 159 10292 http://www.s PHYSPROP
    19672 2-naphthalenol
    OC1Cc2ccccc2 15.5 10294 http://www.s PHYSPROP
    19673 4-oh-3,5-dimeCOc1cc(cc(OC 207.5 10289 http://www.s PHYSPROP
    19674 1,1-diphenyleC=C(c1ccccc1) 8.2 10287 http://www.s PHYSPROP
    19675 hydrazine, 1,1NN(c1ccccc1)c 50.5 10286 http://www.s PHYSPROP
    19676 methanone, 4-CN(C)c1ccc(cc 92.5 10284 http://www.s PHYSPROP
    19677 chloramphenicO=[N+]([O-]) 90 10283 http://www.s PHYSPROP
    19678 anthranol Oc2c3ccccc3c 152 10278 http://www.s PHYSPROP
    19679 acetamide, n-CCN(C(C)=O)c 55 10275 http://www.s PHYSPROP
    19680 benzeneaceticOCC(C(=O)O)c 118 10274 http://www.s PHYSPROP
    19681 tropic acid OCC(C(=O)O)c 118 10274 http://www.s PHYSPROP
    19682 3,4-dihydro-1 O=C2CCCc1ccc 8 10273 http://www.s PHYSPROP
    19683 n-(aminocarboCC(C)C(CC=C) 194 10264 http://www.s PHYSPROP
    19684 benzoic acid, Cc1cc(C)c(C)c 152.5 10263 http://www.s PHYSPROP
    19685 3,4-dinitrobenO=[N+]([O-])c 166 10259 http://www.s PHYSPROP
    19686 trimellitic acidOC(=O)c1cc(c 219 10258 http://www.s PHYSPROP
    19687 o-dinitrobenz O=[N+]([O-])c 118.5 10257 http://www.s PHYSPROP
    19688 2-methylbenzCc1ccccc1C(= 147 10254 http://www.s PHYSPROP
    19689 ethanone, 1-(2Oc1ccc(C(C)= 173 10256 http://www.s PHYSPROP
    19690 thiophene-2-ca
    O=C(O)c1cccs 129.5 10250 http://www.s PHYSPROP
    19691 1-methyl-2-is Cc1ccccc1C(C) -71.5 10253 http://www.s PHYSPROP
    19692 2,4,6-trimeth Cc1cc(C)c(O)c 73 10248 http://www.s PHYSPROP
    19693 4,5-dimethyl rCc1cc(O)cc(O) 136 10247 http://www.s PHYSPROP
    19694 1,2,3,5-tetra Cc1cc(C)c(C)c( -23.7 10245 http://www.s PHYSPROP
    19695 phenol, 2,3,5,Cc1cc(C)c(C)c 118.5 10244 http://www.s PHYSPROP
    19696 pentachloroanClc1c(N)c(Cl)c( 235 10243 http://www.s PHYSPROP
    19697 1,2,3-trimeth Cc1cccc(C)c1C -25.4 10236 http://www.s PHYSPROP
    19698 2,5-cyclohexaCC=1C(=O)C=C 55 10238 http://www.s PHYSPROP
    19699 1h-indole-3-e OCCc2cnc1ccc 59 10235 http://www.s PHYSPROP
    19700 flavone O=C2C=C(Oc1c 100 10230 http://www.s PHYSPROP
    19701 ricidine O=C1C(C#N)= 201.5 10216 http://www.s PHYSPROP
    19702 2,7-diamino-f Nc1ccc2c3ccc 166 10229 http://www.s PHYSPROP
    19703 dibromsalicil Oc2ccc(Br)cc2 212.5 10212 http://www.s PHYSPROP
    19704 hydroquinine COc1cc2c(cc 172.5 10203 http://www.s PHYSPROP
    19705 1,4-phthalazi Oc2nnc(O)c1c 330.5 10192 http://www.s PHYSPROP
    19706 retronecine OC1CCN2CC=C 119.5 10180 http://www.s PHYSPROP
    19707 ethadione O=C1N(CC)C(= 76.5 10184 http://www.s PHYSPROP
    19708 psilocybin O=P(O)(O)Oc1 224 10178 http://www.s PHYSPROP
    19709 florantyrone O=C(O)CCC(=O 208 10172 http://www.s PHYSPROP
    19710 n,n-diphenylaO=C(C)N(c1ccc 103 10170 http://www.s PHYSPROP
    19711 ambucetamidCOc1ccc(cc1) 134 10171 http://www.s PHYSPROP
    19712 triphenylmet c1ccccc1C(c2c 94 10169 http://www.s PHYSPROP
    19713 2,4-dinitrores O=[N+]([O-])c 147.5 10168 http://www.s PHYSPROP
    19714 dimethazan CN(C)CCn2cnc 95 10167 http://www.s PHYSPROP
    19715 hematoxylin Oc2cc3CC4(O) 140 10158 http://www.s PHYSPROP
    19716 cyclocumarol O=C2Oc1ccccc 166 10161 http://www.s PHYSPROP
    19717 methane, trini[O-][N+](=O)C 15 10157 http://www.s PHYSPROP
    19718 methallenestriO=C(O)C(C)(C) 139.5 10154 http://www.s PHYSPROP
    19719 1h-pyrrole, 3-Cc1ncc(C)c1C 0 10155 http://www.s PHYSPROP
    19720 equilenin Oc1ccc2c3CCC 258.5 10152 http://www.s PHYSPROP
    19721 ethene, tetraiI/C(I)=C(/I)I 187 10126 http://www.s PHYSPROP
    19722 2,3-dimethyl- C=C(C)C(=C)C -76 10124 http://www.s PHYSPROP
    19723 2-butanethiol CC(S)CC -165 10120 http://www.s PHYSPROP
    19724 1-iodo-2-met CC(C)CI -93 10116 http://www.s PHYSPROP
    19725 2-iodobutane CC(I)CC -104 10119 http://www.s PHYSPROP
    19726 2-methyl-2-b CC=C(/C)C -133.7 10113 http://www.s PHYSPROP
    19727 2-(ethylsulfonCCS(=O)(=O)C 46 10109 http://www.s PHYSPROP
    19728 trimethyl phoO=P(OC)(OC) -46 10101 http://www.s PHYSPROP
    19729 ascaridole CC12C=CC(CC1 3.3 10105 http://www.s PHYSPROP
    19730 butanamide, 2BrC(CC)(CC)C 67 10095 http://www.s PHYSPROP
    19731 chlorobenzila OC(c1ccc(Cl)c 37 10085 http://www.s PHYSPROP
    19732 malachite gre CN(C)c1ccc(cc 113 10084 http://www.s PHYSPROP
    19733 heptabarbital O=C1NC(=O)N 174 10081 http://www.s PHYSPROP
    19734 2-methoxystr COc1cc2c(cc 222 10077 http://www.s PHYSPROP
    19735 hydrocortisonCC(C)(C)CC(= 168 10073 http://www.s PHYSPROP
    19736 anemonin O=C3C=CC2(C 158 10064 http://www.s PHYSPROP
    19737 octane, heptaFC(F)(C(F)(F)C( 20.8 10059 http://www.s PHYSPROP
    19738 methane, tetrIC(I)(I)I 171 10055 http://www.s PHYSPROP
    19739 t-butyl chlori CC(C)(C)Cl -26 10054 http://www.s PHYSPROP
    19740 2-bromo-2-meBrC(C)(C)C -16.2 10053 http://www.s PHYSPROP
    19741 iodine cyanid IC#N 146.7 10046 http://www.s PHYSPROP
    19742 acetyl bromidBrC(C)=O -96 10050 http://www.s PHYSPROP
    19743 1-tetracosanoCCCCCCCCCCC 77 10040 http://www.s PHYSPROP
    19744 triacontanoic CCCCCCCCCCC 93.6 10039 http://www.s PHYSPROP
    19745 nsc-407311 CCCCCCCCCCC 90.9 10038 http://www.s PHYSPROP
    19746 eicosanoic aciO=C(O)CCCCC 75.4 10035 http://www.s PHYSPROP
    19747 hexacosanoic O=C(O)CCCCC 88.5 10037 http://www.s PHYSPROP
    19748 hexadecanoic O=C(O)CCCCC 98 10034 http://www.s PHYSPROP
    19749 heptadecanoicO=C(O)CCCCC 61.3 10033 http://www.s PHYSPROP
    19750 tridecanedioicO=C(O)CCCCC 111 10026 http://www.s PHYSPROP
    19751 suberic acid O=C(O)CCCCC 144 10025 http://www.s PHYSPROP
    19752 propane, 1-isoCS(=O)(=O)CC 47.5 10022 http://www.s PHYSPROP
    19753 1,4-dithiane C1CSCCS1 112.3 10020 http://www.s PHYSPROP
    19754 1,3-dithiane C1CCSCS1 54 10019 http://www.s PHYSPROP
    19755 1,3-dioxane C1CCOCO1 -45 10018 http://www.s PHYSPROP
    19756 10-nonadecanCCCCCCCCCC( 65.5 10010 http://www.s PHYSPROP
    19757 2-aminopyridiNc1ccccn1 57.5 10008 http://www.s PHYSPROP
    19758 18-pentatriac CCCCCCCCCCC 89 10009 http://www.s PHYSPROP
    19759 phorone CC(C)=C/C(=O) 28 10007 http://www.s PHYSPROP
    19760 1,3-cyclohexaO=C1CCCC(=O 105.5 10004 http://www.s PHYSPROP
    19761 isovaleric acidCC(C)CC(=O)O -29.3 10001 http://www.s PHYSPROP
    19762 methanedisulfO=S(=O)(O)CS 98 9998 http://www.s PHYSPROP
    19763 diazene, dimeCN=NC -78 9992 http://www.s PHYSPROP
    19764 trimethyleneoC1CCO1 -97 9994 http://www.s PHYSPROP
    19765 2-butyne CC#CC -32.3 9990 http://www.s PHYSPROP
    19766 5-nonanone CCCCC(=O)CC -3.8 9976 http://www.s PHYSPROP
    19767 bis(ethylxant CCOC(=S)SSC( 30 9975 http://www.s PHYSPROP
    19768 6-octenoic aciO=C(O)CC(C)C 257 9973 http://www.s PHYSPROP
    19769 cyclooctanon O=C1CCCCCCC 29 9974 http://www.s PHYSPROP
    19770 cycloheptanolOC1CCCCCC1 2 9970 http://www.s PHYSPROP
    19771 e-caprolactonO=C1CCCCCO -18 9972 http://www.s PHYSPROP
    19772 p-hydroxy-b-pOc1ccc(CCC(= 130.8 9965 http://www.s PHYSPROP
    19773 2-(p-hydroxypOc1ccc(CCO)c 90 9964 http://www.s PHYSPROP
    19774 diphenylacetyC(#Cc1ccccc1) 62.5 9961 http://www.s PHYSPROP
    19775 n-benzyl-3-ch ClCCC(=O)NCc 94 9962 http://www.s PHYSPROP
    19776 3,5-dimethox COc1cc(O)cc( 37 9954 http://www.s PHYSPROP
    19777 indophenol O=C2C=C/C(=N 160 9951 http://www.s PHYSPROP
    19778 acetic acid, o O=C(Nc1ccccc 150 9950 http://www.s PHYSPROP
    19779 2-amino-4-(p-cClc1ccc(cc1)N 233.5 9946 http://www.s PHYSPROP
    19780 3-chloro-dimeO=[N+]([O-])c 21 9944 http://www.s PHYSPROP
    19781 beta-eucaine CC2CC(OC(=O) 70.5 9945 http://www.s PHYSPROP
    19782 dinicotinic aci OC(=O)c1cc(c 324 9939 http://www.s PHYSPROP
    19783 2,4-pyridinediOC(=O)c1cc(c 249 9938 http://www.s PHYSPROP
    19784 bicyclo[2.2.1 C1=CC2CCC1C 45 9925 http://www.s PHYSPROP
    19785 benzoic acid, Cc1cc(C)cc(c1 171.1 9929 http://www.s PHYSPROP
    19786 methylsuccinicO=C(O)CC(C)C 117.5 9922 http://www.s PHYSPROP
    19787 butanedioic aci
    O=C(O)CC(C)C 115 9922 http://www.s PHYSPROP
    19788 2,4,5-trimeth Cc1cc(C)c(O)c 72 9911 http://www.s PHYSPROP
    19789 2(5h)-furanonO=C1C=CCO1 4.5 9917 http://www.s PHYSPROP
    19790 1,2-benzeneditCc1cc(S)c(S)cc 29 9910 http://www.s PHYSPROP
    19791 1,3-benzenediOc1cc(O)c(C)c 106 9909 http://www.s PHYSPROP
    19792 3,4-diaminotoCc1cc(N)c(N)c 89.5 9908 http://www.s PHYSPROP
    19793 bicyclo[4.3.0 C1CCC2CCCCC -53 9902 http://www.s PHYSPROP
    19794 indane c1cccc2CCCc1 -51.4 9903 http://www.s PHYSPROP
    19795 1,3-benzodioxOCc1ccc2OCO 58 9900 http://www.s PHYSPROP
    19796 azoxybenzene[O-][N+](=N/c 36 9894 http://www.s PHYSPROP
    19797 1-butanone, 1O=C(CCC)c1cc 12 9893 http://www.s PHYSPROP
    19798 benzohydroxaO=C(NO)c1ccc 128 9891 http://www.s PHYSPROP
    19799 chloronaphaziClCCN(CCCl)c1 55 9885 http://www.s PHYSPROP
    19800 5h-dibenz(b,f)c1cc2Nc3cccc 106.5 9886 http://www.s PHYSPROP
    19801 2-((4-(dimeth CN(C)c2ccc(/ 183 9881 http://www.s PHYSPROP
    19802 auramine CN(C)c1ccc(cc 136 9876 http://www.s PHYSPROP
    19803 chrysarobin Oc2c3c(cc1ccc 203.7 9867 http://www.s PHYSPROP
    19804 9h-thioxantheO=C1c3ccccc3 209 9873 http://www.s PHYSPROP
    19805 4h-1-benzopyO=C2C=COc1c 59 9866 http://www.s PHYSPROP
    19806 2,5-cyclohexaCC(C)C1=CC(= 45.5 9861 http://www.s PHYSPROP
    19807 monotropitosO=C(OC)c3ccc 180 9858 http://www.s PHYSPROP
    19808 cinchomeronicOC(=O)c1cncc 256 9854 http://www.s PHYSPROP
    19809 benzoic acid, COc1cc(OC)c( 145 9856 http://www.s PHYSPROP
    19810 aspergillic aci O=C1C(CC(C)C 98 9853 http://www.s PHYSPROP
    19811 2,4,6-trinitroaO=[N+]([O-])c 193.5 9852 http://www.s PHYSPROP
    19812 furan-3-carboxO=C(O)c1ccoc 122.5 9849 http://www.s PHYSPROP
    19813 1,2,3,4-tetra Cc1ccc(C)c(C) -6.2 9844 http://www.s PHYSPROP
    19814 glucamine OC(C(O)CN)C( 127 9847 http://www.s PHYSPROP
    19815 bufotenin CN(C)CCc2cnc 146.5 9839 http://www.s PHYSPROP
    19816 1h-indole-3-c O=Cc2cnc1ccc 196.5 9838 http://www.s PHYSPROP
    19817 glycine, n-(2- O=C(NCC(=O)O 168 9835 http://www.s PHYSPROP
    19818 salacetamide O=C(NC(C)=O) 148 9834 http://www.s PHYSPROP
    19819 flavanone O=C2CC(Oc1cc 77 9833 http://www.s PHYSPROP
    19820 di-naphthalenc3cccc4cccc(/ 190 9829 http://www.s PHYSPROP
    19821 lumazine O=C1NC(=O)N 348.5 9832 http://www.s PHYSPROP
    19822 quinoline-4-caO=C(O)c1ccnc 254.5 9826 http://www.s PHYSPROP
    19823 fluorenone O=C3c1ccccc1 84 9824 http://www.s PHYSPROP
    19824 binapacryl O=C(Oc1c(cc(c 70 9817 http://www.s PHYSPROP
    19825 osthole C/C(C)=CCc1c 83.5 9811 http://www.s PHYSPROP
    19826 apiole (dill) C=CCc1cc2OC 29.5 9814 http://www.s PHYSPROP
    19827 1h-imidazole, c1ccc(cc1)c2n 275 9815 http://www.s PHYSPROP
    19828 phenanthrene,CC(C)c2cc3ccc 101 9805 http://www.s PHYSPROP
    19829 1,1'-biphenyl OC(=O)c2cccc 233.5 9795 http://www.s PHYSPROP
    19830 menadiol Oc1cc(C)c(O)c 169 9794 http://www.s PHYSPROP
    19831 chrysophanol Oc3cccc2C(=O) 196 9793 http://www.s PHYSPROP
    19832 aloe-emodin Oc3cccc2C(=O 223.5 9792 http://www.s PHYSPROP
    19833 1,4-naphthaleOc1cccc2c1C( 78.5 9790 http://www.s PHYSPROP
    19834 cholestane, (5CC(C)CCCC(C 80 9787 http://www.s PHYSPROP
    19835 cholestane, (5CC(C)CCCC(C 72 9787 http://www.s PHYSPROP
    19836 santonin O=C1C=C[C@] 175 9786 http://www.s PHYSPROP
    19837 2,3-dihydro-1 O=C1NCc2ccc 151 9784 http://www.s PHYSPROP
    19838 2,4,6(1h,3h,5hO=C1NC(=O)NC 180.5 9780 http://www.s PHYSPROP
    19839 2,4,6-trimethyCc1cc(C)cc(C) 154 9779 http://www.s PHYSPROP
    19840 lucanthone CCN(CC)CCNc1 64.5 9772 http://www.s PHYSPROP
    19841 cholanthrene c2c1c5ccccc5 174 9769 http://www.s PHYSPROP
    19842 tetryl CN([N+]([O-]) 131.5 9770 http://www.s PHYSPROP
    19843 cotoin O=C(c1c(O)cc 130.5 9768 http://www.s PHYSPROP
    19844 chelidonine OC3Cc5cc6OC 135.5 9741 http://www.s PHYSPROP
    19845 colchiceine CC(=O)NC2CCc 178.5 9750 http://www.s PHYSPROP
    19846 1,4-naphthaleOc1ccc(O)c2C 232 9735 http://www.s PHYSPROP
    19847 dfdt Fc1ccc(cc1)C(c 44.5 9733 http://www.s PHYSPROP
    19848 pinane CC2(C)C1CC2C -50 9724 http://www.s PHYSPROP
    19849 2,6,6-trimethyCC2(C)C1CC2C -53 9724 http://www.s PHYSPROP
    19850 pimaric acid O=C(O)C1(C)C 218.5 9712 http://www.s PHYSPROP
    19851 2-propynoic aC#CC(=O)O 18 9706 http://www.s PHYSPROP
    19852 1,4-cineol CC(C)C12CCC( 1 9702 http://www.s PHYSPROP
    19853 ketobemidon O=C(CC)C1(CC 156.5 9697 http://www.s PHYSPROP
    19854 phenadoxoneCCC(=O)C(CC( 75.5 9686 http://www.s PHYSPROP
    19855 isomethadoneCCC(=O)C(C(C) 231.5 9675 http://www.s PHYSPROP x salt - AL
    19856 bicyclo[2.2.1] CC12CCC(CC1C 132 9653 http://www.s PHYSPROP
    19857 bicyclo[2.2.1] CC2(C)C1C=CC 113 9652 http://www.s PHYSPROP
    19858 methane, tribBrC(Br)(Br)[N+ 10 9651 http://www.s PHYSPROP
    19859 2-butanol, 3,3-CC(C)(C)C(C)O 5.6 9650 http://www.s PHYSPROP
    19860 3,3-dimethyl- CC(C)(C)C(C)O 4.8 9650 http://www.s PHYSPROP
    19861 2,2,3-trimeth CC(C)C(C)(C)C -25 9649 http://www.s PHYSPROP
    19862 2,2-dimethyl CC(C)(C)C -16.4 9646 http://www.s PHYSPROP
    19863 ketene C=C=O -151 9643 http://www.s PHYSPROP
    19864 carbonyl sulfi O=C=S -138.8 9644 http://www.s PHYSPROP
    19865 1-fluoronona CCCCCCCCCF 1 9634 http://www.s PHYSPROP
    19866 1,2-propadienC=C=C -136.2 9642 http://www.s PHYSPROP
    19867 diethoxymethCCOCOCC -66.5 9630 http://www.s PHYSPROP
    19868 tridecan-7-on CCCCCCC(=O) 33 9621 http://www.s PHYSPROP
    19869 chlorphentermClc1ccc(CC(C) 52.5 9613 http://www.s PHYSPROP x salt - AL
    19870 fluorobenzen Fc1ccccc1 -42.2 9614 http://www.s PHYSPROP
    19871 hydantoin O=C1NC(=O)C 220 9612 http://www.s PHYSPROP
    19872 2-cyanoguanidN#CN=C(/N)N 211 9611 http://www.s PHYSPROP
    19873 propane, 3-chlClCCC(F)(F)F -106.5 9606 http://www.s PHYSPROP
    19874 cyanogen N#CC#N -27.9 9605 http://www.s PHYSPROP
    19875 1-fluoropropaCCCF -159 9604 http://www.s PHYSPROP
    19876 diacetylene C#CC#C -36.4 9603 http://www.s PHYSPROP
    19877 p-fluorobenzoiOC(=O)c1ccc(F 185 9579 http://www.s PHYSPROP
    19878 m-fluoroanisoFc1cccc(OC)c1 -35 9581 http://www.s PHYSPROP
    19879 2-propylpiperCCCC1CCCCN1 -2 9591 http://www.s PHYSPROP
    19880 p-cf3 benzoic FC(F)(F)c1ccc 219.5 9572 http://www.s PHYSPROP
    19881 m-fluorobenzoOC(=O)c1cc(F) 124 9574 http://www.s PHYSPROP
    19882 p-fluorosulfonCc1ccc(cc1)S( 41.5 9571 http://www.s PHYSPROP
    19883 p-trifluorometFC(F)(F)c1ccc( 38 9570 http://www.s PHYSPROP
    19884 m-trifluoromeFC(F)(F)c1ccc 105.5 9569 http://www.s PHYSPROP
    19885 fluoressigsae FCC(=O)OC -35 9565 http://www.s PHYSPROP
    19886 benzenamine,Cc1ccc(N)cc1F 31 9563 http://www.s PHYSPROP
    19887 1,2-benzenediCc1cc(O)c(O)c 65 9564 http://www.s PHYSPROP
    19888 2-phenylacet O=C(Cc1ccccc 60 9554 http://www.s PHYSPROP
    19889 fluoromethyl O=C(CF)c1ccc 29 9553 http://www.s PHYSPROP
    19890 1,2-dihydronac1ccc2CCC=Cc -8 9550 http://www.s PHYSPROP
    19891 5-fluoro-2-ni O=[N+]([O-])c 36 9549 http://www.s PHYSPROP
    19892 2-fluorobenzoiOC(=O)c1cccc 126.5 9547 http://www.s PHYSPROP
    19893 4-thiazolidineO=C(O)C1CSC 196.5 9546 http://www.s PHYSPROP
    19894 2,3,4,5,6-pentFc1c(CO)c(F)c( 37.5 9535 http://www.s PHYSPROP
    19895 xanthinol niacOCCN(C)CC(O) 180 9526 http://www.s PHYSPROP
    19896 octafluorotol Fc1c(c(F)c(F)c -65.6 9522 http://www.s PHYSPROP
    19897 trifluoroacet O=C(c1ccccc1) -40 9521 http://www.s PHYSPROP
    19898 benzoic acid, FC(F)(F)c1ccc 111 9515 http://www.s PHYSPROP
    19899 hcfc 226 FC(F)(F)C(Cl)C( -119.6 9510 http://www.s PHYSPROP
    19900 1,1,2-trifluor FCC(F)F -84 9506 http://www.s PHYSPROP
    19901 methyl fluoro FS(=O)(=O)OC -95 9486 http://www.s PHYSPROP
    19902 1,1,1-trifluor CC(F)(F)F -111.3 9484 http://www.s PHYSPROP
    19903 2-fluoropropaCC(C)F 133.4 9483 http://www.s PHYSPROP
    19904 cyanamide N#CN 45.56 9480 http://www.s PHYSPROP
    19905 5-hepten-2-onC/C(C)=CCCC( -67.1 9478 http://www.s PHYSPROP
    19906 p-fluorophenylFc1ccc(CC(=O) 86 9454 http://www.s PHYSPROP
    19907 2-fluoro-4-ni Fc1cc(ccc1O)[ 121 9442 http://www.s PHYSPROP
    19908 benzene, 1-nitO=[N+]([O-])c1 39 9438 http://www.s PHYSPROP
    19909 benzene, 1-brFC(F)(F)c1cc(B 1 9434 http://www.s PHYSPROP
    19910 1,3-dino2 2-clO=[N+]([O-])c1 57 9426 http://www.s PHYSPROP
    19911 benzoyl chloriO=C(Cl)c1cccc 4 9425 http://www.s PHYSPROP
    19912 prenylamine lCC(Cc1ccccc1) 141 9418 http://www.s PHYSPROP x salt JCB
    19913 prenylamine CC(Cc1ccccc1) 36.5 9418 http://www.s PHYSPROP
    19914 benzoic acid, OC(=O)c1c(F)c 159 9413 http://www.s PHYSPROP
    19915 1-no2 2-cf3 b O=[N+]([O-])c 32.5 9412 http://www.s PHYSPROP
    19916 andrenostero O=C3CCC2C1C 222 9408 http://www.s PHYSPROP
    19917 1-nonanol, 2,2FC(F)(C(F)(F)C 56 9396 http://www.s PHYSPROP
    19918 butanoic acid,FC(F)(C(F)(F)C -17.5 9394 http://www.s PHYSPROP
    19919 1,1-dichloro-1FC(F)(F)C(Cl)(C -56.6 9392 http://www.s PHYSPROP
    19920 1-fluorohexanCCCCCCF -103 9377 http://www.s PHYSPROP
    19921 m-fluorophenFc1cccc(O)c1 13.7 9360 http://www.s PHYSPROP
    19922 cyanoacetic acN#CCC(=O)O 66 9357 http://www.s PHYSPROP
    19923 isopestox FP(=O)(NC(C)C 65 9355 http://www.s PHYSPROP
    19924 2-fluoroethanFCCO -26.4 9354 http://www.s PHYSPROP
    19925 4-fluoroanilin Fc1ccc(N)cc1 -0.8 9349 http://www.s PHYSPROP
    19926 p-fluorophenoFc1ccc(O)cc1 48 9350 http://www.s PHYSPROP
    19927 cloflucarban FC(F)(F)c1cc( 214.5 9337 http://www.s PHYSPROP
    19928 2,4,6-tris-(tri FC(F)(F)c1nc(n -24.8 9333 http://www.s PHYSPROP
    19929 trifluorophenyF[Si](F)(F)c1c -18 9330 http://www.s PHYSPROP
    19930 2,4-difluoroanFc1ccc(N)c(F) -7.5 9328 http://www.s PHYSPROP
    19931 3-chloro-4-fluNc1cc(Cl)c(F)c 45.5 9327 http://www.s PHYSPROP
    19932 o-fluorophenoFc1ccccc1O 16.1 9326 http://www.s PHYSPROP
    19933 1,2-difluorob Fc1ccccc1F -34 9325 http://www.s PHYSPROP
    19934 n,n,n',n'-tetr CN(C)c1ccc(cc 194 9321 http://www.s PHYSPROP
    19935 p-hydroxyephOC(c1ccc(O)cc 153 9320 http://www.s PHYSPROP
    19936 2,5-cyclohexaO=C2C=CC(=O) 114 9307 http://www.s PHYSPROP
    19937 1,1,2,2-tetraf FC(F)C(F)F -89 9286 http://www.s PHYSPROP
    19938 trifluoroethenFC=C(/F)F -78 9284 http://www.s PHYSPROP
    19939 chloro-1,1-dif ClC=C(/F)F -138.5 9283 http://www.s PHYSPROP
    19940 dextromoramiCC(CN1CCOCC1 182 9269 http://www.s PHYSPROP
    19941 hexapropymaO=C(N)OC1(C 99 9280 http://www.s PHYSPROP
    19942 1,2-dichloro-1FC1(F)C(F)(F)C -24.2 9266 http://www.s PHYSPROP
    19943 perfluoro-n-h FC(F)(C(F)(F)C( -88.2 9262 http://www.s PHYSPROP x mixture JCB
    19944 perfluoromethFC1(F)C(F)(F)C -44.7 9260 http://www.s PHYSPROP
    19945 1,1,1-trichlor ClC(Cl)(Cl)C(F) 14.2 9258 http://www.s PHYSPROP
    19946 1,2-dibromo-1BrC(F)(F)C(Br) 50 9257 http://www.s PHYSPROP
    19947 1,1,1,2,2-pen FC(F)C(F)(F)F -103 9256 http://www.s PHYSPROP
    19948 ethane, 1-chloFC(F)C(Cl)(F)F -117 9255 http://www.s PHYSPROP
    19949 ethane, 1,2-diClC(F)(F)C(Cl)F -78 9254 http://www.s PHYSPROP
    19950 bromochlorodBrC(Cl)(F)F -159.5 9248 http://www.s PHYSPROP
    19951 methane, brom
    BrC(Cl)(Cl)F -106 9247 http://www.s PHYSPROP
    19952 fluoroethane CCF -143.2 9243 http://www.s PHYSPROP
    19953 carbonic diflu FC(F)=O -111.2 9246 http://www.s PHYSPROP
    19954 8-fluoro-octanO=C(O)CCCCC 35 9239 http://www.s PHYSPROP
    19955 diethylsulfide CCSCC -103.9 9233 http://www.s PHYSPROP
    19956 p-chlorofluor Fc1ccc(Cl)cc1 -26.8 9228 http://www.s PHYSPROP
    19957 4-fluoroacetanO=C(C)Nc1ccc( 154 9225 http://www.s PHYSPROP
    19958 m-(trifluoromeO=C(C)Nc1cc(c 104.5 9219 http://www.s PHYSPROP
    19959 3-fluoroacetanO=C(C)Nc1cccc 83 9218 http://www.s PHYSPROP
    19960 benzyl fluorid FCc1ccccc1 -35 9215 http://www.s PHYSPROP
    19961 benzenesulfony
    Fc1ccc(cc1)S( 30 9212 http://www.s PHYSPROP
    19962 2-fluoroanilin Fc1ccccc1N -34.6 9208 http://www.s PHYSPROP
    19963 4,4'-difluoro O=C(c1ccc(F)c 103.5 9206 http://www.s PHYSPROP
    19964 mecloqualoneClc1ccccc1N3 127 9192 http://www.s PHYSPROP
    19965 glymidine O=S(=O)(Nc1n 153 9190 http://www.s PHYSPROP
    19966 carbutamide Nc1ccc(cc1)S 144.5 9189 http://www.s PHYSPROP
    19967 perfluorooctanFC(F)(C(F)(F)C 54.3 9180 http://www.s PHYSPROP
    19968 perfluoroheptFC(F)(C(F)(F)C( -78 9179 http://www.s PHYSPROP
    19969 diazomethaneC=N#N -145 9176 http://www.s PHYSPROP
    19970 10-fluoro-dec FCCCCCCCCCC 22 9173 http://www.s PHYSPROP
    19971 10-fluoro-decaO=C(O)CCCCC 49 9169 http://www.s PHYSPROP
    19972 linuron Clc1ccc(NC(=O 93 9130 http://www.s PHYSPROP
    19973 1-fluorodecanCCCCCCCCCCF -35 9168 http://www.s PHYSPROP
    19974 6-aminonicot O=C(N)c1cnc( 246.5 9128 http://www.s PHYSPROP
    19975 2,5-dinitroph O=[N+]([O-])c 108 9120 http://www.s PHYSPROP
    19976 3,4-dichlorobeClc1ccc(cc1Cl) -12.5 9109 http://www.s PHYSPROP
    19977 a-aminocaproiCCCCC(N)C(=O 298.5 9103 http://www.s PHYSPROP
    19978 phenyramidolOC(CNc1ccccn 83.5 9098 http://www.s PHYSPROP
    19979 triflusal O=C(C)Oc1cc(c 121 9086 http://www.s PHYSPROP
    19980 4-fluorobipheFc1ccc(cc1)c2 74.2 9089 http://www.s PHYSPROP
    19981 haloxon O=P(OCCCl)(O 91 9082 http://www.s PHYSPROP
    19982 1-fluoronaphtFc2cccc1ccccc -9 9078 http://www.s PHYSPROP
    19983 5-chlorosalicylOc1ccc(Cl)cc1 171.5 9075 http://www.s PHYSPROP
    19984 benzoic acid, Oc1c(cc(Cl)cc 220.5 9073 http://www.s PHYSPROP
    19985 6',7',10,11-t COc4cc5CCNC( 74 9055 http://www.s PHYSPROP
    19986 2,4-dichloro( FC(F)(F)c1ccc( -26 9071 http://www.s PHYSPROP
    19987 dibenzepin hyCN(C)CCN3c1c 237 9048 http://www.s PHYSPROP x salt JCB
    19988 opipramol hydOCCN1CCN(CC1 229 9046 http://www.s PHYSPROP x salt JCB
    19989 opipramol OCCN1CCN(CC1 100.5 9046 http://www.s PHYSPROP
    19990 mexacarbate O=C(Oc1cc(C)c 85 9043 http://www.s PHYSPROP
    19991 isocil O=C1NC(C)=C( 158.5 9041 http://www.s PHYSPROP
    19992 bromacil CCC(C)N1C(=O 158 9040 http://www.s PHYSPROP
    19993 difluorodinit Fc1ccc(cc1[N+ 193.5 9028 http://www.s PHYSPROP
    19994 paraoxon [O-][N+](=O) 300 9026 http://www.s PHYSPROP
    19995 octane, octad FC(F)(C(F)(F)C( -23.2 9018 http://www.s PHYSPROP
    19996 perfluorobutylFC(F)(OC(F)(F)C -100 9021 http://www.s PHYSPROP
    19997 1,1,1-trifluor ClC(Cl)C(F)(F)F -107 9016 http://www.s PHYSPROP
    19998 pivalylbenzhy CC(C)(C)C(=O 68.5 9007 http://www.s PHYSPROP
    19999 phenol, 2,6-diIc1cc(cc(I)c1O 157 9002 http://www.s PHYSPROP
    20000 l-histidine, n- O=C(O)C(NC(= 260 9001 http://www.s PHYSPROP
    20001 hydrazine, (2, NNc1cc(Cl)ccc 102.5 8998 http://www.s PHYSPROP
    20002 benzamide, n,Oc1ccc(cc1OC 95 8996 http://www.s PHYSPROP
    20003 succimer O=C(O)C(S)C( 193 8988 http://www.s PHYSPROP
    20004 3-phenylsalicyOC(=O)c2cccc 186.5 8983 http://www.s PHYSPROP
    20005 meparfynol c C#CC(C)(CC)O 55.8 8969 http://www.s PHYSPROP
    20006 phenol, 3-meth
    O=[N+]([O-])c 55.5 8975 http://www.s PHYSPROP
    20007 uredepa O=P(NC(=O)O 89 8968 http://www.s PHYSPROP
    20008 piritramide N#CC(CCN1CCC 149.5 8967 http://www.s PHYSPROP
    20009 benactyzine OC(C(=O)OCCN 51 8966 http://www.s PHYSPROP
    20010 hydrazine NN 2 8960 http://www.s PHYSPROP
    20011 allylbenzene C=CCc1ccccc1 -40 8950 http://www.s PHYSPROP
    20012 crufomate Clc1cc(ccc1OP 60 8941 http://www.s PHYSPROP
    20013 dmpa Clc1cc(Cl)ccc 51.4 8940 http://www.s PHYSPROP
    20014 ronnel Clc1cc(OP(=S) 41 8939 http://www.s PHYSPROP
    20015 indopan CC(N)Cc2cnc1 99 8930 http://www.s PHYSPROP
    20016 bulbocapnine CN3CCc2cc5OC 199.5 8919 http://www.s PHYSPROP
    20017 bis(2-ethylhe CCCCC(COP(O) -50 8918 http://www.s PHYSPROP
    20018 o,o-diethyl d CCOP(=S)(S)O -10 8917 http://www.s PHYSPROP
    20019 isobenzan ClC2=C(Cl)C3( 121 8914 http://www.s PHYSPROP
    20020 thionazin S=P(Oc1cnccn -1.7 8915 http://www.s PHYSPROP
    20021 1,4,7,10-tetr C1COCCOCCO 16 8912 http://www.s PHYSPROP
    20022 cyclododecanC1CCCCCCCCC 60.4 8911 http://www.s PHYSPROP
    20023 cyclododecanC1CCCCCCCCC 59 8911 http://www.s PHYSPROP
    20024 cyclodecane C1CCCCCCCCC 10 8910 http://www.s PHYSPROP
    20025 cyclooctane C1CCCCCCC1 14.8 8909 http://www.s PHYSPROP
    20026 cycloheptane C1CCCCCC1 -8 8908 http://www.s PHYSPROP
    20027 1,3,5-trithian C1SCSCS1 220 8907 http://www.s PHYSPROP
    20028 sym-triazine c1ncncn1 86 8905 http://www.s PHYSPROP
    20029 pyrazine c1cnccn1 55 8904 http://www.s PHYSPROP
    20030 pyridazine c1cccnn1 -8 8902 http://www.s PHYSPROP
    20031 pyrimidine c1ccncn1 22 8903 http://www.s PHYSPROP
    20032 1h-1,2,4-triaz c1ncnn1 120 8900 http://www.s PHYSPROP
    20033 cyclopentane C1CCCC1 -93.8 8896 http://www.s PHYSPROP
    20034 thiacyclobuta C1CCS1 -73.2 8895 http://www.s PHYSPROP
    20035 cyclobutane C1CCC1 -90.6 8894 http://www.s PHYSPROP
    20036 tricyclo[3.3.1 C1C3CC2CC(C 205 8883 http://www.s PHYSPROP x clearly out of range JCB
    20037 1,4-diazabicycC1CN2CCN1C 159 8882 http://www.s PHYSPROP
    20038 bicyclo(2.2.1. C1CC2CCC1C2 87.5 8878 http://www.s PHYSPROP
    20039 azulene c1cccc2cccc2c 99 8876 http://www.s PHYSPROP
    20040 indolizine c1ccc2ccccn1 75 8875 http://www.s PHYSPROP
    20041 benzoxazole c1cccc2ocnc1 31 8873 http://www.s PHYSPROP
    20042 1h-imidazo[4,c1cncc2ncnc1 149.5 8872 http://www.s PHYSPROP
    20043 1,2-benzisothic1cccc2sncc1 38 8870 http://www.s PHYSPROP
    20044 1h-pyrrolo(2,3c1ccnc2nccc1 106 8867 http://www.s PHYSPROP
    20045 indazole c1cccc2nncc1 148 8866 http://www.s PHYSPROP
    20046 dibenzo-p-dioc1ccc2Oc3ccc 122 8861 http://www.s PHYSPROP
    20047 acridine c1c3ccccc3nc 108 8860 http://www.s PHYSPROP
    20048 5-azadibenzo(c1cc2Nc3cccc 198 8857 http://www.s PHYSPROP
    20049 quinazoline c1cccc2ncncc 48 8855 http://www.s PHYSPROP
    20050 cinnoline c1cnnc2ccccc 38 8853 http://www.s PHYSPROP
    20051 phthalazine c1cccc2cnncc 90.5 8852 http://www.s PHYSPROP
    20052 benzo(b)naphtc1ccc2c3sc4cc 189 8843 http://www.s PHYSPROP
    20053 11h-benzo(b)fc1cccc2Cc3cc 212 8846 http://www.s PHYSPROP
    20054 11h-benzo(a)fc1ccc2c3Cc4c 189.5 8840 http://www.s PHYSPROP
    20055 benzo(h)quinoc1cccc3c1ccc 52 8836 http://www.s PHYSPROP
    20056 5,6-diazaphenc1cccc2nnc3c 158 8835 http://www.s PHYSPROP
    20057 phenanthridinc1cccc2cnc3c 107.4 8834 http://www.s PHYSPROP
    20058 dibenz(a,h)acrc2cccc3ccc1n 226 8828 http://www.s PHYSPROP
    20059 benz(c)acridinc1c3c4ccccc4 132 8825 http://www.s PHYSPROP
    20060 dibenz[a,j]acr c3cccc4ccc2n 216 8822 http://www.s PHYSPROP
    20061 chrysene c1cc4ccccc4c2 258.2 8817 http://www.s PHYSPROP
    20062 triphenylene c3cc4c1ccccc1 199 8816 http://www.s PHYSPROP
    20063 1,2,3,4-diben c3cc4c1ccccc1 206 8810 http://www.s PHYSPROP
    20064 picene c3cc5ccccc5c4 368 8808 http://www.s PHYSPROP
    20065 acenaphthyle c1cc2cccc3C=C 92.5 8807 http://www.s PHYSPROP
    20066 benzo(k)fluor c3c5c1cccc2cc 217 8804 http://www.s PHYSPROP
    20067 fluoranthene c1cccc4c1c2c 107.8 8800 http://www.s PHYSPROP
    20068 benzo(b)fluor c1cccc5c1cc4 168 8799 http://www.s PHYSPROP
    20069 benzo(j)fluor c1cc5ccccc5c 166 8798 http://www.s PHYSPROP
    20070 perylene c1ccc5cccc4c 274 8788 http://www.s PHYSPROP
    20071 4,5-methylen c1cc2cccc3Cc 114 8793 http://www.s PHYSPROP
    20072 benzo(c)phenc3cc2ccc1cccc 68 8782 http://www.s PHYSPROP
    20073 7h-dibenzo(c, c1cccc3c1ccc 158 8780 http://www.s PHYSPROP
    20074 indeno(1,2,3- c5ccc6c1cc2cc 163.6 8777 http://www.s PHYSPROP
    20075 benzo(e)pyre c3ccc2ccc1cc 177.5 8774 http://www.s PHYSPROP
    20076 dibenzo[a,e]pc3cc4c2ccc1cc 233.5 8772 http://www.s PHYSPROP
    20077 dibenzo[a,l]p c1cccc6c1cc3 162.4 8765 http://www.s PHYSPROP
    20078 benzo(ghi)perc3cc2ccc1ccc 278 8763 http://www.s PHYSPROP
    20079 coronene c1cc2ccc3ccc 437.3 8761 http://www.s PHYSPROP
    20080 dibenzo[a,h]pc2cc3cc1cccc 317 8754 http://www.s PHYSPROP
    20081 dibenzo(a,i)p c2cc5cc1ccccc 281.5 8752 http://www.s PHYSPROP
    20082 spiropentane C1CC12CC2 -134.6 8734 http://www.s PHYSPROP
    20083 propanolaminNCCCO 11 8733 http://www.s PHYSPROP
    20084 hypoglycine aOC(=O)C(N)C 282 8728 http://www.s PHYSPROP
    20085 4-nitroso-n-p O=Nc2ccc(Nc1 143 8721 http://www.s PHYSPROP
    20086 sulfalene COc2nccnc2NS 176 8695 http://www.s PHYSPROP
    20087 cycloguanil Clc1ccc(cc1) 146 8697 http://www.s PHYSPROP
    20088 octamethylpyCN(C)P(=O)(OP 17 8685 http://www.s PHYSPROP
    20089 aziridine C1CN1 -77.9 8682 http://www.s PHYSPROP
    20090 3-octanol, 3,6CCC(C)(O)CCC -67.5 8676 http://www.s PHYSPROP
    20091 m-dimethoxy COc1cccc(OC) -52 8674 http://www.s PHYSPROP
    20092 dulcin CCOc1ccc(cc1 173.5 8663 http://www.s PHYSPROP
    20093 p-methoxypheOc1ccc(OC)cc 57 8665 http://www.s PHYSPROP
    20094 disulfide, bis S(SCc1ccccc1) 71.5 8662 http://www.s PHYSPROP
    20095 merphos CCCCSP(SCCC 100 8661 http://www.s PHYSPROP
    20096 triethyl borat CCOB(OCC)OC -84.8 8659 http://www.s PHYSPROP
    20097 trimethoxymeCOC(OC)OC 15 8655 http://www.s PHYSPROP
    20098 1,2-dihydro-2,CC2=CC(C)(C) 26.5 8633 http://www.s PHYSPROP
    20099 aphrodine O=C(OC)[C@H 241 8622 http://www.s PHYSPROP
    20100 chlorindanol Oc1ccc(Cl)c2 92 8617 http://www.s PHYSPROP
    20101 2,2,4-trimethyCC(C)(CO)C(O) 51.5 8602 http://www.s PHYSPROP
    20102 anileridine O=C(OCC)C2(C 83 8600 http://www.s PHYSPROP
    20103 n-hexadecyla CCCCCCCCCCC 46.8 8584 http://www.s PHYSPROP
    20104 1,6-hexanediaNCCCCCCNCC 33 8582 http://www.s PHYSPROP
    20105 triethylene gl OCCOCCOCCO -30 8581 http://www.s PHYSPROP
    20106 1-bromo-n-doBrCCCCCCCCC -9.5 8579 http://www.s PHYSPROP
    20107 1-hexanamine,CCCCCCNCCCC -13.1 8580 http://www.s PHYSPROP
    20108 acetic acid, noCC(=O)OCCCC -26 8578 http://www.s PHYSPROP
    20109 1-decanethiolCCCCCCCCCCS -26 8577 http://www.s PHYSPROP
    20110 n-decylamine CCCCCCCCCC 17 8576 http://www.s PHYSPROP
    20111 1-nonanol CCCCCCCCCO -5 8574 http://www.s PHYSPROP
    20112 di-n-butyl ethCCCCOCCCC -95.2 8569 http://www.s PHYSPROP
    20113 n-hexyl acetatO=C(C)OCCCC -80.9 8568 http://www.s PHYSPROP
    20114 isopropyl palmCC(C)OC(=O) 13.5 8567 http://www.s PHYSPROP
    20115 dodecyl 2-metC=C(C)C(=O) -7 8566 http://www.s PHYSPROP
    20116 dipropylamin CCCNCCC -63 8562 http://www.s PHYSPROP
    20117 n-heptane CCCCCCC -90.6 8560 http://www.s PHYSPROP
    20118 glycine, n-(ca O=C(O)CNCC( 247.5 8557 http://www.s PHYSPROP
    20119 tetrahydropyrC1CCCCO1 -45 8554 http://www.s PHYSPROP
    20120 hexanoic acid CCCCCC(=O)O -3 8552 http://www.s PHYSPROP
    20121 2,5-dimethyl- CC(O)(C)C#CC( 95 8545 http://www.s PHYSPROP
    20122 cyclopentene C1C=CCC1 -135.1 8544 http://www.s PHYSPROP
    20123 1,3-dichlorop ClCCCCl -99.5 8543 http://www.s PHYSPROP
    20124 acetamide, n-CC(=O)NCCO 16 8542 http://www.s PHYSPROP
    20125 diallyl diglyco C=CCOC(=O)O -4 8541 http://www.s PHYSPROP
    20126 2-hydroxypyriOc1ccccn1 107.8 8537 http://www.s PHYSPROP
    20127 2-hydroxypyriOc1ccccn1 107.8 8537 http://www.s PHYSPROP
    20128 m-diethylben CCc1cccc(CC)c -83.9 8531 http://www.s PHYSPROP
    20129 2,6-pyridined Nc1cccc(N)n1 121.5 8528 http://www.s PHYSPROP
    20130 urea, (aminoi N=C(N)NC(N) 105 8527 http://www.s PHYSPROP
    20131 mesityl oxide CC(C)=C/C(C) -59 8526 http://www.s PHYSPROP
    20132 ethyl acetate CC(=O)OCC -83.6 8525 http://www.s PHYSPROP
    20133 3-iodopropionICCC(=O)O 81.5 8524 http://www.s PHYSPROP
    20134 butanoyl chlo CCCC(Cl)=O -89 8523 http://www.s PHYSPROP
    20135 dodecamethylC[Si](C)(C)O[Si -80 8521 http://www.s PHYSPROP
    20136 decamethyltetC[Si](C)(C)O[Si -76 8520 http://www.s PHYSPROP
    20137 t-octyl merca CC(C)(C)CC(C) -74 8519 http://www.s PHYSPROP
    20138 butyl acrylate C=CC(=O)OCC -64.6 8514 http://www.s PHYSPROP
    20139 bis(2-(2-butoxCCCCOCCOCCO -47 8504 http://www.s PHYSPROP
    20140 diisobutyl adi CC(C)COC(=O) -20 8499 http://www.s PHYSPROP
    20141 dimethylol ur OCNC(=O)NC 126 8496 http://www.s PHYSPROP
    20142 ethyl acrylate C=CC(=O)OCC -71.2 8490 http://www.s PHYSPROP
    20143 cyacetacide N#CCC(=O)NN 114.5 8489 http://www.s PHYSPROP
    20144 p-(1,1,3,3-te Oc1ccc(cc1)C( 84.5 8483 http://www.s PHYSPROP
    20145 aramite CC(C)(C)c1ccc -31.7 8479 http://www.s PHYSPROP
    20146 monuron Clc1ccc(NC(=O 170.5 8470 http://www.s PHYSPROP
    20147 nithiamide O=C(C)Nc1ncc( 264.5 8468 http://www.s PHYSPROP
    20148 1-piperazine NCCN1CCNCC -19 8465 http://www.s PHYSPROP
    20149 1,2-ethanediaC(NCc1ccccc1 26 8463 http://www.s PHYSPROP
    20150 dodecanoic acCCCCCCCCCCC 8.5 8461 http://www.s PHYSPROP
    20151 carbonic dihydO=C(NNc1cccc 170 8459 http://www.s PHYSPROP
    20152 nithiazide O=C(Nc1ncc(s 228 8446 http://www.s PHYSPROP
    20153 ethanol, 2,2'- CCN(CCO)CCO -50 8439 http://www.s PHYSPROP
    20154 diphenylsulfidc1ccccc1Sc2cc -25.9 8436 http://www.s PHYSPROP
    20155 4,4'-thiodianilNc1ccc(cc1)Sc 108.5 8435 http://www.s PHYSPROP
    20156 p-phenoxyanilNc2ccc(Oc1ccc 83 8434 http://www.s PHYSPROP
    20157 p-nitroso-n,n-CN(C)c1ccc(N 92.5 8419 http://www.s PHYSPROP
    20158 beta-terpineoCC1(O)CCC(CC 32.5 8418 http://www.s PHYSPROP
    20159 butyl lactate OC(C)C(=O)O -28 8409 http://www.s PHYSPROP
    20160 phenol, 2,4-diOc1ccc(cc1C -13 8406 http://www.s PHYSPROP
    20161 2-aminobenzoNc1nc2ccccc2 132 8382 http://www.s PHYSPROP
    20162 1h-benzotriazCc1cc2nnnc2c 81 8381 http://www.s PHYSPROP
    20163 benzenamine,CCOc1ccc(cc1N 96.5 8378 http://www.s PHYSPROP
    20164 2,4-des Clc1cc(Cl)cc 170 8377 http://www.s PHYSPROP
    20165 butyl benzoatO=C(OCCCC)c1 -22.4 8374 http://www.s PHYSPROP
    20166 resorcinol m O=C(Oc1cccc( 134 8366 http://www.s PHYSPROP
    20167 1,3-diphenyl-1N(=NNc1ccccc 98 8365 http://www.s PHYSPROP
    20168 erbon Clc1cc(OCCOC( 49.5 8362 http://www.s PHYSPROP
    20169 isobutylbenzeCCC(C)c1ccccc -51.4 8356 http://www.s PHYSPROP
    20170 sec-butylbenzCCC(C)c1ccccc -82.7 8356 http://www.s PHYSPROP
    20171 n-phenyl-2-n c1cc3ccccc3c 108 8355 http://www.s PHYSPROP
    20172 1,1':4',1'':4'' c1cc(ccc1c2cc 320 8353 http://www.s PHYSPROP
    20173 4-amino-4'-chClc1ccc(cc1)c 134 8351 http://www.s PHYSPROP
    20174 pentacene c1c3cc4cc5ccc 257 8347 http://www.s PHYSPROP
    20175 indole, 3,3'-mc3n(CN1CCCCC 138 8344 http://www.s PHYSPROP
    20176 2-naphthol Oc1ccc2ccccc 123 8341 http://www.s PHYSPROP
    20177 o-diethylbenzCCc1ccccc1CC -31.2 8335 http://www.s PHYSPROP
    20178 benzaldehyde,COc1cc(cc(OC 113 8333 http://www.s PHYSPROP
    20179 methanone, (4O=C(c1ccc(Cl) 77.5 8331 http://www.s PHYSPROP
    20180 methanone, (4Cc1ccc(cc1)C( 59.5 8330 http://www.s PHYSPROP
    20181 benzil O=C(C(=O)c1cc 94.8 8329 http://www.s PHYSPROP
    20182 8-azaguanine O=C1N=C(N)N 300 8325 http://www.s PHYSPROP
    20183 amphenidoneNc1cc(ccc1)N 183 8320 http://www.s PHYSPROP
    20184 1-naphthylamNc2cccc1cccc 49.2 8319 http://www.s PHYSPROP
    20185 3,5-diiodosalicIc1cc(C(=O)O)c 235.5 8310 http://www.s PHYSPROP
    20186 3-amino-2,5-dClc1cc(C(=O)O 200 8309 http://www.s PHYSPROP
    20187 phenol, 2,4-diCc1cc(O)c(Cl)c 83 8302 http://www.s PHYSPROP
    20188 pentachlorothClc1c(S)c(Cl)c( 231.5 8301 http://www.s PHYSPROP
    20189 3-indolebutyriO=C(O)CCCc2c 124.5 8298 http://www.s PHYSPROP
    20190 peucedanin CC(C)c2oc1cc 85 8297 http://www.s PHYSPROP
    20191 phenyl-4-aminOc2cc(N)ccc2 153 8290 http://www.s PHYSPROP
    20192 captan ClC(Cl)(Cl)S 178 8287 http://www.s PHYSPROP
    20193 naphthalene-1Oc2cc(O)cc1c 123.5 8282 http://www.s PHYSPROP
    20194 1-naphthaleneN#CCc2cccc1c 32.5 8277 http://www.s PHYSPROP
    20195 npa (naptalamO=C(O)c1cccc 185 8275 http://www.s PHYSPROP
    20196 2-phenylcinchO=C(O)c1cc(nc 214.5 8274 http://www.s PHYSPROP
    20197 3-amino-9-ethNc2cc3c1cccc 99 8269 http://www.s PHYSPROP
    20198 1-nitroso-2-n O=Nc1c2ccccc 109.5 8262 http://www.s PHYSPROP
    20199 yellow ob Cc3ccccc3/N= 125.5 8260 http://www.s PHYSPROP
    20200 monobutyl phtO=C(O)c1cccc 73.5 8257 http://www.s PHYSPROP
    20201 phthalylsulfa O=S(=O)(NC(C 196 8256 http://www.s PHYSPROP
    20202 phthalofyne O=C(O)c1cccc 97 8255 http://www.s PHYSPROP
    20203 methanone, (2O=C(c1ccc(O) 144 8254 http://www.s PHYSPROP
    20204 2,2',4,4'-tet O=C(c1ccc(O) 201.5 8253 http://www.s PHYSPROP
    20205 methanone, biO=C(c1ccc(cc 139.5 8252 http://www.s PHYSPROP
    20206 dioxybenzoneO=C(c1ccc(cc 68 8251 http://www.s PHYSPROP
    20207 narceine O=C(O)c1c(OC 138 8246 http://www.s PHYSPROP
    20208 di-n-amyl pht O=C(OCCCCC) -55 8243 http://www.s PHYSPROP
    20209 diallylphthala O=C(OCC=C)c1 -70 8242 http://www.s PHYSPROP
    20210 9,10-anthraceClc2ccc3C(=O) 211 8235 http://www.s PHYSPROP
    20211 2-anthracenesu
    O=S(=O)(O)c2 300 8234 http://www.s PHYSPROP
    20212 pamoic acid O=C(O)c4cc1c 315 8228 http://www.s PHYSPROP
    20213 2-cyclohexyl-4[O-][N+](=O)c 107 8223 http://www.s PHYSPROP
    20214 1,4-naphthoq O=C2C=CC(=O) 128.5 8215 http://www.s PHYSPROP
    20215 9h-fluoren-9-o[O-][N+](=O)c 176 8207 http://www.s PHYSPROP
    20216 9,10-anthraceNc3cccc2c3C( 319 8199 http://www.s PHYSPROP
    20217 1-hydroxyant O=C3c1ccccc1 193.8 8198 http://www.s PHYSPROP
    20218 1-chloro-2-meO=C3c1ccccc1 170.5 8195 http://www.s PHYSPROP
    20219 benzoyl chloriO=[N+]([O-])c 75 8188 http://www.s PHYSPROP
    20220 benzoyl chloriO=C(Cl)c1ccc( 16 8187 http://www.s PHYSPROP
    20221 p-methylacet Cc1ccc(cc1)C( 28 8186 http://www.s PHYSPROP
    20222 m-nitrobenzoiO=[N+]([O-])c 141 8183 http://www.s PHYSPROP
    20223 isophthalic ac OC(=O)c1cccc 347 8182 http://www.s PHYSPROP
    20224 benzoyl chloriO=[N+]([O-])c 36 8181 http://www.s PHYSPROP
    20225 2-chloro-4-nitNc1ccc(cc1Cl) 108 8179 http://www.s PHYSPROP
    20226 2-chloro-4-ni Cc1ccc(cc1Cl) 66.5 8178 http://www.s PHYSPROP
    20227 1,3,5,-trinitr O=[N+]([O-])N 205.5 8177 http://www.s PHYSPROP
    20228 m-hydroxyaceO=C(C)c1cc(O) 96 8174 http://www.s PHYSPROP
    20229 acetamide, n-O=S(N)(=O)c1 219.5 8169 http://www.s PHYSPROP
    20230 benzenesulfony
    O=S(Cl)(=O)c1 149 8168 http://www.s PHYSPROP
    20231 carbarsone O=C(N)Nc1ccc( 174 8167 http://www.s PHYSPROP x metal
    20232 benzenesulfonNc1ccc(cc1)S( 288 8166 http://www.s PHYSPROP
    20233 bicyclo(2.2.1) C1=CC2C=CC1 -19.1 8160 http://www.s PHYSPROP
    20234 trimethyl phoCOP(OC)OC -78 8159 http://www.s PHYSPROP
    20235 triethylamine CCN(CC)CC -114.7 8158 http://www.s PHYSPROP
    20236 methyl borateCOB(OC)OC -29.3 8157 http://www.s PHYSPROP
    20237 trimethyl bor COB(OC)OC -34 8157 http://www.s PHYSPROP
    20238 4-hydroxy-3-mOc1ccc(cc1OC 211.5 8155 http://www.s PHYSPROP
    20239 benzaldehyde,CCOc1cc(ccc1 77.5 8154 http://www.s PHYSPROP
    20240 benzene, 1-chlO=[N+]([O-])c1 -2.5 8151 http://www.s PHYSPROP
    20241 2,4-dinitrotol Cc1ccc(cc1[N+ 71 8150 http://www.s PHYSPROP
    20242 phenol, 2,6-diCc3cccc(C)c3O 137.8 8149 http://www.s PHYSPROP
    20243 2,4-di-t-pentyOc1ccc(cc1C(C 25 8144 http://www.s PHYSPROP
    20244 2-imidazolidi O=C1NCCN1 131 8142 http://www.s PHYSPROP
    20245 cyclopentano O=C1CCCC1 -51.3 8141 http://www.s PHYSPROP
    20246 2,4-dichlorop Clc1cc(Cl)c(O) 45 8140 http://www.s PHYSPROP
    20247 2,2'-dithiobis c1cccc2sc(nc1 180 8139 http://www.s PHYSPROP
    20248 2-methylbenzoCc1nc2ccccc2 14 8138 http://www.s PHYSPROP
    20249 diethylene glyO=C(OCCOCCOC 33.5 8129 http://www.s PHYSPROP
    20250 1,3-propanediO=C(CC(=O)c1 70.5 8126 http://www.s PHYSPROP
    20251 propanoic acidClc1cc(Cl)ccc 122 8120 http://www.s PHYSPROP
    20252 dichlorprop Clc1cc(Cl)ccc 117.5 8120 http://www.s PHYSPROP
    20253 5-chloro-2-h Oc2ccc(Cl)cc2 48.5 8118 http://www.s PHYSPROP
    20254 acetic acid, 2 O=C(O)COc1cc 156 8115 http://www.s PHYSPROP
    20255 naphthalene-2O=S(=O)(O)c1 91 8113 http://www.s PHYSPROP
    20256 anthracene c1ccc2cc3cccc 215 8111 http://www.s PHYSPROP
    20257 scoparone COc1cc2C=CC 145.5 8110 http://www.s PHYSPROP
    20258 phenyldietha OCCN(CCO)c1c 57 8109 http://www.s PHYSPROP
    20259 bianisidine Cc1cc(ccc1N)c 131.5 8106 http://www.s PHYSPROP
    20260 2,2'-biquinoli c1cccc2ccc(nc 194.5 8105 http://www.s PHYSPROP
    20261 3,3'-dimethoxNc1ccc(cc1OC) 137 8104 http://www.s PHYSPROP
    20262 benzoic acid, 2O=C(O)c2cccc 288.5 8102 http://www.s PHYSPROP
    20263 2-nitro-n-phe [O-][N+](=O)c 75 8100 http://www.s PHYSPROP
    20264 benzoic acid, OC(=O)c1cccc 98 8099 http://www.s PHYSPROP
    20265 isoquinoline c1cccc2ccncc 26.47 8098 http://www.s PHYSPROP
    20266 tetralin c1ccc2CCCCc2 -35.7 8097 http://www.s PHYSPROP
    20267 4,4'-sulfinyldi Nc1ccc(cc1)S( 175 8095 http://www.s PHYSPROP
    20268 benzenemethan
    OC(c1ccc(Cl)c 60.75 8094 http://www.s PHYSPROP
    20269 dl-benzoin OC(C(=O)c1ccc 137 8093 http://www.s PHYSPROP
    20270 benzoin OC(C(=O)c1ccc 137 8093 http://www.s PHYSPROP
    20271 bis (2-hydrox CC(C)(C)c2cc( 123 8092 http://www.s PHYSPROP
    20272 efloxate O=C(OCC)COc1 123.7 8089 http://www.s PHYSPROP
    20273 1,2(h)-phthal O=C1NN=Cc2c 188 8088 http://www.s PHYSPROP
    20274 4-methyl-2-niO=[N+]([O-])c 36.5 8086 http://www.s PHYSPROP
    20275 2-nitro-p-tolu O=[N+]([O-])c 116.3 8085 http://www.s PHYSPROP
    20276 benzoic acid, OC(=O)c1cc(I) 190 8083 http://www.s PHYSPROP
    20277 2,4-dinitroani COc1ccc(cc1[N 94.5 8080 http://www.s PHYSPROP
    20278 pyridaphenthiCCOP(=S)(OCC 55 8078 http://www.s PHYSPROP
    20279 n-octyl n-decyO=C(OCCCCCC -40 8077 http://www.s PHYSPROP
    20280 2,4,6-trinitro Cc1c(cc(cc1[N 80.1 8073 http://www.s PHYSPROP
    20281 2-chlorobenzoOC(=O)c1cccc 140.2 8071 http://www.s PHYSPROP
    20282 o-toluic acid Cc1ccccc1C(O 103.7 8070 http://www.s PHYSPROP
    20283 chloranil ClC=1C(=O)C(C 290 8068 http://www.s PHYSPROP
    20284 hexachlorobe Clc1c(Cl)c(Cl)c 231.8 8067 http://www.s PHYSPROP
    20285 4h-pyran-4-onCC=1OC=CC(= 161.5 8066 http://www.s PHYSPROP
    20286 2,6-dichlorot Clc1cccc(Cl)c1 25.8 8065 http://www.s PHYSPROP
    20287 1h-indole-3-etCCC(N)Cc2cnc 97 8064 http://www.s PHYSPROP
    20288 phenyl 2-hydrOc2ccccc2C(= 130.5 8058 http://www.s PHYSPROP x clearly out of range JCB
    20289 1,3-dichloro- O=C1N(Cl)C(=O 132 8057 http://www.s PHYSPROP
    20290 2-naphthalenoNc1cccc2ccc( 206 8055 http://www.s PHYSPROP
    20291 benzoic acid, COc1c(cc(cc1 172.3 8054 http://www.s PHYSPROP
    20292 cinchonine O[C@H](C2CC 265 8047 http://www.s PHYSPROP
    20293 o-hydroxybenO=C(c1ccccc1 40 8045 http://www.s PHYSPROP
    20294 dioctyl phthalO=C(OCCCCCC 25 8043 http://www.s PHYSPROP
    20295 bis (2-butoxyeO=C(OCCOCCC -55 8042 http://www.s PHYSPROP
    20296 bis(methoxyetO=C(OCCOC)c -45 8041 http://www.s PHYSPROP
    20297 dichlone O=C2c1ccccc1 195 8039 http://www.s PHYSPROP
    20298 2-aminoanthrNc2ccc3C(=O) 304.5 8038 http://www.s PHYSPROP
    20299 diphenylaceticOC(=O)C(c1ccc 147 8030 http://www.s PHYSPROP
    20300 1,5-dihydroxyOc3cccc2c3C( 280 8025 http://www.s PHYSPROP
    20301 1,3-isobenzofuO=C1OC(=O)c2c 254.5 8023 http://www.s PHYSPROP
    20302 1-amino-4-hy O=C2c1ccccc1 216 8020 http://www.s PHYSPROP
    20303 violanthrone O=C3c2ccc9c1c 492.5 8015 http://www.s PHYSPROP
    20304 methyl dichlo ClC(Cl)C(=O)O -51.9 8013 http://www.s PHYSPROP
    20305 sulfapyrazine O=S(=O)(Nc1c 251 8008 http://www.s PHYSPROP
    20306 hexafluoropr F/C(F)=C(/F)C( -156.5 8001 http://www.s PHYSPROP
    20307 tetradifon Clc1cc(c(Cl)cc 147 8004 http://www.s PHYSPROP
    20308 tetrafluoroet F/C(F)=C(/F)F -131.15 8000 http://www.s PHYSPROP
    20309 cyclohexanol, CC1(C)CC(C)C 55.8 7997 http://www.s PHYSPROP
    20310 cyclohexanol, CC1(C)CC(C)C 37.3 7997 http://www.s PHYSPROP
    20311 tri-2-chloroet ClCCOP(=O)(O -55 7994 http://www.s PHYSPROP
    20312 triphenylphosO=P(Oc1ccccc 50.5 7988 http://www.s PHYSPROP
    20313 pentaerythritoOCC(CO)(CO) 258 7984 http://www.s PHYSPROP
    20314 2,2-diethyl-1, CCC(CC)(CO)C 61.5 7983 http://www.s PHYSPROP
    20315 1,3-propanediCCC(N)(CO)CO 37.5 7981 http://www.s PHYSPROP
    20316 sulfadicramid Nc1ccc(cc1)S( 184.5 7980 http://www.s PHYSPROP
    20317 barbituric acidO=C1NC(=O)NC 109 7976 http://www.s PHYSPROP
    20318 phenallymal O=C1NC(=O)NC 156.5 7975 http://www.s PHYSPROP
    20319 bromcresol puCc1cc(cc(Br)c 241.5 7974 http://www.s PHYSPROP
    20320 mephobarbitaO=C1NC(=O)N( 176 7972 http://www.s PHYSPROP
    20321 oxyphenisatinCC(=O)Oc1ccc 242 7971 http://www.s PHYSPROP
    20322 dicofol OC(c1ccc(Cl)cc 77.5 7970 http://www.s PHYSPROP
    20323 chlorendic aciClC2(Cl)C1(Cl 209 7968 http://www.s PHYSPROP
    20324 chlorendic an ClC2=C(Cl)C3( 233 7967 http://www.s PHYSPROP
    20325 2,2-bis(ethyls CC(C)(S(=O)(= 125.8 7964 http://www.s PHYSPROP
    20326 ethyltrichloro CC[Si](Cl)(Cl)C -105.6 7962 http://www.s PHYSPROP
    20327 2,2,2-trichlor ClC(Cl)(Cl)CO 19 7961 http://www.s PHYSPROP
    20328 3-buten-2-ol, C=CC(C)(C)O -28 7959 http://www.s PHYSPROP
    20329 isobutene C=C(C)C -140.4 7957 http://www.s PHYSPROP
    20330 dimethyl etheCOC -141.5 7956 http://www.s PHYSPROP
    20331 propene C=CC -185 7954 http://www.s PHYSPROP
    20332 phenformin N=C(N)NC(=N) 176.5 7953 http://www.s PHYSPROP
    20333 n(1)-acetylph CC(=O)NNc1cc 129.5 7951 http://www.s PHYSPROP
    20334 mgk 264 CCC(CCCC)CN -20 7934 http://www.s PHYSPROP
    20335 eicosane CCCCCCCCCCC 36.8 7929 http://www.s PHYSPROP
    20336 1-octadecanolCCCCCCCCCCC 59.5 7928 http://www.s PHYSPROP
    20337 1-bromooctadBrCCCCCCCCC 28.2 7926 http://www.s PHYSPROP
    20338 1-octadecene CCCCCCCCCCC 17.5 7925 http://www.s PHYSPROP
    20339 docosanoic acO=C(O)CCCCC 81 7923 http://www.s PHYSPROP
    20340 1-bromohexa BrCCCCCCCCC 18 7921 http://www.s PHYSPROP
    20341 octadecanoyl ClC(=O)CCCC 23 7920 http://www.s PHYSPROP
    20342 1-tetradecanoCCCCCCCCCC 39.5 7917 http://www.s PHYSPROP
    20343 1-bromo-n-te BrCCCCCCCCC 5.6 7916 http://www.s PHYSPROP
    20344 1-tridecanol CCCCCCCCCC 32.5 7915 http://www.s PHYSPROP
    20345 hexadecanoyl ClC(=O)CCCC 12 7914 http://www.s PHYSPROP
    20346 dodecyl acetaCC(=O)OCCCC 1.3 7913 http://www.s PHYSPROP
    20347 dodine N=C(N)NCCCC 136 7912 http://www.s PHYSPROP
    20348 methyl stearaO=C(CCCCCCC 39.1 7909 http://www.s PHYSPROP
    20349 tetraethylene OCCOCCOCCO -6.2 7908 http://www.s PHYSPROP
    20350 ethanol, 2- 2- OCCOCCOCCC -40 7907 http://www.s PHYSPROP
    20351 tetraethylen NCCNCCNCCN -30 7905 http://www.s PHYSPROP
    20352 dodecyl merc CCCCCCCCCCC -8 7903 http://www.s PHYSPROP
    20353 dodecanal CCCCCCCCCCC 44.5 7902 http://www.s PHYSPROP
    20354 dodecanol CCCCCCCCCC 24 7901 http://www.s PHYSPROP
    20355 1-chlorodode CCCCCCCCCCC -9.3 7900 http://www.s PHYSPROP
    20356 ethoxytriethylOCCOCCOCCO -18.7 7898 http://www.s PHYSPROP
    20357 1,2-dibutoxyeCCCCOCCOCC -69.1 7896 http://www.s PHYSPROP
    20358 undecanal CCCCCCCCCCC -4 7894 http://www.s PHYSPROP
    20359 10-undecen-1-C=CCCCCCCCC -2 7893 http://www.s PHYSPROP
    20360 1-undecanol CCCCCCCCCC 19 7892 http://www.s PHYSPROP
    20361 dodecene (mixCCCCCCCCCCC -35.2 7891 http://www.s PHYSPROP
    20362 n-dodecene CCCCCCCCCCC -35.2 7891 http://www.s PHYSPROP
    20363 dodecane CCCCCCCCCCC -9.6 7890 http://www.s PHYSPROP
    20364 methyl hexad O=C(CCCCCCC 30 7889 http://www.s PHYSPROP
    20365 undecanoic acO=C(O)CCCCC 28.6 7888 http://www.s PHYSPROP
    20366 methoxy triethOCCOCCOCCO -44 7886 http://www.s PHYSPROP
    20367 formic acid, ocCCCCCCCCOC -39.1 7884 http://www.s PHYSPROP
    20368 n-decanal CCCCCCCCCC= -5 7883 http://www.s PHYSPROP
    20369 1-decanol CCCCCCCCCC 6.9 7882 http://www.s PHYSPROP
    20370 1-bromodeca BrCCCCCCCCC -29.2 7881 http://www.s PHYSPROP
    20371 1,2-bis(2-chl ClCCOCCOCCC -31.5 7879 http://www.s PHYSPROP
    20372 ethanol, 2-(heOCCOCCCCCC -45.1 7878 http://www.s PHYSPROP
    20373 n,n-dimethyl CN(C)CCCCCC -15 7876 http://www.s PHYSPROP
    20374 decyl acetate CC(=O)OCCCC -15 7875 http://www.s PHYSPROP
    20375 dodecanoyl chClC(=O)CCCC -17 7874 http://www.s PHYSPROP
    20376 acetic acid, ocCCCCCCCCOC( -38.5 7872 http://www.s PHYSPROP
    20377 undecanone CC(=O)CCCCC 15 7871 http://www.s PHYSPROP
    20378 isopropyl steaCC(C)OC(=O) 28 7870 http://www.s PHYSPROP
    20379 2-butoxyethanO=C(C)OCCOC -63 7868 http://www.s PHYSPROP
    20380 acetic acid, heCCCCCCCOC(C -50.2 7867 http://www.s PHYSPROP
    20381 nonanoic acidO=C(O)CCCCC 12.3 7866 http://www.s PHYSPROP
    20382 dibutylamine CCCCNCCCC -62 7856 http://www.s PHYSPROP
    20383 bis(2-chloroe ClCCOCOCCCl -32 7855 http://www.s PHYSPROP
    20384 1-octanethiol CCCCCCCCS -49.2 7852 http://www.s PHYSPROP
    20385 n-octylamine CCCCCCCCN 0 7851 http://www.s PHYSPROP
    20386 1-chlorooctanCCCCCCCCCl -57.8 7850 http://www.s PHYSPROP
    20387 n-nonane CCCCCCCCC -53.5 7849 http://www.s PHYSPROP
    20388 1-bromooctanBrCCCCCCCC -55 7848 http://www.s PHYSPROP
    20389 methyl laurat O=C(CCCCCCC 5.2 7847 http://www.s PHYSPROP
    20390 10-undecenoicO=C(CCCCCCC -27.5 7846 http://www.s PHYSPROP
    20391 ethanol, 2-(buCCCCNCCO -2 7840 http://www.s PHYSPROP
    20392 heptanal CCCCCCC=O -43.3 7838 http://www.s PHYSPROP
    20393 1-heptanol CCCCCCCO -34 7837 http://www.s PHYSPROP
    20394 heptylamine CCCCCCCN -18 7835 http://www.s PHYSPROP
    20395 1-octene C=CCCCCCC -101.7 7833 http://www.s PHYSPROP
    20396 octene (mixturC=CCCCCCC -109 7833 http://www.s PHYSPROP x Value clearly out of range EC
    20397 octanoyl chlorClC(=O)CCCCC -63 7832 http://www.s PHYSPROP
    20398 ethyl stearateO=C(CCCCCCC 33 7830 http://www.s PHYSPROP
    20399 di-n-propylsulCCCSCCC -102.5 7827 http://www.s PHYSPROP
    20400 di(n-propyl) e CCCOCCC -122 7823 http://www.s PHYSPROP
    20401 2-(2-aminoethNCCNCCO -38 7821 http://www.s PHYSPROP
    20402 butyl isocyanaCCCCN=C=O -75 7819 http://www.s PHYSPROP
    20403 3-ethoxy-1-prCCOCCCO 160.5 7818 http://www.s PHYSPROP
    20404 butyl vinyl et C=COCCCC -92 7817 http://www.s PHYSPROP
    20405 1-hexanethiolCCCCCCS -81 7815 http://www.s PHYSPROP
    20406 n-hexylamine CCCCCCN -22.9 7811 http://www.s PHYSPROP
    20407 1-hexanol CCCCCCO -44.6 7812 http://www.s PHYSPROP
    20408 1-bromohexa BrCCCCCC -84.7 7810 http://www.s PHYSPROP
    20409 pentane, 1,5- BrCCCCCBr -39.5 7809 http://www.s PHYSPROP
    20410 ethylenebis(o O=C(C)OCCOC -50 7807 http://www.s PHYSPROP
    20411 propanoic acidOC(=O)CCSCC 129 7805 http://www.s PHYSPROP
    20412 heptanoic aci CCCCCCC(=O) -7.5 7803 http://www.s PHYSPROP
    20413 2-octanone CC(=O)CCCCC -16 7802 http://www.s PHYSPROP
    20414 methyl octanoO=C(CCCCCCC -40 7800 http://www.s PHYSPROP
    20415 butyl palmitatO=C(CCCCCCC 16.9 7799 http://www.s PHYSPROP
    20416 tetracosane, CC(C)CCCC(C) -38 7798 http://www.s PHYSPROP
    20417 acetic acid, 2, O=C(O)COCC( 148 7797 http://www.s PHYSPROP
    20418 diisopropanolCC(O)CNCC(C) 44.5 7795 http://www.s PHYSPROP
    20419 diisobutylami CC(C)CNCC(C) -73.5 7794 http://www.s PHYSPROP
    20420 piperidine C1CCCCN1 -7 7791 http://www.s PHYSPROP
    20421 1,3,5-trioxaneC1OCOCO1 60.2 7790 http://www.s PHYSPROP
    20422 2h-pyran, 3,4-C1=CCCCO1 -70 7789 http://www.s PHYSPROP
    20423 cyclohexene C1C=CCCC1 -103.5 7788 http://www.s PHYSPROP
    20424 cyclohexane C1CCCCC1 6.6 7787 http://www.s PHYSPROP
    20425 diethyl disulfi CCSSCC -101.5 7786 http://www.s PHYSPROP
    20426 2-chloroethyl C=COCCCl -70 7783 http://www.s PHYSPROP
    20427 propyl formatO=COCCC -92.9 7782 http://www.s PHYSPROP
    20428 methylbutyla CCCCNC -75 7777 http://www.s PHYSPROP
    20429 1-pentanethioCCCCCS -75.7 7776 http://www.s PHYSPROP
    20430 2-butyne-1,4-dOCC#CCO 50 7775 http://www.s PHYSPROP
    20431 1-pentanal CCCCC=O -91.5 7772 http://www.s PHYSPROP
    20432 valeronitrile CCCCC#N -96.2 7770 http://www.s PHYSPROP
    20433 n-pentylamin CCCCCN -55 7769 http://www.s PHYSPROP
    20434 n-hexane CCCCCC -95.3 7767 http://www.s PHYSPROP
    20435 1-bromopent BrCCCCC -95 7766 http://www.s PHYSPROP
    20436 1,4-dibromobBrCCCCBr -16.5 7765 http://www.s PHYSPROP
    20437 isoamyl formaCC(C)CCOC=O -93.5 7761 http://www.s PHYSPROP
    20438 2-heptanone CC(=O)CCCCC -35 7760 http://www.s PHYSPROP
    20439 methyl decan O=C(CCCCCCC -18 7759 http://www.s PHYSPROP
    20440 diethyl sebacaO=C(CCCCCCC 5 7758 http://www.s PHYSPROP
    20441 ethyl decanoaO=C(CCCCCCC -20 7757 http://www.s PHYSPROP
    20442 octyl decyl adO=C(OCCCCCC -50 7752 http://www.s PHYSPROP
    20443 isopropyl myriCC(C)OC(=O) 3 7751 http://www.s PHYSPROP
    20444 peroxide, diacCC(=O)OOC(C 30 7749 http://www.s PHYSPROP
    20445 sec-butylacet CC(=O)OCC(C) -98.8 7747 http://www.s PHYSPROP
    20446 n,n,n',n'-tet CN(C)CCN(C)C -55 7746 http://www.s PHYSPROP
    20447 2,5-hexanedi CC(=O)CCC(C) -5.5 7744 http://www.s PHYSPROP
    20448 5-methyl-2-h CC(C)CCC(C)= -74 7743 http://www.s PHYSPROP
    20449 t-butyl-peroxiCC(C)(C)OOC(C -40 7742 http://www.s PHYSPROP
    20450 1,2-ethanedisuO=S(O)(=O)CC 173 7741 http://www.s PHYSPROP
    20451 2,5-hexanediolCC(O)(C)CCC(C 92 7740 http://www.s PHYSPROP
    20452 thiophene c1cccs1 -39.4 7739 http://www.s PHYSPROP
    20453 furan c1ccco1 -85.6 7738 http://www.s PHYSPROP
    20454 tetrahydrofur C1CCCO1 -108.44 7737 http://www.s PHYSPROP
    20455 pyrrole c1cccn1 -23.4 7736 http://www.s PHYSPROP
    20456 ethyl formate O=COCC -79.6 7734 http://www.s PHYSPROP
    20457 divinyl ether C=COC=C -101 7733 http://www.s PHYSPROP
    20458 ethyl vinyl et C=COCC -115.8 7732 http://www.s PHYSPROP
    20459 diethylamine CCNCC -50 7730 http://www.s PHYSPROP
    20460 2-methoxyethOCCOC -85.1 7728 http://www.s PHYSPROP
    20461 ethanol, 2-hydNNCCO -70 7726 http://www.s PHYSPROP
    20462 acetonitrile, C=NCC#N 129 7724 http://www.s PHYSPROP
    20463 butanethiol CCCCS -115.7 7721 http://www.s PHYSPROP
    20464 ethylene cyanN#CCCO -46 7720 http://www.s PHYSPROP
    20465 butyronitrile CCCC#N -111.9 7717 http://www.s PHYSPROP
    20466 n-butylamine CCCCN -50 7716 http://www.s PHYSPROP
    20467 1-chloro-3-b BrCCCCl -58.9 7715 http://www.s PHYSPROP
    20468 1-chlorobutanCCCCCl -123.1 7714 http://www.s PHYSPROP
    20469 1-pentene CCCC=C -165.2 7713 http://www.s PHYSPROP
    20470 n-pentane CCCCC -129.7 7712 http://www.s PHYSPROP
    20471 1-bromobuta BrCCCC -112.4 7711 http://www.s PHYSPROP
    20472 1,3-dibromopBrCCCBr -34.2 7710 http://www.s PHYSPROP
    20473 n-propyl acet CC(=O)OCCC -93 7706 http://www.s PHYSPROP
    20474 ethanol, 2- (1 CC(C)NCCO 128.5 7704 http://www.s PHYSPROP
    20475 1,3-propanediNCCCN(C)C -60 7703 http://www.s PHYSPROP
    20476 pentanoic aci CCCCC(=O)O -34 7701 http://www.s PHYSPROP
    20477 isobutyl vinyl CC(C)COC=C -112 7702 http://www.s PHYSPROP
    20478 dihexyl adipatO=C(CCCCCCC -8 7696 http://www.s PHYSPROP
    20479 n-butylbutyraO=C(CCC)OCC -91.5 7694 http://www.s PHYSPROP
    20480 2-aminopyrimNc1ncccn1 127.5 7690 http://www.s PHYSPROP
    20481 2-chloropyrid Clc1ccccn1 -46.5 7689 http://www.s PHYSPROP
    20482 2-methylpyrazCc1cnccn1 -29 7688 http://www.s PHYSPROP
    20483 3-hydroxypyriOc1cccnc1 127.5 7683 http://www.s PHYSPROP
    20484 thiophenol Sc1ccccc1 -14.9 7681 http://www.s PHYSPROP
    20485 4h-pyran-4-o O=C1C=COC= 32.5 7680 http://www.s PHYSPROP
    20486 cyclohexanonO=C1CCCCC1 -31 7679 http://www.s PHYSPROP
    20487 cyclohexanol OC1CCCCC1 25.4 7678 http://www.s PHYSPROP
    20488 cyclohexanamNC1CCCCC1 -17.7 7677 http://www.s PHYSPROP
    20489 chlorobenzen Clc1ccccc1 -45.31 7676 http://www.s PHYSPROP
    20490 1-methylcycl CC1CCCCC1 -126.6 7674 http://www.s PHYSPROP
    20491 bromobenzenBrc1ccccc1 -30.6 7673 http://www.s PHYSPROP
    20492 bromocycloheBrC1CCCCC1 -56.5 7672 http://www.s PHYSPROP
    20493 4-methyl-2-peCC(C)CC(C)OC -64 7671 http://www.s PHYSPROP
    20494 2,6-dimethyl- CC(C)CC(=O)C -41.5 7670 http://www.s PHYSPROP
    20495 cyanuric acid Oc1nc(O)nc(O 360 7668 http://www.s PHYSPROP
    20496 cyanuric chlorClc1nc(Cl)nc(C 154 7666 http://www.s PHYSPROP
    20497 1,3,5-triazine CN1CN(C)CN(C -27 7664 http://www.s PHYSPROP
    20498 1,3,5-trichlo Clc1cc(Cl)cc(C 63.5 7662 http://www.s PHYSPROP
    20499 1,3,5-trimeth Cc1cc(C)cc(C) -44.7 7659 http://www.s PHYSPROP
    20500 ethyl isovaler CC(C)CC(=O)O -99.3 7657 http://www.s PHYSPROP
    20501 dcip (2,2'-oxy CC(CCl)OC(C)C -97 7656 http://www.s PHYSPROP
    20502 m-diethenylb C=Cc1cccc(C= -52.3 7653 http://www.s PHYSPROP
    20503 glutaric anhydO=C1CCCC(=O 56.3 7652 http://www.s PHYSPROP
    20504 2-amino-4-metCc1ccnc(N)n1 160.3 7651 http://www.s PHYSPROP
    20505 m-xylene Cc1cccc(C)c1 -47.8 7641 http://www.s PHYSPROP
    20506 pyrazine, 2,6- Cc1cncc(C)n1 47.5 7650 http://www.s PHYSPROP
    20507 maleic anhydrO=C1C=CC(=O 52.8 7635 http://www.s PHYSPROP
    20508 propylene carO=C1OCC(C)O -48.8 7636 http://www.s PHYSPROP
    20509 succinic anhydO=C1CCC(=O) 119 7634 http://www.s PHYSPROP
    20510 gamma-valeroO=C1CCC(C)O 242.15 7633 http://www.s PHYSPROP x clearly out of range JCB
    20511 3-methyl-5-pyO=C1CC(C)=N 221 7632 http://www.s PHYSPROP
    20512 acetic anhydr CC(=O)OC(C)= -73 7630 http://www.s PHYSPROP
    20513 1-propen-2-olC=C(C)OC(C)= -92.9 7628 http://www.s PHYSPROP
    20514 isopropyl acetCC(=O)OC(C)C -73.4 7627 http://www.s PHYSPROP
    20515 di-isopropyl e CC(C)OC(C)C -86.8 7626 http://www.s PHYSPROP
    20516 diisopropylamCC(C)NC(C)C 217 7624 http://www.s PHYSPROP x salt JCB
    20517 diisopropylamCC(C)NC(C)C -61 7624 http://www.s PHYSPROP
    20518 4-methyl-2-peCC(C)CC(C)O -90 7622 http://www.s PHYSPROP
    20519 4-methyl-2-p CC(C)CC(C)=O -84 7621 http://www.s PHYSPROP
    20520 2,4-dimethylpCC(C)CC(C)C -119.9 7619 http://www.s PHYSPROP
    20521 vinyl acetate CC(=O)OC=C -93.2 7616 http://www.s PHYSPROP
    20522 1-nitropropan[O-][N+](=O)C -108 7615 http://www.s PHYSPROP
    20523 1-methoxy-2- CC(O)COC -95 7612 http://www.s PHYSPROP
    20524 3-chloropropioClCCC(=O)O 41 7611 http://www.s PHYSPROP
    20525 acetamide, 2-N#CCC(N)=O 121.5 7610 http://www.s PHYSPROP
    20526 2-pentanone CC(=O)CCC -76.9 7607 http://www.s PHYSPROP
    20527 butane, 1-chl CC(C)CCCl -104.4 7605 http://www.s PHYSPROP
    20528 2-methylpent CC(C)CCC -153.7 7604 http://www.s PHYSPROP
    20529 1-bromo-3-meCC(C)CCBr -112 7603 http://www.s PHYSPROP
    20530 2-bromopent BrC(C)CCC -95.5 7602 http://www.s PHYSPROP
    20531 trichlorouret NC(=O)OCC(Cl) 64 7595 http://www.s PHYSPROP
    20532 2-(ethylaminoCNCCS(=O)(= 241.5 7594 http://www.s PHYSPROP
    20533 di-n-butyl ph CCCCOP(O)(= -13 7593 http://www.s PHYSPROP
    20534 1,4-oxathiane,O=S1(=O)CCO 132 7590 http://www.s PHYSPROP
    20535 tert-butylacr CC(C)(C)NC(= 128.5 7589 http://www.s PHYSPROP
    20536 tetradecamethC[Si](C)(C)O[Si -59 7587 http://www.s PHYSPROP
    20537 tetradecamethC[Si]1(C)O[Si] -26 7586 http://www.s PHYSPROP
    20538 propane, 2,2'-CC(C)(C)SC(C) -9 7584 http://www.s PHYSPROP
    20539 sarin CC(C)OP(C)(F) -57 7583 http://www.s PHYSPROP
    20540 2,4,4-trimeth CC(C)=C/C(C)( -106.3 7581 http://www.s PHYSPROP
    20541 2,4,4-trimeth C=C(C)CC(C)(C -93.5 7580 http://www.s PHYSPROP
    20542 methylformatO=COC -99 7577 http://www.s PHYSPROP
    20543 methylvinyletC=COC -122 7573 http://www.s PHYSPROP
    20544 glyoxal O=CC=O 15 7572 http://www.s PHYSPROP
    20545 acrylonitrile C=CC#N -83.5 7567 http://www.s PHYSPROP
    20546 propionitrile CCC#N -92.8 7566 http://www.s PHYSPROP
    20547 propylamine CCCN -83 7564 http://www.s PHYSPROP
    20548 1-propanethioCCCS -113.3 7560 http://www.s PHYSPROP
    20549 acrolein C=CC=O -87.7 7559 http://www.s PHYSPROP
    20550 1-butyne C#CCC -125.7 7558 http://www.s PHYSPROP
    20551 1,3-butadieneC=CC=C -108.9 7557 http://www.s PHYSPROP
    20552 butene (mixtuC=CCC -145 7556 http://www.s PHYSPROP x Value clearly out of range EC
    20553 n-butane CCCC -138.2 7555 http://www.s PHYSPROP
    20554 1-butene C=CCC -185.3 7556 http://www.s PHYSPROP
    20555 3-bromo-1-pr BrCC=C -119 7553 http://www.s PHYSPROP
    20556 1-bromoprop BrCCC -110 7552 http://www.s PHYSPROP
    20557 1,2-dibromoe BrCCBr 9.9 7551 http://www.s PHYSPROP
    20558 1,2-butyleneoCCC1CO1 -150 7546 http://www.s PHYSPROP
    20559 decanedioic acO=C(CCCCCCC 38 7541 http://www.s PHYSPROP
    20560 methyl hepta O=C(CCCCCC) -56 7538 http://www.s PHYSPROP
    20561 methyl hexan CCCCCC(=O)O -71 7536 http://www.s PHYSPROP
    20562 isobutyl acryl C=CC(=O)OCC( -61 7531 http://www.s PHYSPROP
    20563 trans-2,5-dim CC1CNC(C)CN 118.5 7528 http://www.s PHYSPROP
    20564 2,5-dimethylpCC1CNC(C)CN 116 7528 http://www.s PHYSPROP
    20565 piperazine, 2, CC1CNC(C)CN 114 7528 http://www.s PHYSPROP
    20566 4-chlorobenzeSc1ccc(Cl)cc1 61 7527 http://www.s PHYSPROP
    20567 p-xylene Cc1ccc(C)cc1 13.25 7521 http://www.s PHYSPROP
    20568 p-bromoanilinNc1ccc(Br)cc1 66.4 7519 http://www.s PHYSPROP
    20569 p-bromochlorClc1ccc(Br)cc1 68 7518 http://www.s PHYSPROP
    20570 n-propylpropiCCC(=O)OCCC -75.9 7515 http://www.s PHYSPROP
    20571 3-heptanone CCC(=O)CCCC -39 7514 http://www.s PHYSPROP
    20572 ethyl laurate O=C(CCCCCCC -10 7512 http://www.s PHYSPROP
    20573 ethyl octanoaO=C(CCCCCCC -43.1 7511 http://www.s PHYSPROP
    20574 butyric anhydCCCC(=O)OC( -75 7510 http://www.s PHYSPROP
    20575 ethyl heptanoO=C(CCCCCC) -66.1 7509 http://www.s PHYSPROP
    20576 isopentyl but CC(C)CCOC(=O -73.2 7507 http://www.s PHYSPROP
    20577 di-(2-ethylhe CCCCC(CNCC( -60 7503 http://www.s PHYSPROP
    20578 hexanedioic acO=C(CCCCC(= -15.7 7502 http://www.s PHYSPROP
    20579 hexanedioic acO=C(CCCCC(= -32.4 7496 http://www.s PHYSPROP
    20580 peroxide, bis O=C(CCCCCCC 49 7485 http://www.s PHYSPROP
    20581 n-propylbutyrCCCC(=O)OCC -95.2 7482 http://www.s PHYSPROP
    20582 diisopropyl p CC(C)OC(=O)O 10 7481 http://www.s PHYSPROP
    20583 caprolactam O=C1CCCCCN 69.3 7480 http://www.s PHYSPROP
    20584 n-methyldiet OCCN(C)CCO -21 7479 http://www.s PHYSPROP
    20585 diethyl carbo O=C(OCC)OCC -43 7478 http://www.s PHYSPROP
    20586 ethylbutyrate CCCC(=O)OCC -98 7475 http://www.s PHYSPROP
    20587 s-butylacetateCC(=O)OC(C)C -98.9 7472 http://www.s PHYSPROP
    20588 ethyl chloroacClCC(=O)OCC -21 7465 http://www.s PHYSPROP
    20589 vinyl propionaCCC(=O)OC=C -80 7464 http://www.s PHYSPROP
    20590 ethyl propion CCC(=O)OCC -73.9 7463 http://www.s PHYSPROP
    20591 1-hexyn-3-ol C#CC(O)CCC -80 7460 http://www.s PHYSPROP
    20592 1,4-cyclohexaOCC1CCC(CO) 51 7449 http://www.s PHYSPROP
    20593 p-diethylbenzCCc1ccc(CC)cc -42.83 7448 http://www.s PHYSPROP
    20594 benzene, 1-chClCc1ccc(Cl)cc 31 7437 http://www.s PHYSPROP
    20595 benzene, 1-(bCc1ccc(CBr)cc 35 7435 http://www.s PHYSPROP
    20596 2-ethyl-1-hex CCC(CCCC)CO -70 7434 http://www.s PHYSPROP
    20597 2-ethylhexyla CCC(CCCC)CN -76 7433 http://www.s PHYSPROP
    20598 1-phenyldeca CCCCCCCCCCc -14.4 7430 http://www.s PHYSPROP
    20599 1,2-diphenox C(COc1ccccc1 98 7427 http://www.s PHYSPROP
    20600 benzenepropaO=CCCc1ccccc 47 7421 http://www.s PHYSPROP x almost every chemical supplier lists at -42
    20601 n-butylbenze CCCCc1ccccc1 -87.9 7419 http://www.s PHYSPROP
    20602 p-dodecylanil Nc1ccc(CCCCC 40.5 7415 http://www.s PHYSPROP
    20603 chlorphenesinClc1ccc(OCC( 78 7411 http://www.s PHYSPROP
    20604 benzenemethan
    COc1ccc(COC( 84 7410 http://www.s PHYSPROP
    20605 1-chloro-4-is Clc1ccc(/N=C 30 7408 http://www.s PHYSPROP
    20606 4-nitroacetaniO=C(C)Nc1ccc( 216 7407 http://www.s PHYSPROP
    20607 p-methoxyphen
    COc1ccc(CC(= 87 7406 http://www.s PHYSPROP
    20608 n-stearoyl-p- Oc1ccc(cc1) 133.8 7405 http://www.s PHYSPROP
    20609 4-bromoacetan
    Brc1ccc(NC(C) 168 7399 http://www.s PHYSPROP
    20610 phenylacetamO=C(N)Cc1ccc 157 7397 http://www.s PHYSPROP
    20611 2-pyridineeth OCCc1ccccn1 -7.8 7392 http://www.s PHYSPROP
    20612 ethoxybenzenCCOc1ccccc1 -29.5 7391 http://www.s PHYSPROP
    20613 formanilide O=CNc1ccccc1 46 7388 http://www.s PHYSPROP
    20614 n-ethylanilineCCNc1ccccc1 -63.5 7387 http://www.s PHYSPROP
    20615 n-propylbenz CCCc1ccccc1 -99.5 7385 http://www.s PHYSPROP
    20616 (2-bromoethyBrCCc1ccccc1 -65.7 7383 http://www.s PHYSPROP
    20617 dibenzyl aminC(NCc1ccccc1) -26 7373 http://www.s PHYSPROP
    20618 dibenzyl succiO=C(OCc1cccc 49.5 7370 http://www.s PHYSPROP
    20619 morpholine, 4,S(SN1CCOCC1 124.5 7365 http://www.s PHYSPROP
    20620 bibenzyl C(Cc1ccccc1)c 52.5 7364 http://www.s PHYSPROP
    20621 nonanedioic acO=C(CCCCCCC -78 7359 http://www.s PHYSPROP
    20622 di-2-ethylhexyO=C(CCCCC(= -67.8 7358 http://www.s PHYSPROP
    20623 chlorbenside Clc2ccc(SCc1cc 75 7357 http://www.s PHYSPROP
    20624 p-(benzyloxy) Oc2ccc(OCc1c 122 7356 http://www.s PHYSPROP
    20625 phenol, 4-((p Oc2ccc(NCc1c 88 7355 http://www.s PHYSPROP
    20626 2-ethylhexyl aO=C(C=C)OCC -90 7354 http://www.s PHYSPROP
    20627 2-ethylhexyla O=C(C)OCC(CC -80 7353 http://www.s PHYSPROP
    20628 benzenepropan
    CC(C)(O)CCc1c 24.5 7350 http://www.s PHYSPROP
    20629 boric acid OB(O)O 170.9 7346 http://www.s PHYSPROP
    20630 phosphorous ac
    CCCCOP(OCCC -80 7341 http://www.s PHYSPROP
    20631 tri n-butylami CCCCN(CCCC) -70 7340 http://www.s PHYSPROP
    20632 2-dibutylaminCCCCN(CCCC) -75 7339 http://www.s PHYSPROP
    20633 morpholine, 4-c1cccc2sc(nc 85 7337 http://www.s PHYSPROP
    20634 triallylamine C=CCN(CC=C) 94 7335 http://www.s PHYSPROP x too high - possibly salt JCB
    20635 tripropylaminCCCN(CCC)CC -93.5 7334 http://www.s PHYSPROP
    20636 cyclopentadieC1=CC=CC1 -85 7330 http://www.s PHYSPROP
    20637 benzene, 1,2- Clc1ccc(CCl)cc 37.5 7327 http://www.s PHYSPROP
    20638 1,2-dichloro- Clc1ccc(/N=C= 43 7325 http://www.s PHYSPROP
    20639 1,3,5-triethyl CCc1cc(cc(CC) -66.5 7320 http://www.s PHYSPROP
    20640 benzeneaceticO=C(OCCc1ccc 26.5 7319 http://www.s PHYSPROP
    20641 4-oxo-4-(phenO=C(Nc1ccccc 148.5 7316 http://www.s PHYSPROP
    20642 carbonic acid,O=C(Oc1ccccc 83 7315 http://www.s PHYSPROP
    20643 diphenylurea,O=C(Nc1ccccc 239 7314 http://www.s PHYSPROP
    20644 diphenyl ureaO=C(Nc1ccccc 189 7314 http://www.s PHYSPROP
    20645 n,n'-diphenyl N=C(Nc1ccccc 150 7313 http://www.s PHYSPROP
    20646 acetoacetanil O=C(Nc1ccccc 86 7311 http://www.s PHYSPROP
    20647 n-phenyl ethyO=C(OCC)Nc1c 53 7310 http://www.s PHYSPROP
    20648 n,n'-di-s-but CC(CC)Nc1ccc 18 7308 http://www.s PHYSPROP
    20649 phenacaine hyCCOc1ccc(cc1 191 7307 http://www.s PHYSPROP x salt - AL
    20650 p-chloroacetoClc1ccc(NC(=O 132.5 7306 http://www.s PHYSPROP
    20651 oxirane, 2,2'- c1ccc(cc1OC 42.5 7305 http://www.s PHYSPROP
    20652 diphenyl ethec1ccccc1Oc2c 26.8 7302 http://www.s PHYSPROP
    20653 dicyclohexyla C1CCCCC1NC2 -0.1 7301 http://www.s PHYSPROP
    20654 2-benzylpyrid c1ccccc1Cc2c 12.5 7300 http://www.s PHYSPROP
    20655 benzene, 1,1' c1ccccc1Cc2cc 25.2 7299 http://www.s PHYSPROP
    20656 di-(p-aminop Nc2ccc(Cc1ccc 92.5 7296 http://www.s PHYSPROP
    20657 benzene, 1,1' Clc2ccc(Cc1ccc 55.5 7295 http://www.s PHYSPROP
    20658 benzenamine,c1ccccc1Nc2c 90 7294 http://www.s PHYSPROP
    20659 4-isopropoxy CC(C)Oc1ccc(c 79 7293 http://www.s PHYSPROP
    20660 4-(isopropyla CC(C)Nc1ccc(c 74 7292 http://www.s PHYSPROP
    20661 diphenane O=C(N)Oc1ccc 148.5 7291 http://www.s PHYSPROP
    20662 diphenyl methO=C=Nc1ccc(c 38 7289 http://www.s PHYSPROP
    20663 aniline, p-((p- [O-][N+](=O)c 144 7285 http://www.s PHYSPROP
    20664 4-bromophenyl
    Brc2ccc(Oc1cc 18.72 7284 http://www.s PHYSPROP
    20665 4-aminodipheNc2ccc(Nc1ccc 66 7283 http://www.s PHYSPROP
    20666 fenuron O=C(Nc1ccccc 133.5 7279 http://www.s PHYSPROP
    20667 gibbs reagent ClC1=CC(=NCl 66 7275 http://www.s PHYSPROP
    20668 1,3,5-triazine,C=CCOc1nc(n 27 7274 http://www.s PHYSPROP
    20669 hexanal, 3-ethCCOC(CC(CCC -100 7273 http://www.s PHYSPROP
    20670 barban Clc1cc(NC(=O 75 7270 http://www.s PHYSPROP
    20671 dinitrosopent O=NN1CN2CN( 204.5 7268 http://www.s PHYSPROP
    20672 triclocarban Clc2ccc(NC(=O 255.6 7266 http://www.s PHYSPROP
    20673 4-chloro-n-p Clc2cc(Nc1ccc 74 7264 http://www.s PHYSPROP
    20674 3-methoxy-n- COc2cccc(Nc1 73 7263 http://www.s PHYSPROP
    20675 4,4'-methylene
    Nc2ccc(Cc1ccc 110 7262 http://www.s PHYSPROP
    20676 cloprop Clc1cc(OC(C)C 113 7261 http://www.s PHYSPROP
    20677 anilazine Clc2nc(Nc1ccc 160 7260 http://www.s PHYSPROP
    20678 phosphorous ac
    O(P(Oc1ccccc1 25 7259 http://www.s PHYSPROP
    20679 guanidine, n,n'N(C(Nc1ccccc1 146.5 7258 http://www.s PHYSPROP
    20680 eucatropine CC2CC(OC(=O) 113 7253 http://www.s PHYSPROP
    20681 cyclamate OS(=O)(=O)N 169.5 7252 http://www.s PHYSPROP
    20682 benzeneethanol
    OC(C)(C)Cc1cc 24 7250 http://www.s PHYSPROP
    20683 m-methylstyr Cc1cccc(C=C)c -86.3 7248 http://www.s PHYSPROP
    20684 quinuclidine C1CN2CCC1CC 158 7246 http://www.s PHYSPROP
    20685 4-ethylmorphoCCN1CCOCC1 -64 7244 http://www.s PHYSPROP
    20686 2-ethylpyridinCCc1ccccn1 -63.1 7242 http://www.s PHYSPROP
    20687 2-cyanopyridi N#Cc1ccccn1 29 7241 http://www.s PHYSPROP
    20688 anisole COc1ccccc1 -37.5 7238 http://www.s PHYSPROP
    20689 phenylhydroxONc1ccccc1 83.5 7237 http://www.s PHYSPROP
    20690 cyclohexanonON=C1/CCCCC 90 7236 http://www.s PHYSPROP
    20691 phenyl hydrazNNc1ccccc1 19.6 7235 http://www.s PHYSPROP
    20692 n-methylanili CNc1ccccc1 -57 7234 http://www.s PHYSPROP
    20693 3-pyridinemetOCc1cccnc1 -6.5 7229 http://www.s PHYSPROP
    20694 cyclohexanemOCC1CCCCC1 -43 7226 http://www.s PHYSPROP
    20695 4-cyanopyridi N#Cc1ccncc1 79 7225 http://www.s PHYSPROP
    20696 benzonitrile N#Cc1ccccc1 -12.7 7224 http://www.s PHYSPROP
    20697 benzylamine NCc1ccccc1 10 7223 http://www.s PHYSPROP
    20698 styrene C=Cc1ccccc1 -31 7220 http://www.s PHYSPROP
    20699 ethylbenzene CCc1ccccc1 -94.9 7219 http://www.s PHYSPROP
    20700 4-vinylcycloh C=CC1CC=CCC -108.9 7218 http://www.s PHYSPROP
    20701 p-nitrophenetCCOc1ccc(cc1) 60 7214 http://www.s PHYSPROP
    20702 2-(p-nitrophe O=[N+]([O-])c 63 7213 http://www.s PHYSPROP
    20703 pyridine-2,5-dOC(=O)c1ccc( 254 7212 http://www.s PHYSPROP
    20704 p-dinitrobenz O=[N+]([O-])c 174 7211 http://www.s PHYSPROP
    20705 p-nitro-n,n-di CN(C)c1ccc(cc 164 7210 http://www.s PHYSPROP
    20706 1,4-benzenediO=C(Cl)c1ccc( 83.5 7207 http://www.s PHYSPROP
    20707 1,4-diisoprop CC(C)c1ccc(cc -17 7205 http://www.s PHYSPROP
    20708 p-nitro-n-methCNc1ccc(cc1)[ 152 7203 http://www.s PHYSPROP
    20709 benzene, 1-(chO=[N+]([O-])c 71 7202 http://www.s PHYSPROP
    20710 p-formyl-n,n- CN(C)c1ccc(C 74.5 7199 http://www.s PHYSPROP
    20711 p-toluic acid Cc1ccc(cc1)C( 179.6 7190 http://www.s PHYSPROP
    20712 p-hydroxyace O=C(C)c1ccc(O 109.5 7189 http://www.s PHYSPROP
    20713 p-bromoacet O=C(C)c1ccc(B 50.5 7186 http://www.s PHYSPROP
    20714 p-isopropylphCC(C)c1ccc(O) 62.3 7185 http://www.s PHYSPROP
    20715 p-i-propyltol Cc1ccc(cc1)C( -68 7183 http://www.s PHYSPROP
    20716 p-cymene Cc1ccc(cc1)C( -68.9 7183 http://www.s PHYSPROP
    20717 gamma-terpinCC1=CCC(=CC1 -10 7181 http://www.s PHYSPROP
    20718 cyclohexane, 1CC1CCC(CC1)C -86.3 7179 http://www.s PHYSPROP
    20719 p-menthane CC1CCC(CC1)C -87.6 7179 http://www.s PHYSPROP
    20720 cyclohexane, 1CC1CCC(CC1)C -89.9 7179 http://www.s PHYSPROP
    20721 ethyl-p-nitro O=[N+]([O-])c 57 7177 http://www.s PHYSPROP
    20722 4-hydroxy metOc1ccc(cc1)C 131 7176 http://www.s PHYSPROP
    20723 benzoic acid, COC(=O)c1ccc 33.2 7175 http://www.s PHYSPROP
    20724 ethanone, 2-bO=C(CBr)c1ccc 111 7174 http://www.s PHYSPROP
    20725 p-(sec-butyl) Oc1ccc(cc1)C( 61.5 7173 http://www.s PHYSPROP
    20726 1,3-dinitrobe O=[N+]([O-])c 90 7172 http://www.s PHYSPROP
    20727 1,3-benzenediO=C(Cl)c1cccc 43.5 7171 http://www.s PHYSPROP
    20728 1,3-diisoprop CC(C)c1cccc(c -63.1 7170 http://www.s PHYSPROP
    20729 m-nitrobenza O=[N+]([O-])c 58.5 7169 http://www.s PHYSPROP
    20730 benzoic acid, OC(=O)c1ccc(c 140 7168 http://www.s PHYSPROP
    20731 2-methoxy-5-nNc1cc(ccc1OC) 118 7167 http://www.s PHYSPROP
    20732 5-nitro-2-tolu Cc1ccc(cc1N)[ 105.5 7166 http://www.s PHYSPROP
    20733 2-methyl-4-niCc1cc(ccc1O)[ 96 7164 http://www.s PHYSPROP
    20734 4-nitro-2-tolu Cc1cc(ccc1N)[ 133.5 7163 http://www.s PHYSPROP
    20735 1,2-dimethyl- Cc1ccc(cc1C)[ 30.5 7162 http://www.s PHYSPROP
    20736 3,5-dinitrobenO=[N+]([O-])c 205 7155 http://www.s PHYSPROP
    20737 benzoyl chloriO=[N+]([O-])c 74 7154 http://www.s PHYSPROP
    20738 4-oxo-4h-pyran
    O=C1C=C(OC(= 262 7153 http://www.s PHYSPROP
    20739 2,6-dichloro-4Clc1cc(cc(Cl)c 191 7152 http://www.s PHYSPROP
    20740 methyl gallateOc1cc(cc(O)c 261.5 7150 http://www.s PHYSPROP
    20741 benzene, 1,3- Cc1cc(C)cc(c1 75 7148 http://www.s PHYSPROP
    20742 3-nitroaniline O=[N+]([O-])c 114 7145 http://www.s PHYSPROP
    20743 phenol, 3-(di CN(C)c1cccc(O 86 7143 http://www.s PHYSPROP
    20744 m-hydroxybenz
    OC(=O)c1cc(O 202 7142 http://www.s PHYSPROP
    20745 3-aminobenzoiOC(=O)c1cc(N 173 7141 http://www.s PHYSPROP
    20746 m-toluic acid Cc1cccc(c1)C( 108.7 7140 http://www.s PHYSPROP
    20747 nitrobenzene [O-][N+](=O)c 5.7 7138 http://www.s PHYSPROP
    20748 benzenecarbotO=C(S)c1ccccc 24 7136 http://www.s PHYSPROP
    20749 cyclohexanecaO=C(O)C1CCC 31.5 7135 http://www.s PHYSPROP
    20750 benzoyl chlor ClC(=O)c1cccc -1 7134 http://www.s PHYSPROP
    20751 acetophenoneCC(=O)c1cccc 20 7132 http://www.s PHYSPROP
    20752 alpha-methylbCC(O)c1ccccc 20 7131 http://www.s PHYSPROP
    20753 1-phenylethanCC(O)c1ccccc 10 7131 http://www.s PHYSPROP
    20754 benzenemethan
    CC(N)c1ccccc1 32 7130 http://www.s PHYSPROP
    20755 alpha-methylsC=C(C)c1ccccc -23.2 7129 http://www.s PHYSPROP
    20756 cumene CC(C)c1ccccc1 -96 7128 http://www.s PHYSPROP
    20757 benzoic acid, 4CC(C)(C)c1ccc 164.5 7125 http://www.s PHYSPROP
    20758 benzenesulfoni
    OS(=O)(=O)c1c 67 7122 http://www.s PHYSPROP
    20759 benzenesulfony
    Ic1ccc(cc1)S(= 85 7121 http://www.s PHYSPROP
    20760 benzenesulfony
    O=S(Cl)(=O)c1 51 7120 http://www.s PHYSPROP
    20761 p-toluenesulfoCc1ccc(cc1)S( 71 7119 http://www.s PHYSPROP
    20762 benzenesulfonO=S(Cl)(=O)c1 76 7118 http://www.s PHYSPROP
    20763 4-(trifluorom FC(F)(F)c1ccc( -33 7116 http://www.s PHYSPROP
    20764 cyclohexanoneO=C1CCC(CC1) 48.5 7114 http://www.s PHYSPROP
    20765 cyclohexanol, CC(C)(C)C1CC 66 7113 http://www.s PHYSPROP
    20766 p-(t-butyl)tol Cc1ccc(cc1)C( -52 7112 http://www.s PHYSPROP
    20767 m-trifluoromeO=[N+]([O-])c1 -2.4 7108 http://www.s PHYSPROP
    20768 1,2-benzenedio
    Oc1ccc(cc1O)C 54.3 7103 http://www.s PHYSPROP
    20769 4-(t-butyl)-2-cCc1cc(ccc1O)C 27.5 7101 http://www.s PHYSPROP
    20770 benzene, 1-(1Cc1cc(C)cc(c1) -18 7100 http://www.s PHYSPROP
    20771 m-trifluoromeFC(F)(F)c1cc(O -1.8 7098 http://www.s PHYSPROP
    20772 3-trifluorometFC(F)(F)c1cc(N 5.5 7097 http://www.s PHYSPROP
    20773 benzene, 1-chlFC(F)(F)c1cc(C -56 7096 http://www.s PHYSPROP
    20774 benzenesulfonO=S(O)(=O)c1 65 7093 http://www.s PHYSPROP
    20775 benzenesulfo O=S(=O)(N)c1 151 7092 http://www.s PHYSPROP
    20776 benzenesulfonO=S(=O)(Cl)c1 14.5 7091 http://www.s PHYSPROP
    20777 benzotrifluori FC(F)(F)c1cccc -29.1 7090 http://www.s PHYSPROP
    20778 t-butylbenzenCC(C)(C)c1ccc -57.8 7088 http://www.s PHYSPROP
    20779 2-hydroxymetOCc1ccco1 -14.6 7083 http://www.s PHYSPROP
    20780 triethylborineCCB(CC)CC -93 7079 http://www.s PHYSPROP
    20781 methacrylic acCC(=C)C(=O)O -75 7076 http://www.s PHYSPROP
    20782 isobutyl isobuCC(C)C(=O)OC -80.7 7073 http://www.s PHYSPROP
    20783 tetramethylthCN(C)C(=S)SC( 109.5 7070 http://www.s PHYSPROP
    20784 propanoic acidCC(C)C(=O)OC -53.5 7069 http://www.s PHYSPROP
    20785 ethyl methacrC=C(C)C(=O)O -75 7066 http://www.s PHYSPROP
    20786 ethyl isobutyrCC(C)C(=O)OC -88.2 7065 http://www.s PHYSPROP
    20787 benzenamine,Nc1ccc(cc1OC) 141 7060 http://www.s PHYSPROP
    20788 guanidine, n,nCc2ccccc2NC( 179 7056 http://www.s PHYSPROP
    20789 di(2-hydroxy- Oc2ccc(Cl)cc2 174 7052 http://www.s PHYSPROP
    20790 genite Clc2cc(Cl)ccc 45.5 7050 http://www.s PHYSPROP
    20791 benzoic acid, Oc1ccc(cc1C( 120 7046 http://www.s PHYSPROP
    20792 2,4-dinitroani O=[N+]([O-])c 180 7045 http://www.s PHYSPROP
    20793 benzoic acid, O=[N+]([O-])c 182.8 7044 http://www.s PHYSPROP
    20794 5-nitrosalicyli OC(=O)c1cc(cc 229.5 7042 http://www.s PHYSPROP
    20795 iophenoxic acIc1cc(I)c(O)c( 147 7041 http://www.s PHYSPROP
    20796 2-(bis(1-methCC(C)N(CCO)C -39 7039 http://www.s PHYSPROP
    20797 2,4-di-t-butyl CC(C)(C)c1cc( 56.5 7037 http://www.s PHYSPROP
    20798 4,4'-thiobis(6-CC(C)(C)c2cc( 162 7034 http://www.s PHYSPROP
    20799 phenol, 4,4'-t CC(C)(C)c2cc( 125.5 7033 http://www.s PHYSPROP
    20800 soman CC(OP(C)(F)=O -42 7032 http://www.s PHYSPROP
    20801 1,3-dioxolan- O=C1OCCO1 39.5 7030 http://www.s PHYSPROP
    20802 gamma-butyroO=C1CCCO1 -43.3 7029 http://www.s PHYSPROP
    20803 2-chlorothiop Clc1cccs1 -71.9 7027 http://www.s PHYSPROP
    20804 cyclopentanolOC1CCCC1 -19 7026 http://www.s PHYSPROP
    20805 methylcyclop CC1CCCC1 -142.5 7024 http://www.s PHYSPROP
    20806 methyl acryla C=CC(=O)OC -76.5 7022 http://www.s PHYSPROP
    20807 dimethylurea,CNC(=O)NC 108 7021 http://www.s PHYSPROP
    20808 3-pentanone CCC(=O)CC -39 7016 http://www.s PHYSPROP
    20809 1,2,3-trichlo ClCC(Cl)CCl -14.7 7013 http://www.s PHYSPROP
    20810 2-methylbutanCC(CC)C=O 91 7012 http://www.s PHYSPROP
    20811 3-methylpent CC(CC)CC -162.9 7010 http://www.s PHYSPROP x clearly out of range JCB
    20812 1,2-dibromo-3BrC(CBr)CCl 6 7008 http://www.s PHYSPROP
    20813 propane, 1,2, BrC(CBr)CBr 16.9 7007 http://www.s PHYSPROP
    20814 styrene oxide c1ccccc1C2CO -35.6 7005 http://www.s PHYSPROP
    20815 dilactide CC1OC(=O)C( 117.5 7002 http://www.s PHYSPROP
    20816 2,4,5-trichlor Oc1cc(Cl)c(Cl) 69 7001 http://www.s PHYSPROP
    20817 1,2,4,5-tetra Cc1cc(C)c(C)c 79.3 6999 http://www.s PHYSPROP
    20818 ethyl oxalate CCOC(=O)C(= -40.6 6998 http://www.s PHYSPROP
    20819 phenol, 2-amiNc1cc(Cl)ccc1 140 6995 http://www.s PHYSPROP
    20820 phenol, 2-amiCc1ccc(O)c(N) 136 6994 http://www.s PHYSPROP
    20821 4-chloro-1,2- Nc1cc(Cl)ccc1 76 6993 http://www.s PHYSPROP
    20822 2,4-toluenedi Nc1cc(N)c(C)c 99 6991 http://www.s PHYSPROP
    20823 5-chloro-o-tolNc1cc(Cl)ccc1 26 6990 http://www.s PHYSPROP
    20824 3,4-dichlorop Oc1cc(Cl)c(Cl) 68 6988 http://www.s PHYSPROP
    20825 3-chloro-p-tolNc1cc(Cl)c(C) 26 6985 http://www.s PHYSPROP
    20826 1,4-benzenediOc1ccc(O)c(C) 128 6983 http://www.s PHYSPROP
    20827 2,5-diaminotoNc1ccc(N)c(C) 64 6982 http://www.s PHYSPROP
    20828 2-methyl-4-chCc1cc(Cl)ccc1 30.3 6981 http://www.s PHYSPROP
    20829 1,2,4-trimeth Cc1cc(C)c(C)c -43.8 6977 http://www.s PHYSPROP
    20830 1,4-dioxane, 2ClC1OCCOC1C 30 6976 http://www.s PHYSPROP
    20831 o-bromophenoOc1ccccc1Br 5.6 6974 http://www.s PHYSPROP
    20832 o-xylene Cc1ccccc1C -25.2 6967 http://www.s PHYSPROP
    20833 n-cyclohexyl- c1cccc2sc(nc 98 6962 http://www.s PHYSPROP
    20834 4-morpholinyl-c1cccc2sc(nc 135 6961 http://www.s PHYSPROP
    20835 benzothiazole,Cc1cc2nc(C)sc 38 6957 http://www.s PHYSPROP
    20836 2-benzothiazoClc1ccc2NC(= 200 6956 http://www.s PHYSPROP
    20837 benzoxazole, Cc1nc2ccccc2 9.5 6955 http://www.s PHYSPROP
    20838 2-methylindolCc1cc2ccccc2 61 6954 http://www.s PHYSPROP
    20839 benzothiazolec1cccc2scnc1 2 6952 http://www.s PHYSPROP
    20840 benzo(b)thio c1cccc2sccc12 32 6951 http://www.s PHYSPROP
    20841 benzothiophec1cccc2sccc12 31.5 6951 http://www.s PHYSPROP
    20842 1h-benzotriazc1cccc2nnnc1 100 6950 http://www.s PHYSPROP
    20843 indene c1cccc2CC=Cc -1.8 6949 http://www.s PHYSPROP
    20844 5-norbornene-N#CC2CC1C=C 13 6948 http://www.s PHYSPROP
    20845 sulfiram CCN(CC)C(=S) 31 6945 http://www.s PHYSPROP
    20846 benzaldehyde,O=Cc1ccc(O)c 135 6943 http://www.s PHYSPROP
    20847 2,4-dichlorobeClCc1ccc(Cl)cc -2.6 6942 http://www.s PHYSPROP
    20848 2,4-deb Clc2cc(Cl)ccc 66 6939 http://www.s PHYSPROP
    20849 mcpb Clc1cc(C)c(OC 100 6938 http://www.s PHYSPROP
    20850 2-methyl-4-chClc1cc(C)c(OC 120 6935 http://www.s PHYSPROP
    20851 formamide, n-O=CNc1ccccc 62 6933 http://www.s PHYSPROP
    20852 1,3-benzodioxo
    O=C(O)c1ccc 229 6928 http://www.s PHYSPROP
    20853 1h-benzimidazo
    [O-][N+](=O)c 208 6927 http://www.s PHYSPROP
    20854 dipentamethylS=C(SSC(=S)N 137.5 6920 http://www.s PHYSPROP
    20855 benzoyl peroxO=C(OOC(=O)c 105 6919 http://www.s PHYSPROP
    20856 styramate OC(COC(N)=O) 111.5 6918 http://www.s PHYSPROP
    20857 p-hydroxy butOc1ccc(cc1)C 68.5 6916 http://www.s PHYSPROP
    20858 parethoxycainCCOc1ccc(cc1 173 6915 http://www.s PHYSPROP
    20859 benzoic acid, Nc1ccc(cc1)C 64.5 6908 http://www.s PHYSPROP
    20860 p-hydroxy proOc1ccc(cc1)C 97 6907 http://www.s PHYSPROP
    20861 propyl-p-ami Nc1ccc(cc1)C 75 6906 http://www.s PHYSPROP
    20862 2,4-d, isopropClc1cc(Cl)ccc 5 6905 http://www.s PHYSPROP
    20863 synephrine OC(CNC)c1ccc 184.5 6904 http://www.s PHYSPROP
    20864 benzanilide O=C(Nc1ccccc 163 6900 http://www.s PHYSPROP
    20865 phenyl benzoaO=C(Oc1ccccc 71 6901 http://www.s PHYSPROP
    20866 benzoic acid, O=C(OC(=O)c1 42.5 6899 http://www.s PHYSPROP
    20867 1,3-butanedioO=C(CC(C)=O) 56 6898 http://www.s PHYSPROP
    20868 ethyl benzoatO=C(OCC)c1cc -34 6897 http://www.s PHYSPROP
    20869 2,4,5-t, n-butyClc1cc(OCC(=O 28.5 6894 http://www.s PHYSPROP
    20870 2,4,5-t, isoproClc1cc(OCC(=O 45 6893 http://www.s PHYSPROP
    20871 thioquinox S=C1Sc2nc3cc 180 6892 http://www.s PHYSPROP
    20872 silvex Clc1cc(OC(C)C 181.6 6891 http://www.s PHYSPROP
    20873 butanamide, nClc1ccccc1NC 105 6889 http://www.s PHYSPROP
    20874 2-tolylbiguaniN=C(N)NC(=N) 144 6888 http://www.s PHYSPROP
    20875 butanamide, nO=C(Nc1ccccc 105 6887 http://www.s PHYSPROP
    20876 mecoprop-p Clc1cc(C)c(OC 95 6886 http://www.s PHYSPROP
    20877 mecoprop Clc1cc(C)c(OC 94.5 6886 http://www.s PHYSPROP
    20878 mcpp Clc1cc(C)c(OC 94 6886 http://www.s PHYSPROP
    20879 n-(2-hydroxyetOC(=O)CN(CC 178 6885 http://www.s PHYSPROP
    20880 benzoic acid, COC(=O)c1ccc -15 6883 http://www.s PHYSPROP
    20881 1,2-ethanediolOC(CO)c1cccc 67.5 6882 http://www.s PHYSPROP
    20882 propiophenonO=C(CC)c1ccc 18.6 6881 http://www.s PHYSPROP
    20883 (1,2-dibromoeBrCC(Br)c1ccc 75 6878 http://www.s PHYSPROP
    20884 diafen nn c1cc5ccccc5cc 235 6875 http://www.s PHYSPROP
    20885 4-(2-naphthyl Oc3ccc(Nc1cc2 140 6874 http://www.s PHYSPROP
    20886 quinoline, 2,7 Cc1cc2nc(C)cc 61 6871 http://www.s PHYSPROP
    20887 eugenyl acetaCOc1cc(ccc1O 30.5 6869 http://www.s PHYSPROP
    20888 benzeneaceticCOc1ccccc1CC 124 6867 http://www.s PHYSPROP
    20889 2-(2-naphthyl OCCOc1ccc2cc 76.7 6864 http://www.s PHYSPROP
    20890 naphthalene, CCOc1ccc2ccc 37.5 6862 http://www.s PHYSPROP
    20891 2-naphthaleneClS(=O)(=O)c1 81 6858 http://www.s PHYSPROP
    20892 2-quinolinecarO=C(O)c1ccc2 156 6857 http://www.s PHYSPROP
    20893 2-naphthoic aO=C(O)c1ccc2 185.5 6856 http://www.s PHYSPROP
    20894 1-(2-naphthalCC(=O)c1ccc2 56 6855 http://www.s PHYSPROP
    20895 3,4-dimethoxyCOc1cc(ccc1O 181 6854 http://www.s PHYSPROP
    20896 benzoic acid, COc1cc(ccc1O 180 6854 http://www.s PHYSPROP
    20897 naphthalene, COc1ccc2cccc 73.5 6852 http://www.s PHYSPROP
    20898 2-naphthalenes
    O=S(=O)(O)c1c 125 6850 http://www.s PHYSPROP
    20899 1,1':4',1''-ter c1cc(ccc1)c2c 210.1 6848 http://www.s PHYSPROP
    20900 4-acetylbiphe O=C(C)c1ccc(c 121 6846 http://www.s PHYSPROP
    20901 4,4'-biphenol Oc1ccc(cc1)c2 283 6845 http://www.s PHYSPROP
    20902 benzidine Nc1ccc(cc1)c2 120 6844 http://www.s PHYSPROP
    20903 4,4'-dibromobBrc1ccc(cc1)c 164 6843 http://www.s PHYSPROP
    20904 thianthrene c1ccc2Sc3ccc 159.3 6842 http://www.s PHYSPROP
    20905 9h-xanthene c1ccc2Oc3ccc 100.5 6840 http://www.s PHYSPROP
    20906 oxazole, 2,5-dc1ccc(cc1)c2n 74 6838 http://www.s PHYSPROP
    20907 2-naphthaleneO=C(O)c1cc2c 222.5 6837 http://www.s PHYSPROP
    20908 4-aminobipheNc1ccc(cc1)c2 53.5 6835 http://www.s PHYSPROP
    20909 4-bromobipheBrc1ccc(cc1)c 91.5 6834 http://www.s PHYSPROP
    20910 3,6-diaminoacNc1cc2nc3cc( 285 6832 http://www.s PHYSPROP
    20911 benzenemethan
    CCN(Cc1ccccc 35 6831 http://www.s PHYSPROP
    20912 2-no2-5-di-(a O=[N+]([O-])c 91 6830 http://www.s PHYSPROP
    20913 piperazine, 1- c1cc(ccc1)N2 248.5 6829 http://www.s PHYSPROP x salt JCB
    20914 biphenyl c1cc(ccc1)c2c 69 6828 http://www.s PHYSPROP
    20915 dowtherm c1cc(ccc1)c2c 12 6828 http://www.s PHYSPROP x clearly out of range JCB
    20916 dicyclohexyl C1CC(CCC1)C 4 6827 http://www.s PHYSPROP
    20917 2h-1-benzopyrCc1ccc2OC(=O 76.5 6825 http://www.s PHYSPROP
    20918 2,3-naphthaleOc1cc2ccccc2 162 6824 http://www.s PHYSPROP
    20919 1-phenyl-3-pyO=C1CCN(N1)c 126 6823 http://www.s PHYSPROP
    20920 benzenamine,Nc1ccc(cc1)c2 194.8 6820 http://www.s PHYSPROP
    20921 trifluorometh FC(F)(F)c1cc2 189 6815 http://www.s PHYSPROP
    20922 tetracene c1cccc2cc3cc4 357 6813 http://www.s PHYSPROP
    20923 acetoacet-o-aCOc1ccccc1NC 86 6811 http://www.s PHYSPROP
    20924 m-terphenyl c1cc(ccc1)c2c 87 6809 http://www.s PHYSPROP
    20925 4-phenyl-2-chOc1ccc(cc1Cl) 77 6807 http://www.s PHYSPROP
    20926 1,1'-biphenyl,O=C=Nc1ccc(c 71 6805 http://www.s PHYSPROP
    20927 3,3'-diaminobNc1ccc(cc1N)c 176 6804 http://www.s PHYSPROP
    20928 3,3'-dichlorobNc1ccc(cc1Cl) 132.5 6803 http://www.s PHYSPROP
    20929 3,3'-dimethoxCOc1cc(ccc1/ 114 6802 http://www.s PHYSPROP
    20930 1,3,5-triazine c1cc(ccc1)N2C 144 6798 http://www.s PHYSPROP
    20931 benzoguanamNc1nc(nc(N)n1 226.5 6797 http://www.s PHYSPROP
    20932 phenol, 3-(dieOc1cccc(c1)N 78 6795 http://www.s PHYSPROP
    20933 n,n-diethylaniCCN(CC)c1ccc -38.8 6794 http://www.s PHYSPROP
    20934 6-methylquinoCc1ccc2ncccc -22 6792 http://www.s PHYSPROP
    20935 2-naphthaleneSc1ccc2ccccc2 81 6791 http://www.s PHYSPROP
    20936 2-naphthylamNc1ccc2ccccc 113 6790 http://www.s PHYSPROP
    20937 2-chloronaphtClc1ccc2ccccc 61 6789 http://www.s PHYSPROP
    20938 2-methylnaphCc1ccc2ccccc 34.4 6788 http://www.s PHYSPROP
    20939 1h-indole, 2,3Cc1c2ccccc2n 106 6786 http://www.s PHYSPROP
    20940 2,4-dimethoxyCOc1cc(ccc1C 109 6785 http://www.s PHYSPROP
    20941 acetamide, n-CC(=O)N(CCCC 24.5 6784 http://www.s PHYSPROP
    20942 2-nitroanisoleCOc1ccccc1[N+ 10.5 6781 http://www.s PHYSPROP
    20943 quinoline c1cccc2cccnc -14.78 6780 http://www.s PHYSPROP
    20944 trans-bicyclo[ C1CCC2CCCCC -30.3 10265270 http://www.s PHYSPROP
    20945 cis-bicyclo[4. C1CCC2CCCCC -42.9 10179239 http://www.s PHYSPROP
    20946 1,2-dicyanob N#Cc1ccccc1 140 6775 http://www.s PHYSPROP
    20947 2,6-dimethox COc1cccc(OC) 56.5 6774 http://www.s PHYSPROP
    20948 toluene-2,6-d O=C=Nc1cccc 18.3 6773 http://www.s PHYSPROP
    20949 1,3-benzenediOCc1cc(C)cc( 129 6772 http://www.s PHYSPROP
    20950 phenyl-a-pyri O=C(c1ccccc1 42 6771 http://www.s PHYSPROP
    20951 benzhydrol OC(c1ccccc1)c 69 6770 http://www.s PHYSPROP
    20952 benzhydrylamNC(c1ccccc1)c 34 6769 http://www.s PHYSPROP
    20953 benzene, 1,1' ClC(c1ccccc1) 16 6768 http://www.s PHYSPROP
    20954 methanone, biO=C(c1ccc(Cl) 147.5 6767 http://www.s PHYSPROP
    20955 4,4-bis(dime CN(C)c1ccc(cc 179 6764 http://www.s PHYSPROP
    20956 methanone, ( O=C(c1ccc(Br) 82.5 6763 http://www.s PHYSPROP
    20957 3,5-dibromsalOc1c(C=O)cc(B 86 6757 http://www.s PHYSPROP
    20958 9-aminoacridiNc1c3ccccc3n 241 6752 http://www.s PHYSPROP
    20959 9(10h)-anthr O=C1c3ccccc3 155 6751 http://www.s PHYSPROP
    20960 1,1'-bicycloheO=C1CCCCC1C -32 6749 http://www.s PHYSPROP
    20961 2-aminobipheNc2ccccc2c1c 51 6748 http://www.s PHYSPROP
    20962 1-naphthalenac1ccc3ccccc3 62 6746 http://www.s PHYSPROP
    20963 benzeneaceticCCC(C(=O)O)c 47.5 6745 http://www.s PHYSPROP
    20964 benzeneacetam
    CCC(C(N)=O)c 86 6744 http://www.s PHYSPROP
    20965 benzenemethan
    ClC(Cl)(Cl)C( 87.5 6741 http://www.s PHYSPROP
    20966 1,2,3-benzotriO=C2N=NNc1c 217 6740 http://www.s PHYSPROP
    20967 1-naphthol Oc2cccc1cccc 95 6739 http://www.s PHYSPROP
    20968 1-chloronaphtClc2cccc1cccc -2.5 6737 http://www.s PHYSPROP
    20969 methyl naphthCc2cccc1cccc 34 6736 http://www.s PHYSPROP
    20970 1-methylnaphCc2cccc1cccc -30.4 6736 http://www.s PHYSPROP
    20971 1-bromonaphtBrc2cccc1cccc -1.8 6735 http://www.s PHYSPROP
    20972 benzenemethaCc1ccccc1CO 38 6728 http://www.s PHYSPROP
    20973 benzenemethaCc1ccccc1CN -30 6727 http://www.s PHYSPROP
    20974 benzene, 1-(bCc1ccccc1CBr 21 6726 http://www.s PHYSPROP
    20975 4-nitro-m-xyl Cc1cc(C)ccc1[ 9 6725 http://www.s PHYSPROP
    20976 ethanone, 1-( O=C(C)c1ccc( 146 6724 http://www.s PHYSPROP
    20977 (-)-menthone CC(C)C1CCC(C -6 6720 http://www.s PHYSPROP
    20978 o-sec-butylphOc1ccccc1C(C 16 6718 http://www.s PHYSPROP
    20979 chlorothymol Oc1cc(C)c(Cl) 63 6716 http://www.s PHYSPROP
    20980 4-chloro-2-ni Oc1ccc(Cl)cc1 88.5 6714 http://www.s PHYSPROP
    20981 4-chloro-2-nitNc1ccc(Cl)cc1 116.5 6713 http://www.s PHYSPROP
    20982 3-nitro-4-tolu O=[N+]([O-])c 45.5 6712 http://www.s PHYSPROP
    20983 benzene, 1-chO=[N+]([O-])c 7 6710 http://www.s PHYSPROP
    20984 benzene, 4-chCc1ccc(Cl)cc1 38 6709 http://www.s PHYSPROP
    20985 benzene, 1,4- Cc1ccc(C)cc1[ -25 6708 http://www.s PHYSPROP
    20986 5-methylsalicyOC(=O)c1cc(C 151 6707 http://www.s PHYSPROP
    20987 n-acetyl o-amO=C(C)Nc1ccc 185.5 6705 http://www.s PHYSPROP
    20988 4-nitrophthal [O-][N+](=O) 201 6703 http://www.s PHYSPROP
    20989 carbamodithioi
    S=C(Sc1ccc(cc 152.5 6701 http://www.s PHYSPROP
    20990 pyromellitic a OC(=O)c1cc(c 276 6695 http://www.s PHYSPROP
    20991 2,4-dinitrobenOS(=O)(=O)c1c 108 6693 http://www.s PHYSPROP
    20992 1,2-benzenedO=C(N)c1cccc 222 6690 http://www.s PHYSPROP
    20993 2,4,6-trinitro O=[N+]([O-])c 122.5 6688 http://www.s PHYSPROP
    20994 2,4,6-trinitro O=[N+]([O-])c 83 6687 http://www.s PHYSPROP
    20995 4-chloro-2,6-dO=[N+]([O-])c 81 6686 http://www.s PHYSPROP
    20996 dinoseb O=[N+]([O-])c 40 6684 http://www.s PHYSPROP
    20997 o-isopropylphCC(C)c1ccccc 15.5 6677 http://www.s PHYSPROP
    20998 2-iodobenzoicOC(=O)c1cccc 163 6675 http://www.s PHYSPROP
    20999 o-bromobenzoi
    OC(=O)c1cccc 150 6674 http://www.s PHYSPROP
    21000 benzenesulfoni
    Cc1cc(C)ccc1S 57 6672 http://www.s PHYSPROP
    21001 phenol, 2-(1,1CC(C)(C)c1ccc 46.5 6671 http://www.s PHYSPROP
    21002 3-trifluorome O=[N+]([O-])c 76 6665 http://www.s PHYSPROP
    21003 versalide CC(=O)c1cc2c( 46.5 6664 http://www.s PHYSPROP
    21004 2,6-di-tert-b CC(C)(C)c1cc( 140 6663 http://www.s PHYSPROP
    21005 2,2'-methylene
    CC(C)(C)c2cc( 120.5 6662 http://www.s PHYSPROP
    21006 o-toluene sulfNc1ccccc1S(O 67.5 6660 http://www.s PHYSPROP
    21007 o-methylbenzCc1ccccc1S(= 156.3 6658 http://www.s PHYSPROP
    21008 o-t-butylphenCC(C)(C)c1ccc -6.8 6657 http://www.s PHYSPROP
    21009 benzenamine,FC(F)(F)c1ccc 35.5 6656 http://www.s PHYSPROP x out of range and index of refraction repor
    21010 chloro(triflu FC(F)(F)c1cccc -6 6655 http://www.s PHYSPROP
    21011 2-acetylthiop CC(=O)c1cccs 10.5 6654 http://www.s PHYSPROP
    21012 thiophene-3-ca
    O=C(O)c1ccsc 138 6652 http://www.s PHYSPROP
    21013 n-vinyl-2-pyrr O=C1CCCN1C 13.5 6651 http://www.s PHYSPROP
    21014 carbamic chlorCCN(CC)C(Cl) -32 6650 http://www.s PHYSPROP
    21015 2-ethylbutyricCCC(CC)C(=O) -31.8 6649 http://www.s PHYSPROP
    21016 hexamethylbeCc1c(C)c(C)c(C 166.5 6642 http://www.s PHYSPROP
    21017 pentabromotoBrc1c(C)c(Br)c 288 6640 http://www.s PHYSPROP
    21018 hexabromobeBrc1c(Br)c(Br) 326 6639 http://www.s PHYSPROP
    21019 hexachlorobuCl/C(Cl)=C(/Cl -21 6635 http://www.s PHYSPROP
    21020 2,6-dichlorop Clc1cccc(Cl)c 68.5 6633 http://www.s PHYSPROP
    21021 benzenamine,Cc1cccc(Cl)c1 2 6631 http://www.s PHYSPROP
    21022 2,6-dimethylan
    Cc1cccc(C)c1N 11.2 6630 http://www.s PHYSPROP
    21023 2-methyl-3-chNc1cccc(Cl)c1 1 6628 http://www.s PHYSPROP
    21024 1h-indole-3-mCN(C)Cc2cnc1 138.5 6625 http://www.s PHYSPROP
    21025 5-bromoisatinBrc1cc2c(cc1 249.5 6624 http://www.s PHYSPROP
    21026 pyrolan CN(C)C(=O)Oc 50 6623 http://www.s PHYSPROP
    21027 phthalide O=C1OCc2ccc 75 6621 http://www.s PHYSPROP
    21028 2,4,6-trichlor COc1c(Cl)cc(Cl 61.5 6620 http://www.s PHYSPROP
    21029 diazodinitrop [O-][N+](=O)c 158 6618 http://www.s PHYSPROP
    21030 benzoic acid, Oc1ccccc1C( 37 6616 http://www.s PHYSPROP
    21031 benzoic acid, Oc1ccccc1C(= 5.9 6611 http://www.s PHYSPROP
    21032 salicylanilide O=C(Nc1ccccc 136.5 6610 http://www.s PHYSPROP
    21033 quinoline, 4,7 Clc1cc2nccc(C 93 6604 http://www.s PHYSPROP
    21034 2-naphthalenoNc2cccc1cc(O 190.6 6603 http://www.s PHYSPROP
    21035 naphthaleneacO=C(O)Cc2ccc 135 6601 http://www.s PHYSPROP
    21036 1-naphthalen NC(=O)Cc2ccc 184 6600 http://www.s PHYSPROP
    21037 quinisocaine CN(C)CCOc2nc 146 6596 http://www.s PHYSPROP
    21038 2-bromodibenBrc1cc2c3ccc 110 6595 http://www.s PHYSPROP
    21039 benzoxiquine O=C(Oc1cccc2 119 6594 http://www.s PHYSPROP
    21040 carbazole c1cccc2nc3cc 246.2 6593 http://www.s PHYSPROP
    21041 9h-fluorene c1cccc2Cc3cc 114.8 6592 http://www.s PHYSPROP
    21042 2-naphthylamiO=S(=O)(O)c2c 274 6590 http://www.s PHYSPROP
    21043 1-nitronaphth[O-][N+](=O)c 61 6588 http://www.s PHYSPROP
    21044 1-napthoic ac O=C(O)c2cccc 161 6586 http://www.s PHYSPROP
    21045 1-naphthaleneN#Cc2cccc1cc 37.5 6585 http://www.s PHYSPROP
    21046 naphthalene, ClCc2cccc1ccc 32 6584 http://www.s PHYSPROP
    21047 2-naphthaleneO=C(O)c2ccc1 195 6583 http://www.s PHYSPROP
    21048 n-methyl-2-phO=C1C(CC(=O) 72 6578 http://www.s PHYSPROP
    21049 diphenylnitro O=NN(c1ccccc 66.5 6577 http://www.s PHYSPROP
    21050 diphenylaceton
    N#CC(c1ccccc1 74.3 6576 http://www.s PHYSPROP
    21051 n-ethylcarbaz CCn3c1ccccc1 68 6575 http://www.s PHYSPROP
    21052 1,1'-biphenyl COc2ccccc2c1 29 6574 http://www.s PHYSPROP
    21053 diethyl diphenCCN(C(=O)N(C 79 6567 http://www.s PHYSPROP
    21054 2-naphthalenaNc3ccc1ccccc 103 6564 http://www.s PHYSPROP
    21055 quinoline, 6-m[O-][N+](=O)c 159 6563 http://www.s PHYSPROP
    21056 3'-methylphtha
    O=C(Nc1cc(C) 150 6562 http://www.s PHYSPROP
    21057 butylglycolyl O=C(OCCCC)C -35 6560 http://www.s PHYSPROP
    21058 2-benzoylbenzOC(=O)c2cccc 127 6554 http://www.s PHYSPROP
    21059 1-naphthaleneO=S(=O)(O)c2 140 6553 http://www.s PHYSPROP
    21060 phthalic anhy O=C1OC(=O)c2 130.8 6552 http://www.s PHYSPROP
    21061 tetrahydrophtO=C1OC(=O)C 101.9 6551 http://www.s PHYSPROP
    21062 phthalimide O=C1NC(=O)c2 238 6550 http://www.s PHYSPROP
    21063 p-nitrosalicyli O=[N+]([O-])c 148 6548 http://www.s PHYSPROP
    21064 fenac Clc1c(CC(=O)O 161 6546 http://www.s PHYSPROP
    21065 pentabromoetBrc1c(CC)c(Br) 138 6542 http://www.s PHYSPROP
    21066 benzo(f)quinoc2cc1ncccc1c 94 6538 http://www.s PHYSPROP
    21067 5-quinolinesulO=S(=O)(O)c1 322.5 6534 http://www.s PHYSPROP
    21068 didecyl phthalO=C(OCCCCCC 2.5 6530 http://www.s PHYSPROP
    21069 dihexyl phthalO=C(OCCCCCC -58 6528 http://www.s PHYSPROP
    21070 di-isobutylphtCC(C)COC(=O) -64 6524 http://www.s PHYSPROP
    21071 diphenyl phthO=C(Oc1ccccc 73 6520 http://www.s PHYSPROP
    21072 dicyclohexyl pO=C(OC1CCCC 66 6519 http://www.s PHYSPROP
    21073 2,3-dichloro- ClC=1C(=O)C( 214.5 6517 http://www.s PHYSPROP
    21074 9,10-anthraceCc2ccc3C(=O) 177 6515 http://www.s PHYSPROP
    21075 2-ethylanthraCCc2ccc3C(=O 109.5 6514 http://www.s PHYSPROP
    21076 quininone COc1cc2c(cc1 108 6510 http://www.s PHYSPROP
    21077 o-terphenyl c1cc(ccc1)c3c 56.2 6508 http://www.s PHYSPROP
    21078 9,10-phenant O=C2c3ccccc3 209 6505 http://www.s PHYSPROP
    21079 pipamazine NC(=O)C1CCN( 139 6503 http://www.s PHYSPROP
    21080 furo[2,3-b]quiCOc2c3ccoc3n 177 6502 http://www.s PHYSPROP
    21081 rotenone C=C(C)[C@@H 176 6500 http://www.s PHYSPROP
    21082 benzene, 1-(1COc1c(cc(c(C) 85 6496 http://www.s PHYSPROP
    21083 diacetazotol O=C(C)N(C(C) 75 6494 http://www.s PHYSPROP
    21084 4(1h)-quinoli O=C2C=CN(C)c 152 6491 http://www.s PHYSPROP
    21085 3-beta, 5-alphCC(C)C(CC)CC 144 6487 http://www.s PHYSPROP
    21086 benzene, 1-chCc1c(cccc1Cl) 37.8 6484 http://www.s PHYSPROP
    21087 1,2-dimethyl- Cc1c(C)cccc1[ 15 6483 http://www.s PHYSPROP
    21088 3-methylsalicyOC(=O)c1cccc 165.5 6482 http://www.s PHYSPROP
    21089 2,6-dichlorob O=Cc1c(Cl)ccc 71.5 6481 http://www.s PHYSPROP
    21090 3-methylindolCc2cnc1ccccc 97.5 6480 http://www.s PHYSPROP
    21091 1h-inden-1-onO=C1CCc2cccc 42 6479 http://www.s PHYSPROP
    21092 acenaphthenec1cc2cccc3CCc 93.4 6478 http://www.s PHYSPROP
    21093 valone CC(C)CC(=O)C 68.5 6477 http://www.s PHYSPROP
    21094 pindone CC(C)(C)C(=O 109 6476 http://www.s PHYSPROP
    21095 solvent yellowO=C4c1ccccc1 241 6475 http://www.s PHYSPROP
    21096 dda Clc1ccc(cc1)C 168 6474 http://www.s PHYSPROP
    21097 cyclizine CN1CCN(CC1)C 105.5 6470 http://www.s PHYSPROP
    21098 1,2-acenaphthO=C3c2cccc1c 261 6468 http://www.s PHYSPROP
    21099 4-pyridoxic acOc1c(C(=O)O) 247.5 6467 http://www.s PHYSPROP
    21100 2,4,6-trinitror O=[N+]([O-])c 175.5 6465 http://www.s PHYSPROP
    21101 pentachloroniClc1c(c(Cl)c(C 144 6464 http://www.s PHYSPROP
    21102 diphacinone O=C2c1ccccc1 146.5 6463 http://www.s PHYSPROP
    21103 3,4,6-trichlor Clc1c([N+]([O- 92.5 6462 http://www.s PHYSPROP
    21104 visnagin COc1c3ccoc3c 144.5 6460 http://www.s PHYSPROP
    21105 1-aminoanthrO=C3c1ccccc1 253.5 6454 http://www.s PHYSPROP
    21106 1-chloroanthrO=C3c1ccccc1 163 6453 http://www.s PHYSPROP
    21107 9,10-anthracen
    [O-][N+](=O)c 385 6449 http://www.s PHYSPROP
    21108 1-nitroanthra [O-][N+](=O)c 231.5 6448 http://www.s PHYSPROP
    21109 1-amino-2-metO=C3c1ccccc1 205.5 6447 http://www.s PHYSPROP
    21110 1-aminoanthraO=C(O)c3ccc2 295.5 6446 http://www.s PHYSPROP
    21111 benzanthroneO=C3c4ccccc4 170 6442 http://www.s PHYSPROP
    21112 1,8-naphthali O=C3OC(=O)c2 270 6438 http://www.s PHYSPROP
    21113 1,4-dihydroxyO=C2c1ccccc1 200 6433 http://www.s PHYSPROP
    21114 purpurin O=C2c1ccccc1 259 6431 http://www.s PHYSPROP
    21115 1-amino-2,4- O=C2c1ccccc1C 221 6429 http://www.s PHYSPROP
    21116 2 benzopyranoO=C4OC(=O)c1 450 6426 http://www.s PHYSPROP
    21117 1,3-dimethyl- Cc1cccc(C)c1[ 15 6420 http://www.s PHYSPROP
    21118 2-amino-1-napO=S(=O)(O)c2c 180 6418 http://www.s PHYSPROP
    21119 musk ketone O=[N+]([O-])c 135.5 6417 http://www.s PHYSPROP
    21120 acetyl sulfiso Cc1c(onc1C)N( 193.5 6410 http://www.s PHYSPROP
    21121 1,3-dimethyl- O=C1N(C)CCN 8.2 6409 http://www.s PHYSPROP
    21122 cyclotene O=C1CCC(C)= 106.5 6408 http://www.s PHYSPROP
    21123 methyl methacC=C(C)C(=O)O -47.55 6406 http://www.s PHYSPROP
    21124 alpha-aminobu
    CCC(N)C(=O)O 304 6405 http://www.s PHYSPROP
    21125 a-bromobutyriBrC(CC)C(=O) -4 6403 http://www.s PHYSPROP
    21126 dl-pin-2(3)-enCC2(C)C1CC=C -55 6402 http://www.s PHYSPROP
    21127 bicyclo 3.1.1 CC2(C)C1CC=C -61 6402 http://www.s PHYSPROP
    21128 (+)-alpha-pin CC2(C)C1CC=C -62 6402 http://www.s PHYSPROP
    21129 alpha-pinene CC2(C)C1CC=C -62.5 6402 http://www.s PHYSPROP
    21130 trans-terpin CC1(O)CCC(CC 158.5 6399 http://www.s PHYSPROP
    21131 terpin CC1(O)CCC(CC 158 6399 http://www.s PHYSPROP
    21132 p-menthane-1,CC1(N)CCC(CC -45 6398 http://www.s PHYSPROP
    21133 benzenesulfoni
    COS(=O)(=O)c1 28.5 6393 http://www.s PHYSPROP
    21134 peroxide, bis( CC(C)(OOC(C)( 40.6 6389 http://www.s PHYSPROP
    21135 ethyl-p-methyO=S(=O)(OCC) 34.5 6386 http://www.s PHYSPROP
    21136 chlorfenson Clc1ccc(cc1)S 86.5 6383 http://www.s PHYSPROP
    21137 sulfachlorpyri O=S(=O)(Nc1cc 187 6382 http://www.s PHYSPROP
    21138 cumene hydroOOC(C)(C)c1c -9 6377 http://www.s PHYSPROP
    21139 benzenesulfonCc1ccc(cc1)S 60 6376 http://www.s PHYSPROP
    21140 phenol, 4,4'-s Oc1ccc(cc1)S( 240.5 6374 http://www.s PHYSPROP
    21141 benzene, 1,1'-O=S(=O)(c1ccc 147.9 6373 http://www.s PHYSPROP
    21142 dimite OC(C)(c1ccc(Cl 70 6372 http://www.s PHYSPROP
    21143 diphenylolproCC(C)(c1ccc(O 153 6371 http://www.s PHYSPROP
    21144 2-p-sulfanilyl O=S(=O)(c1ccc 131 6370 http://www.s PHYSPROP
    21145 sulphenone O=S(=O)(c1ccc 94 6369 http://www.s PHYSPROP
    21146 3,3'-dimethyl Cc1cc(ccc1O)C 139 6368 http://www.s PHYSPROP
    21147 tetrachlorodi Clc1cc(cc(Cl)c 135 6367 http://www.s PHYSPROP
    21148 2,2-bis(4-hyd Brc1cc(cc(Br)c 181 6366 http://www.s PHYSPROP
    21149 (+)-campheneCC2(C)C(=C)C 52 6364 http://www.s PHYSPROP
    21150 bicyclo 2.2.1 CC2(C)C(=C)C 51.5 6364 http://www.s PHYSPROP
    21151 camphene CC2(C)C(=C)C 51.2 6364 http://www.s PHYSPROP
    21152 1,4-benzenedio
    Oc1cc(c(O)cc1 180 6359 http://www.s PHYSPROP
    21153 chloropentafl FC(F)(F)C(=O)C -133 6351 http://www.s PHYSPROP
    21154 dimethylcarbaCN(C)C(Cl)=O -33 6348 http://www.s PHYSPROP
    21155 methacrylamiC=C(C)C(N)=O 110 6346 http://www.s PHYSPROP
    21156 chlorotrifluo F/C(F)=C(Cl)F -108.9 6345 http://www.s PHYSPROP x Other sources support -158 - EC
    21157 chlorotrifluor F/C(F)=C(/Cl)F -158 6345 http://www.s PHYSPROP
    21158 1,1,2,2-tetra ClC(Cl)C(Cl)Cl -43.8 6342 http://www.s PHYSPROP
    21159 isobutyric aci CC(C)C(=O)O -46 6341 http://www.s PHYSPROP
    21160 2,3-dimethylbCC(C)C(C)C -128.8 6340 http://www.s PHYSPROP
    21161 1,1,2,2-tetra BrC(Br)C(Br)Br 0 6339 http://www.s PHYSPROP
    21162 nitroethane [O-][N+](=O)C -89.5 6338 http://www.s PHYSPROP
    21163 methyl chloroClC(=O)OC -61 6337 http://www.s PHYSPROP
    21164 peroxyacetic aCC(=O)OO -0.2 6336 http://www.s PHYSPROP
    21165 methyl acetatCC(=O)OC -98 6335 http://www.s PHYSPROP
    21166 n-methylacet CC(=O)NC 28 6334 http://www.s PHYSPROP
    21167 acrylic acid C=CC(=O)O 12.5 6333 http://www.s PHYSPROP
    21168 chloroacetamClCC(N)=O 121 6332 http://www.s PHYSPROP
    21169 acrylamide C=CC(N)=O 84.5 6331 http://www.s PHYSPROP
    21170 proprionamidCCC(N)=O 81.3 6330 http://www.s PHYSPROP
    21171 1,1,2-trichlor ClCC(Cl)Cl -36.6 6326 http://www.s PHYSPROP
    21172 chloroacetoneCC(=O)CCl -44.5 6323 http://www.s PHYSPROP
    21173 2-butanone CC(=O)CC -86.6 6321 http://www.s PHYSPROP
    21174 2-butanol CC(O)CC -114.7 6320 http://www.s PHYSPROP
    21175 2,3-dichlorop C=C(Cl)CCl 10 6317 http://www.s PHYSPROP x same as flash point JCB
    21176 1,2-dichlorop CC(Cl)CCl -100 6316 http://www.s PHYSPROP
    21177 isobutyl chlor CC(Cl)CC -130.3 6315 http://www.s PHYSPROP
    21178 2-chlorobutanCC(Cl)CC -140 6315 http://www.s PHYSPROP
    21179 methacrolein C=C(C)C=O -81 6314 http://www.s PHYSPROP
    21180 isobutyraldehCC(C)C=O -65.9 6313 http://www.s PHYSPROP
    21181 isobutyl alcohCC(C)CO -108 6312 http://www.s PHYSPROP
    21182 2-methylpropaCC(C)C#N -71.5 6311 http://www.s PHYSPROP
    21183 2-methyl-1,3-C=C(C)C=C -145.9 6309 http://www.s PHYSPROP
    21184 isobutylamineCC(C)CN -85 6310 http://www.s PHYSPROP
    21185 isopentane CC(C)CC -159.77 6308 http://www.s PHYSPROP
    21186 isobutyl bromCC(C)CBr -119 6307 http://www.s PHYSPROP
    21187 2-bromobuta BrC(C)CC -112 6306 http://www.s PHYSPROP
    21188 1,2-dibromopBrC(C)CBr -55.49 6305 http://www.s PHYSPROP
    21189 oxetane, 3,3-bClCC1(CCl)CO 18.7 6302 http://www.s PHYSPROP
    21190 3,7-dimethyl- CCC(C)(O)CCC 31.5 6300 http://www.s PHYSPROP
    21191 2,2'-azobis(2- N#CC(C)(C)/N 101.5 6299 http://www.s PHYSPROP
    21192 varox CC(C)(C)OOC(C 8 6297 http://www.s PHYSPROP
    21193 isophorone O=C1C=C(C)CC -8.1 6296 http://www.s PHYSPROP
    21194 menazon Nc1nc(CSP(=S 165 6295 http://www.s PHYSPROP
    21195 tri-2-butoxye CCCCOCCOP(= -70 6292 http://www.s PHYSPROP
    21196 tris(2-ethylhe CCCCC(COP(=O -74 6289 http://www.s PHYSPROP
    21197 triparanol Clc3ccc(CC(O) 103 6288 http://www.s PHYSPROP
    21198 triethyl phospCCOP(=O)(OC -56.4 6287 http://www.s PHYSPROP
    21199 dioxathion S=P(SC1OCCOC -20 6283 http://www.s PHYSPROP
    21200 tri-p-cresyl p Cc1ccc(cc1)OP 77.5 6281 http://www.s PHYSPROP
    21201 3-pentanol, 3 CC(CC)(CC)OC 56 6278 http://www.s PHYSPROP
    21202 1-ethynyl cyc C#CC1(O)CCC 31.5 6277 http://www.s PHYSPROP
    21203 pentaerythritoOC(OCC(COC(O)C 53 6272 http://www.s PHYSPROP
    21204 pentaerythritoO=[N+]([O-])O 140.5 6271 http://www.s PHYSPROP
    21205 tetraethoxysi CCO[Si](OCC) -82.5 6270 http://www.s PHYSPROP
    21206 3-mercaptoproO=C(O)CCS 18 6267 http://www.s PHYSPROP
    21207 butyl citrate OC(CC(=O)OC -20 6261 http://www.s PHYSPROP
    21208 acetyl tributylCCCCOC(=O)CC -80 6259 http://www.s PHYSPROP
    21209 1,3-propanediCC(CO)(CO)CO 204 6256 http://www.s PHYSPROP
    21210 tabun N#CP(=O)(OCC -50 6254 http://www.s PHYSPROP
    21211 2,5-dihydrothO=S1(=O)CC= 64.5 6253 http://www.s PHYSPROP
    21212 dimethylsulfa O=S(=O)(OC)O -27 6252 http://www.s PHYSPROP
    21213 1,1'-sulfonylb C=CS(=O)(=O) -26 6251 http://www.s PHYSPROP
    21214 3-methyl-3-peCC(O)(CC)CC -23.6 6248 http://www.s PHYSPROP
    21215 3a,4,7,7a-tet C=2CC3C1C=C 32 6247 http://www.s PHYSPROP
    21216 dicyclopentadC=2CC3C1C=C -1 6247 http://www.s PHYSPROP
    21217 2,4-imidazolidO=C1NC(=O)C( 178 6246 http://www.s PHYSPROP
    21218 acecarbromal O=C(C)NC(=O) 109 6244 http://www.s PHYSPROP
    21219 carbromal CCC(Br)(CC)C 118 6243 http://www.s PHYSPROP
    21220 2,4,6,8-tetramC[Si]1(O[Si](C 99 6242 http://www.s PHYSPROP
    21221 2-methyl-2-ni[O-][N+](=O)C 150.1 6235 http://www.s PHYSPROP
    21222 hexachlorocycClC=1C(Cl)=C(C -9 6233 http://www.s PHYSPROP
    21223 acedapsone O=S(=O)(c1ccc 290 6232 http://www.s PHYSPROP
    21224 methsuximideCC1(CC(=O)N( 52.5 6231 http://www.s PHYSPROP
    21225 5-butyl-5-ethyO=C1NC(=O)N 128.5 6229 http://www.s PHYSPROP
    21226 phencyclidineC1CC(CCC1)(c 46.5 6224 http://www.s PHYSPROP
    21227 gibberellic aciO=C(O)[C@H] 234 6223 http://www.s PHYSPROP
    21228 piperdione CCC1(CC)C(= 104 6222 http://www.s PHYSPROP
    21229 aprobarbital O=C1NC(=O)NC 141 6221 http://www.s PHYSPROP
    21230 benzilic acid OC(C(=O)O)(c1 151 6220 http://www.s PHYSPROP
    21231 chlorotriphenyCl[Si](c1ccccc 91.5 6216 http://www.s PHYSPROP
    21232 triphenylcarbiOC(c1ccccc1)( 164.2 6215 http://www.s PHYSPROP
    21233 benzene, 1,1',ClC(c1ccccc1) 113.5 6214 http://www.s PHYSPROP
    21234 probarbital O=C1NC(=O)NC 203 6213 http://www.s PHYSPROP
    21235 cyclopentabarO=C2NC(=O)N 139.5 6212 http://www.s PHYSPROP
    21236 amolanone CCN(CC)CCC1( 43.4 6211 http://www.s PHYSPROP
    21237 bromcresol grBrc1cc(c(C)c( 218.5 6209 http://www.s PHYSPROP
    21238 bromthymol bCC(C)c1cc(c(C 201 6208 http://www.s PHYSPROP
    21239 bornyl acetat CC(=O)OC1CC2 29 6207 http://www.s PHYSPROP
    21240 2-methyl-2-ni[O-][N+](=O)C 89.5 6202 http://www.s PHYSPROP
    21241 tetrahydroxysu
    OC(O)(C(=O)O 114.5 6199 http://www.s PHYSPROP
    21242 3-bromo-d-caCC2(C)C1CCC2 77 6198 http://www.s PHYSPROP
    21243 [1(r)-endo]-( CC2(C)C1CCC2 76 6198 http://www.s PHYSPROP
    21244 trional O=S(=O)(CC)C( 76 6193 http://www.s PHYSPROP
    21245 octafluoroproFC(F)(F)C(F)(F) -147.6 6192 http://www.s PHYSPROP
    21246 hexafluoroet FC(F)(F)C(F)(F -100.7 6191 http://www.s PHYSPROP
    21247 chloropentafl FC(F)(F)C(Cl)(F -99.4 6190 http://www.s PHYSPROP
    21248 1,1,2-trichlor ClC(F)(F)C(Cl)( -35 6188 http://www.s PHYSPROP
    21249 1,1,2,2,-tetra ClC(Cl)(F)C(Cl) 26 6187 http://www.s PHYSPROP
    21250 1,1,1,2-tetrac ClC(Cl)(Cl)C(Cl 40.6 6186 http://www.s PHYSPROP
    21251 tribromo-tert-BrC(Br)(Br)C(C 169 6184 http://www.s PHYSPROP
    21252 trichloracetyl ClC(Cl)(Cl)C(C -31.8 6180 http://www.s PHYSPROP
    21253 pentachloroe ClC(Cl)C(Cl)(Cl -28.78 6179 http://www.s PHYSPROP
    21254 dalapon CC(Cl)(Cl)C(= -5 6178 http://www.s PHYSPROP
    21255 2,2-dimethyl CC(C)(C)C(=O) 35.5 6177 http://www.s PHYSPROP
    21256 3,3-dimethyl- CC(C)(C)C(C)= -52.5 6176 http://www.s PHYSPROP
    21257 acetic acid, t BrC(Br)(Br)C( 132 6175 http://www.s PHYSPROP
    21258 vinyltrichlorosC=C[Si](Cl)(Cl) -95 6173 http://www.s PHYSPROP
    21259 tert-butylhyd CC(C)(C)OO -8 6170 http://www.s PHYSPROP
    21260 1,1,1-trifluor ClCC(F)(F)F -105.5 6168 http://www.s PHYSPROP
    21261 acetone cyanoN#CC(C)(C)O -19 6166 http://www.s PHYSPROP
    21262 2-methyl-2-buCC(C)(O)CC -9.1 6165 http://www.s PHYSPROP
    21263 2,2-dimethyl- CC(C)(C)CO 52.5 6164 http://www.s PHYSPROP
    21264 2,2-dimethylbCC(C)(C)CC -99 6163 http://www.s PHYSPROP
    21265 ethane, 1,2-d BrC(Cl)(Cl)CBr -26 6161 http://www.s PHYSPROP
    21266 ethanol, 2,2,2BrC(Br)(Br)CO 81 6160 http://www.s PHYSPROP
    21267 methyltrichlorC[Si](Cl)(Cl)Cl -90 6159 http://www.s PHYSPROP
    21268 dichlorodimetC[Si](C)(Cl)Cl -16 6158 http://www.s PHYSPROP
    21269 chlorotrimethyC[Si](C)(C)Cl -40 6157 http://www.s PHYSPROP
    21270 tetramethylsi C[Si](C)(C)C -99 6156 http://www.s PHYSPROP
    21271 methanesulfon
    CS(=O)(=O)O 20 6155 http://www.s PHYSPROP
    21272 tetrafluoromeFC(F)(F)F -183.6 6153 http://www.s PHYSPROP
    21273 chlorotrifluo ClC(F)(F)F -181 6152 http://www.s PHYSPROP
    21274 dichlorodiflu ClC(Cl)(F)F -158 6151 http://www.s PHYSPROP
    21275 trichlorofluo ClC(Cl)(Cl)F -111.1 6149 http://www.s PHYSPROP
    21276 1-chloro-1,1- CC(Cl)(F)F -130.8 6148 http://www.s PHYSPROP
    21277 t-butanol CC(C)(C)O 25.4 6146 http://www.s PHYSPROP
    21278 2-methyl-2-prCC(C)(C)S -0.5 6147 http://www.s PHYSPROP
    21279 t-butylamine CC(C)(C)N -72.65 6145 http://www.s PHYSPROP
    21280 bromotrifluo BrC(F)(F)F -172 6144 http://www.s PHYSPROP
    21281 bromotrichlo BrC(Cl)(Cl)Cl -5.7 6143 http://www.s PHYSPROP
    21282 dibromodiflu BrC(Br)(F)F -110.1 6142 http://www.s PHYSPROP
    21283 propylene oxi CC1CO1 -111.9 6138 http://www.s PHYSPROP
    21284 2-methylaziri CC1CN1 -65 6137 http://www.s PHYSPROP
    21285 dichloromethyC[SiH](Cl)Cl -93 6136 http://www.s PHYSPROP
    21286 nitromethane[O-][N+](C)=O -28.5 6135 http://www.s PHYSPROP
    21287 iodoform IC(I)I 119 6134 http://www.s PHYSPROP
    21288 phosgene ClC(Cl)=O -118 6131 http://www.s PHYSPROP
    21289 chlorodifluor ClC(F)F -157.4 6132 http://www.s PHYSPROP
    21290 dichlorofluor ClC(Cl)F -135 6130 http://www.s PHYSPROP
    21291 1,1-difluoroe CC(F)F -117 6128 http://www.s PHYSPROP
    21292 acetylchlorideCC(Cl)=O -112.8 6127 http://www.s PHYSPROP
    21293 1,1-dichloroe CC(Cl)Cl -96.9 6125 http://www.s PHYSPROP
    21294 2-propanethioCC(C)S -130.5 6124 http://www.s PHYSPROP
    21295 isopropylaminCC(C)N -95.13 6123 http://www.s PHYSPROP
    21296 2-iodopropan CC(C)I -90 6122 http://www.s PHYSPROP
    21297 2-chloroprop CC(C)Cl -117.2 6121 http://www.s PHYSPROP
    21298 2-methylpropCC(C)C -138.3 6120 http://www.s PHYSPROP
    21299 bromodichlor BrC(Cl)Cl -57 6119 http://www.s PHYSPROP
    21300 2-bromoprop BrC(C)C -89 6118 http://www.s PHYSPROP
    21301 boron fluorideF[B@@](F)F -126.8 6116 http://www.s PHYSPROP
    21302 ethylene oxid C1CO1 -111.7 6114 http://www.s PHYSPROP
    21303 cyclopropane C1CC1 -127.4 6111 http://www.s PHYSPROP
    21304 carbon disulfi S=C=S -111.5 6108 http://www.s PHYSPROP
    21305 methylene iodICI 6.1 6106 http://www.s PHYSPROP
    21306 dichlorometh ClCCl -95.1 6104 http://www.s PHYSPROP
    21307 difluorometh FCF -136 6105 http://www.s PHYSPROP
    21308 ethyl mercaptCCS -147.8 6103 http://www.s PHYSPROP
    21309 acetonitrile CC#N -43.8 6102 http://www.s PHYSPROP
    21310 ethylamine CCN -81.2 6101 http://www.s PHYSPROP
    21311 iodoethane CCI -111.1 6100 http://www.s PHYSPROP
    21312 vinylfluoride C=CF -160.5 6099 http://www.s PHYSPROP
    21313 chloroethane CCCl -138.7 6097 http://www.s PHYSPROP
    21314 vinylchloride C=CCl -153.7 6098 http://www.s PHYSPROP
    21315 propyne C#CC -102.7 6095 http://www.s PHYSPROP
    21316 propane CCC -187.6 6094 http://www.s PHYSPROP
    21317 chlorobromo BrCCl -87.9 6093 http://www.s PHYSPROP
    21318 bromoethaneBrCC -118.6 6092 http://www.s PHYSPROP
    21319 methylamine CN -93.4 6089 http://www.s PHYSPROP
    21320 methyl iodideCI -66.4 6088 http://www.s PHYSPROP
    21321 methyl chlori CCl -97.7 6087 http://www.s PHYSPROP
    21322 ethylene C=C -169 6085 http://www.s PHYSPROP
    21323 acetylene C#C -80.7 6086 http://www.s PHYSPROP
    21324 ethane CC -182.79 6084 http://www.s PHYSPROP
    21325 methyl bromi BrC -93.7 6083 http://www.s PHYSPROP
    21326 n,n'-diphenyl c1ccccc1Nc2cc 144 6080 http://www.s PHYSPROP
    21327 4-chlorobenzoOC(=O)c1ccc(C 243 6079 http://www.s PHYSPROP
    21328 1(4-no2 ph)-2O=[N+]([O-])c 98 6078 http://www.s PHYSPROP
    21329 quinethazoneNS(=O)(=O)c1 251 6068 http://www.s PHYSPROP
    21330 chlorquinaldolOc1c(Cl)cc(Cl 114.5 6062 http://www.s PHYSPROP
    21331 1,1-dichloro-2ClC(Cl)C(c1cc 56 6058 http://www.s PHYSPROP
    21332 p,p'-ddd Clc1ccc(cc1)C( 109.5 6057 http://www.s PHYSPROP
    21333 alizarine O=C3c1ccccc1 289.5 6056 http://www.s PHYSPROP
    21334 methaqualon Cc1ccccc1N3C 120 6055 http://www.s PHYSPROP
    21335 dehydrocorticOCC(=O)C3CC 183.5 6053 http://www.s PHYSPROP
    21336 valine C[C@H](C)[C@ 315 6050 http://www.s PHYSPROP
    21337 1,1,1-trichlor CC(Cl)(Cl)Cl -30.41 6042 http://www.s PHYSPROP
    21338 1-pentanol CCCCCO -78.9 6040 http://www.s PHYSPROP
    21339 1-propanone, O=C(CC)c1ccc 140 6034 http://www.s PHYSPROP
    21340 4-methylbenzCc1ccc(cc1)S( 138.5 6033 http://www.s PHYSPROP
    21341 butanedioic a O=C(O)C(S)CC 149 6032 http://www.s PHYSPROP
    21342 diethyl sulfox CCS(=O)CC 14 6027 http://www.s PHYSPROP
    21343 ethanone, 2-bO=C(CBr)c1cc 50.5 6023 http://www.s PHYSPROP
    21344 benziodaroneIc1cc(cc(I)c1 167 6001 http://www.s PHYSPROP
    21345 triaziquone O=C1C=C(C(= 162.75 5999 http://www.s PHYSPROP
    21346 p-di(trichlor ClC(Cl)(Cl)c1cc 109 5997 http://www.s PHYSPROP
    21347 n,n'-dimethyl CN(C)C=O -60.4 5993 http://www.s PHYSPROP
    21348 hexachloroet ClC(Cl)(Cl)C(Cl 187 5979 http://www.s PHYSPROP
    21349 dimethyl sulf CS(C)(=O)=O 109 5978 http://www.s PHYSPROP
    21350 chloroform ClC(Cl)Cl -63.6 5977 http://www.s PHYSPROP
    21351 barbituric aci O=C1CC(=O)N 248 5976 http://www.s PHYSPROP
    21352 1h-pyrazole, 3Cc1cc(C)nn1 107.5 5975 http://www.s PHYSPROP
    21353 l-homocysteine
    OC(=O)C(N)CC 195 5970 http://www.s PHYSPROP
    21354 naphthalene-2O=Cc1ccc2ccc 62 5966 http://www.s PHYSPROP
    21355 psoralen O=C1C=Cc2cc 163.5 5964 http://www.s PHYSPROP
    21356 1-naphthalen O=Cc2cccc1cc 33.5 5960 http://www.s PHYSPROP
    21357 2,3-dinitroph O=[N+]([O-])c 144.5 5956 http://www.s PHYSPROP
    21358 hexanal CCCCCC=O -56 5949 http://www.s PHYSPROP
    21359 3,5-diiodo-l-t Ic1cc(CC(N)C( 213 5946 http://www.s PHYSPROP
    21360 l-methionine, O=C(C)NC(CCS 105.5 5945 http://www.s PHYSPROP
    21361 colchicine CC(=O)N[C@H] 146 5933 http://www.s PHYSPROP
    21362 diethyl sulfateO=S(=O)(OCC -24 5931 http://www.s PHYSPROP
    21363 mebutamate O=C(N)OCC(C) 77 5919 http://www.s PHYSPROP
    21364 phenylurea O=C(N)Nc1ccc 147 5915 http://www.s PHYSPROP
    21365 n-methyl o-(3 O=C(Oc1cc(cc 73 5913 http://www.s PHYSPROP
    21366 1-naphthyl-n CNC(=O)Oc2cc 145 5899 http://www.s PHYSPROP
    21367 alanine, 2-metCC(C)(N)C(=O 335 5891 http://www.s PHYSPROP
    21368 aniline Nc1ccccc1 -6.02 5889 http://www.s PHYSPROP
    21369 p-nitrobenzoicO=[N+]([O-])c 242 5882 http://www.s PHYSPROP
    21370 zoxazolamine Clc1cc2nc(N)o 184.5 5878 http://www.s PHYSPROP
    21371 p-toluenesulfoCc1ccc(cc1)S( 104.5 5876 http://www.s PHYSPROP
    21372 niridazole [O-][N+](=O) 261 5868 http://www.s PHYSPROP
    21373 n,n-dimethylt CN(C)CCc2cnc 46 5864 http://www.s PHYSPROP
    21374 n-methyltryp CNCCc2cnc1cc 88 5863 http://www.s PHYSPROP
    21375 methoxamineCOc1ccc(cc1C
    h 214 5857 http://www.s PHYSPROP x salt - AL
    21376 methyl hydrazCNN -52.4 5837 http://www.s PHYSPROP
    21377 2-aminoethane
    NCCS 98 5834 http://www.s PHYSPROP
    21378 2-phenylethanOCCc1ccccc1 -27 5830 http://www.s PHYSPROP
    21379 4-(n,n-dimet CN(C)c2ccc(/N 117 5829 http://www.s PHYSPROP
    21380 p-phenylazoanNc2ccc(/N=N/ 127 5828 http://www.s PHYSPROP
    21381 n-nitrosomorpO=NN1CCOCC 29 5823 http://www.s PHYSPROP
    21382 o-phenylene O=C1Nc2cccc 138 5820 http://www.s PHYSPROP
    21383 2-(1h)-quinol O=C1C=Cc2cc 199.5 5816 http://www.s PHYSPROP
    21384 ethopabate CCOc1cc(ccc1 148.5 5812 http://www.s PHYSPROP
    21385 2,3,4,6-tetra Clc1cc(Cl)c(Cl 70 5806 http://www.s PHYSPROP
    21386 benzene, 1,1',C(/c1ccccc1)= 72.5 5803 http://www.s PHYSPROP
    21387 tetrabenazineCC(C)CC2CN3C 128 5796 http://www.s PHYSPROP
    21388 testosterone O=C3CCC4(C) 155 5790 http://www.s PHYSPROP
    21389 aminopyrine CN(C)C=2C(=O 134.5 5787 http://www.s PHYSPROP
    21390 phencarbamidCCN(CC)CCSC( 48.5 5786 http://www.s PHYSPROP
    21391 7,12-dime-benCc2c1c4ccccc4 122.5 5779 http://www.s PHYSPROP
    21392 progesterone CC(=O)[C@H] 126 5773 http://www.s PHYSPROP
    21393 chlordane ClC2=C(Cl)C3(C 106 5772 http://www.s PHYSPROP
    21394 1,1-dimethylhCN(C)N -58 5756 http://www.s PHYSPROP
    21395 strychnine O=C2CC4OCC= 287 5759 http://www.s PHYSPROP
    21396 4-nitroquinoli[O-][N+](=O)c 154 5740 http://www.s PHYSPROP
    21397 benz(a)anthrac1c4ccccc4cc3 84 5739 http://www.s PHYSPROP x All other sources support 156-162 - EC
    21398 carbon tetrachClC(Cl)(Cl)Cl -23 5730 http://www.s PHYSPROP
    21399 1,3-propanediNCCCNCCCN -14 5729 http://www.s PHYSPROP
    21400 biguanide N=C(N)NC(=N 136 5726 http://www.s PHYSPROP
    21401 isoflurophate FP(=O)(OC(C) -82 5723 http://www.s PHYSPROP
    21402 4-dimethylamCN(C)c2ccc(/N 138.5 5721 http://www.s PHYSPROP
    21403 metoquinone CNc1ccc(O)cc 135 5718 http://www.s PHYSPROP
    21404 metol CNc1ccc(O)cc 87 5718 http://www.s PHYSPROP
    21405 isonicotinic acO=C(O)c1ccnc 315 5709 http://www.s PHYSPROP
    21406 3,4-diaminopyNc1ccncc1N 220 5705 http://www.s PHYSPROP
    21407 3,4-diaminopyNc1ccncc1N 120.8 5705 http://www.s PHYSPROP x clearly out of range JCB
    21408 pentylenetetrC1CCCc2nnnn 59.5 5704 http://www.s PHYSPROP
    21409 2-methyl-4-d CN(C)c2ccc(/N 68 5703 http://www.s PHYSPROP
    21410 trifluoromethyO=C1NC(=O)NC 316 5688 http://www.s PHYSPROP
    21411 n-2-fluorenyl CC(=O)Nc1ccc 193 5686 http://www.s PHYSPROP
    21412 dibenz(a,h)anc1c4c5ccccc5c 269.5 5678 http://www.s PHYSPROP
    21413 famphur O=S(=O)(N(C)C 53 5650 http://www.s PHYSPROP
    21414 trichlorfon OC(C(Cl)(Cl)C 77 5644 http://www.s PHYSPROP
    21415 apholate C1CN1p2(np(n 147.5 5637 http://www.s PHYSPROP
    21416 allobarbital O=C1NC(=O)N 172 5635 http://www.s PHYSPROP
    21417 cyclobarbital O=C1NC(=O)N 173 5632 http://www.s PHYSPROP
    21418 p-methoxyacetCOc1ccc(NC(C 131 5622 http://www.s PHYSPROP
    21419 3,5-dichlorobeClc1cc(cc(Cl) 188 5606 http://www.s PHYSPROP
    21420 thyropropic acO=C(O)CCc2cc(I 200 5599 http://www.s PHYSPROP
    21421 tiratricol O=C(O)Cc2cc(I) 181.5 5598 http://www.s PHYSPROP
    21422 5-bromouracilBrC1=CNC(=O 310 5597 http://www.s PHYSPROP
    21423 o-aminophenoNc1ccccc1O 174 5596 http://www.s PHYSPROP
    21424 benzimidazolec1cccc2ncnc1 170.5 5593 http://www.s PHYSPROP
    21425 4-methylsalicyOC(=O)c1ccc( 177 5584 http://www.s PHYSPROP
    21426 2,4-dichlorobeOC(=O)c1ccc(C 164.2 5583 http://www.s PHYSPROP
    21427 2,4,5-trichlor Clc1cc(C(=O)O 166.5 5582 http://www.s PHYSPROP
    21428 benzoic acid, Clc1c(cc(Cl)c( 194.5 5578 http://www.s PHYSPROP
    21429 hexobendine COc1c(cc(cc1 76 5573 http://www.s PHYSPROP
    21430 phentolamineCc1ccc(cc1)N 175 5571 http://www.s PHYSPROP
    21431 reserpine COc1cc(cc(O 264.5 5566 http://www.s PHYSPROP
    21432 benzoic acid, Clc1c(cccc1Cl 169 5562 http://www.s PHYSPROP
    21433 2,4,6-trichlor OC(=O)c1c(Cl) 162 5561 http://www.s PHYSPROP
    21434 2,3,6-trichlor Clc1c(C(=O)O) 124.5 5556 http://www.s PHYSPROP
    21435 2,6-dichlorobeOC(=O)c1c(Cl) 144 5555 http://www.s PHYSPROP
    21436 hydroxyphen OC(COC(N)=O) 55 5549 http://www.s PHYSPROP
    21437 zopiclone CN1CCN(CC1)C 178 5533 http://www.s PHYSPROP
    21438 zonisamide NS(=O)(=O)Cc 161.5 5532 http://www.s PHYSPROP
    21439 zomepirac Cc2cc(CC(=O)O 178.5 5531 http://www.s PHYSPROP
    21440 zolpidem CN(C)C(=O)Cc1 196 5530 http://www.s PHYSPROP
    21441 cytidine, 2',3' NC1=NC(=O)N 217.5 5516 http://www.s PHYSPROP
    21442 xylometazolinCC(C)(C)c2cc( 132 5507 http://www.s PHYSPROP
    21443 xylazine Cc2cccc(C)c2 140 5505 http://www.s PHYSPROP
    21444 2-quinolinecarO=C(O)c1cc(O 289 5497 http://www.s PHYSPROP
    21445 vincamine O=C(OC)C5(O) 231.5 5466 http://www.s PHYSPROP
    21446 valinomycin CC(C)C1NC(=O 190 5447 http://www.s PHYSPROP
    21447 usnic acid CC(=O)c2c1OC 204 5444 http://www.s PHYSPROP
    21448 ursodeoxycholO=C(O)CCC(C) 203 5443 http://www.s PHYSPROP
    21449 hyodeoxycholiO=C(O)CCC(C) 198.5 4446908 http://www.s PHYSPROP
    21450 chenodeoxycho
    O=C(O)CCC(C) 119 9728 http://www.s PHYSPROP
    21451 o-ethyl carba NC(=O)OCC 49 5439 http://www.s PHYSPROP
    21452 2,4(1h,3h)-py COc3ccccc3N 157 5437 http://www.s PHYSPROP
    21453 4-(2-aminoethOc1ccc(CCN)c 164.5 5408 http://www.s PHYSPROP
    21454 thenoyltriflu O=C(CC(=O)C(F 42 5399 http://www.s PHYSPROP
    21455 tropicamide OCC(c1ccccc1 96.5 5391 http://www.s PHYSPROP
    21456 octoxynol 9 [uCC(C)(C)CC(C) -4 5388 http://www.s PHYSPROP
    21457 trimipramine CN(C)CC(C)CN 45 5382 http://www.s PHYSPROP
    21458 24nh2-5me-6(COc1cc(cc(OC 216 5381 http://www.s PHYSPROP
    21459 trimethoprim Nc2nc(N)ncc2 201 5376 http://www.s PHYSPROP
    21460 trimethobenzaCOc1c(cc(cc1 188.7 5375 http://www.s PHYSPROP
    21461 trimethadioneCN1C(=O)OC(C 46 5374 http://www.s PHYSPROP
    21462 trimeprazine CN(C)CC(C)CN 68 5373 http://www.s PHYSPROP
    21463 trimebutine COc1c(cc(cc1 79 5372 http://www.s PHYSPROP
    21464 trihexyphenidOC(CCN1CCCCC 258.5 5371 http://www.s PHYSPROP x salt JCB
    21465 trihexylpheneOC(CCN1CCCCC 114 5371 http://www.s PHYSPROP
    21466 trifluralin [O-][N+](=O)c 49 5368 http://www.s PHYSPROP
    21467 trifluperidol FC(F)(F)c1ccc 212 5366 http://www.s PHYSPROP x salt - AL
    21468 5-chloro-2-(2 Clc2cc(Cl)ccc 55.65 5363 http://www.s PHYSPROP
    21469 2,2',2''-trich ClCCN(CCCl)CC 128.5 5360 http://www.s PHYSPROP x salt JCB
    21470 tris(beta-chlo ClCCN(CCCl)CC -4 5360 http://www.s PHYSPROP
    21471 2,4,7-triaminoNc2nc(N)nc1nc 316 5345 http://www.s PHYSPROP
    21472 triamcinoloneOCC(=O)C3(O) 270 5343 http://www.s PHYSPROP
    21473 triallate Cl/C(Cl)=C(Cl 29 5342 http://www.s PHYSPROP
    21474 trepibutone CCOc1cc(OCC) 150.5 5335 http://www.s PHYSPROP
    21475 tremorine dihC(C#CCN1CCC 237 5333 http://www.s PHYSPROP x salt - AL
    21476 trazodone Clc1cccc(c1 87 5332 http://www.s PHYSPROP
    21477 tramazoline C2CCCc3cccc 142.5 5323 http://www.s PHYSPROP
    21478 1-propanone, CC(CN1CCCCC1 176.5 5310 http://www.s PHYSPROP
    21479 tolnaftate Cc1cc(ccc1)N( 111 5309 http://www.s PHYSPROP
    21480 tolciclate Cc1cc(ccc1)N 93 5305 http://www.s PHYSPROP
    21481 tolbutamide Cc1ccc(cc1)S 128.5 5304 http://www.s PHYSPROP
    21482 1h-imidazole, c2cc(CC1=NCC 174 5303 http://www.s PHYSPROP
    21483 tolazamide Cc1ccc(cc1)S 171.5 5302 http://www.s PHYSPROP
    21484 tofisopam COc1ccc(cc1O 156.5 5301 http://www.s PHYSPROP
    21485 nikethamide O=C(N(CC)CC) 25 5296 http://www.s PHYSPROP
    21486 tirofiban O=C(O)C(NS(= 224 5286 http://www.s PHYSPROP
    21487 tiopronin OC(=O)CNC(=O 96 5283 http://www.s PHYSPROP
    21488 tinoridine O=C(OCC)c1c2 112.5 5280 http://www.s PHYSPROP
    21489 tinidazole O=S(=O)(CCn1c 127.5 5279 http://www.s PHYSPROP
    21490 timolol OC(COc1nsnc 202 5278 http://www.s PHYSPROP
    21491 tibolone O=C2CC=3CC(C 167 5271 http://www.s PHYSPROP
    21492 tiaramide OCCN1CCN(CC1 160 5270 http://www.s PHYSPROP
    21493 tiaprofenic ac O=C(c1ccc(s1) 96 5269 http://www.s PHYSPROP
    21494 benzamide,n(O=S(C)(=O)c1 124 5268 http://www.s PHYSPROP
    21495 thiram CN(C)C(=S)SSC 155.6 5256 http://www.s PHYSPROP
    21496 thiotepa S=P(N1CC1)( 51.5 5254 http://www.s PHYSPROP
    21497 thioridazine CN4CCCCC4CCN 73 5253 http://www.s PHYSPROP
    21498 ethylthiopera CN1CCN(CC1)C 63 5245 http://www.s PHYSPROP
    21499 2,4-thiazolidi O=C1NC(=O)C 128 5242 http://www.s PHYSPROP
    21500 thiamphenicolO=S(C)(=O)c1c 165.3 5240 http://www.s PHYSPROP
    21501 p-methylsulfoO=S(C)(=O)c1c 165 5240 http://www.s PHYSPROP
    21502 thiabendazolen1c3ccccc3nc 304.5 5237 http://www.s PHYSPROP
    21503 theobromine Cn1cnc2c1C(= 357 5236 http://www.s PHYSPROP
    21504 thalidomide O=C1NC(=O)C 270 5233 http://www.s PHYSPROP
    21505 tetrandrine COc3c(OC)cc5 217.5 5229 http://www.s PHYSPROP
    21506 testosterone CCC(=O)OC2C 120 5217 http://www.s PHYSPROP
    21507 testosterone CCCCCCC(=O) 37 5216 http://www.s PHYSPROP
    21508 testosterone O=C2CCC3(C) 155 5215 http://www.s PHYSPROP
    21509 testolactone O=C3C=C4CCC1 218.5 5214 http://www.s PHYSPROP
    21510 terfenadine CC(C)(C)c1ccc 147 5212 http://www.s PHYSPROP
    21511 terazosin O=C(N1CCN(CC 273 5208 http://www.s PHYSPROP
    21512 teniposide COc1cc(cc(OC 244 5203 http://www.s PHYSPROP
    21513 2,2,6,6-tetramCC1(C)CC(O)C 70 5202 http://www.s PHYSPROP
    21514 temephos COP(=S)(OC)Oc 30.25 5199 http://www.s PHYSPROP
    21515 temazepam Clc1ccc2c(c1) 120 5198 http://www.s PHYSPROP
    21516 tegafur FC1=CN(C(=O 172 5193 http://www.s PHYSPROP
    21517 tebuthiuron CC(C)(C)c1nnc 162.85 5190 http://www.s PHYSPROP
    21518 syrosingopineO=C(OCC)Oc1c 177 5174 http://www.s PHYSPROP
    21519 suprofen O=C(c1ccc(cc1 124.3 5166 http://www.s PHYSPROP
    21520 sumatriptan CNS(=O)(=O)C 170 5165 http://www.s PHYSPROP
    21521 sultopride CCN2CCCC2CNC 181.5 5164 http://www.s PHYSPROP
    21522 sulthiame O=S2(=O)CCCC 181 5163 http://www.s PHYSPROP
    21523 suloctidil CC(C)Sc1ccc( 62.5 5161 http://www.s PHYSPROP
    21524 1h-imidazo[4,CS(=O)c3ccc(c 204 5160 http://www.s PHYSPROP
    21525 sulfisoxazole Cc2c(NS(=O)(= 191 5151 http://www.s PHYSPROP
    21526 sulfisomidine Cc2cc(NS(=O)( 243 5150 http://www.s PHYSPROP
    21527 sulfoxyphenyl O=C4C(CCS(=O 136.5 5149 http://www.s PHYSPROP
    21528 sulfathiazole O=S(=O)(Nc1nc 202 5148 http://www.s PHYSPROP
    21529 sulfaquinoxaliNc1ccc(cc1)S 247.5 5147 http://www.s PHYSPROP
    21530 sulfapyridine O=S(=O)(Nc1cc 192 5145 http://www.s PHYSPROP
    21531 sulfaphenazolNc1ccc(cc1)S 181 5144 http://www.s PHYSPROP
    21532 sulfanitran O=S(=O)(Nc1cc 240 5143 http://www.s PHYSPROP
    21533 sulfanilamide Nc1ccc(cc1)S( 165.5 5142 http://www.s PHYSPROP
    21534 sulfamethoxypO=S(=O)(Nc1c 182.5 5139 http://www.s PHYSPROP
    21535 sulfamethoxazCc2cc(NS(=O)( 167 5138 http://www.s PHYSPROP
    21536 sulfamethiazoCc2nnc(NS(=O) 208 5137 http://www.s PHYSPROP
    21537 sulfamethazinO=S(=O)(Nc1nc 198.5 5136 http://www.s PHYSPROP
    21538 sulfameter O=S(=O)(Nc1n 215 5135 http://www.s PHYSPROP
    21539 sulfamerazineO=S(=O)(Nc1nc 236 5134 http://www.s PHYSPROP
    21540 sulfanilyl gua Nc1ccc(cc1)S 191.5 5133 http://www.s PHYSPROP
    21541 sulfadimethoxCOc2nc(NS(=O 203.5 5132 http://www.s PHYSPROP
    21542 sulfacytine O=C1N=C(C=CN 167.25 5131 http://www.s PHYSPROP
    21543 sulfanilaceta Nc1ccc(cc1)S 183 5129 http://www.s PHYSPROP
    21544 benzamide, n-Nc1ccc(cc1)S( 181.5 5128 http://www.s PHYSPROP
    21545 succinylsulfat O=S(=O)(Nc1n 193.5 5124 http://www.s PHYSPROP
    21546 streptozocin OC(C(C=O)NC( 115 5108 http://www.s PHYSPROP
    21547 stearic acid O=C(O)CCCCC 69.3 5091 http://www.s PHYSPROP
    21548 thymidine, 3' CC1=CN(C(=O 155.5 5090 http://www.s PHYSPROP
    21549 spironolactonCC(=O)SC4CC1 207.5 5077 http://www.s PHYSPROP
    21550 spiroperidol Fc1ccc(cc1)C 191.8 5075 http://www.s PHYSPROP
    21551 sotalol O=S(C)(=O)Nc 206.75 5063 http://www.s PHYSPROP
    21552 solassodine CC6C2C(CC3C 202 5060 http://www.s PHYSPROP
    21553 ipodate O=C(O)CCc1c(I 168.5 5051 http://www.s PHYSPROP
    21554 acetic acid, io ICC(=O)O 82.5 5050 http://www.s PHYSPROP
    21555 simfibrate Clc2ccc(OC(C) 52 5028 http://www.s PHYSPROP
    21556 simazine Clc1nc(NCC)n 226 5027 http://www.s PHYSPROP
    21557 sesamin C3OC(c1ccc2O 124 5015 http://www.s PHYSPROP
    21558 5-hydroxytry Oc1cc2c(cc1) 167.5 5013 http://www.s PHYSPROP
    21559 carbamylhydrNC(=O)NN 96 5008 http://www.s PHYSPROP
    21560 secobarbital O=C1NC(=O)NC 100 5005 http://www.s PHYSPROP
    21561 decanedioic aO=C(O)CCCCC 130.8 5004 http://www.s PHYSPROP
    21562 scopolamine, OCC(c1ccccc1 200 10194106 http://www.s PHYSPROP x salt JCB
    21563 scopolamine OCC(c1ccccc1 59 10194106 http://www.s PHYSPROP
    21564 2-carboxyphenO=C(Oc1ccccc 147 4977 http://www.s PHYSPROP
    21565 salmeterol OCc1cc(ccc1O 75.75 4968 http://www.s PHYSPROP
    21566 o-hydroxybenO=C(N)c1cccc 142 4963 http://www.s PHYSPROP
    21567 o-hydroxybenzOCc1ccccc1O 87 4962 http://www.s PHYSPROP
    21568 risperidone CC=5N=C1CCCC 170 4895 http://www.s PHYSPROP
    21569 resorcinol Oc1cccc(O)c1 111 4878 http://www.s PHYSPROP
    21570 ribostamycin NC3C(O)C(O) 193.5 4890 http://www.s PHYSPROP
    21571 resmethrin O=C(OCc2cc(C 56.5 4877 http://www.s PHYSPROP
    21572 bioresmethrinO=C(OCc2cc(C 32 4877 http://www.s PHYSPROP
    21573 ramipril O=C(OCC)C(CC 109 4862 http://www.s PHYSPROP
    21574 ramifenazoneCC(C)NC=2C(= 80 4861 http://www.s PHYSPROP
    21575 raloxifene Oc1ccc(cc1)c 145 4859 http://www.s PHYSPROP
    21576 pseudoephedriOC(C(C)NC)c1 119 4856 http://www.s PHYSPROP
    21577 d-pseudoepheOC(C(C)NC)c1 118.5 4856 http://www.s PHYSPROP
    21578 benzenemethan
    OC(C(C)NC)c1 76.5 4856 http://www.s PHYSPROP
    21579 benzenemethan
    OC(C(C)NC)c1 40 4856 http://www.s PHYSPROP
    21580 (1r,2s)-(-)-ep OC(C(C)NC)c1 34 4856 http://www.s PHYSPROP
    21581 rabeprazole Cc3c(OCCCOC) 99.5 4853 http://www.s PHYSPROP
    21582 apocodeine COc3ccc2CC1c 123.5 4846 http://www.s PHYSPROP
    21583 2h-1,4-benzodiFc3ccccc3C2=N 138.25 4825 http://www.s PHYSPROP
    21584 quassin O=C1C2C4(C)C 222 4824 http://www.s PHYSPROP
    21585 2,4(1h,3h)-pyrCCC1(CC)C(= 90.7 4820 http://www.s PHYSPROP
    21586 pyrimethaminCCc1nc(N)nc(N 233.5 4819 http://www.s PHYSPROP
    21587 pyridinol car CNC(=O)OCc1c 136.5 4816 http://www.s PHYSPROP
    21588 puromycin COc1ccc(cc1) 176.25 4811 http://www.s PHYSPROP
    21589 psilocin CN(C)CCc2cnc 174.5 4807 http://www.s PHYSPROP
    21590 proxyphylline CC(O)Cn2cnc1 135.5 4806 http://www.s PHYSPROP
    21591 protopine O=C1Cc4ccc5 208 4799 http://www.s PHYSPROP
    21592 proscillaridin O=C1C=CC(=C 221 4781 http://www.s PHYSPROP
    21593 propyliodone O=C(OCCC)CN1 186 4780 http://www.s PHYSPROP
    21594 propyl gallate Oc1cc(cc(O)c 130 4778 http://www.s PHYSPROP
    21595 propoxur CC(C)Oc1cccc 90 4775 http://www.s PHYSPROP
    21596 phenol, 2,6-biCC(C)c1cccc(C 18 4774 http://www.s PHYSPROP
    21597 propentofylli CC(=O)CCCCN2 69 4769 http://www.s PHYSPROP
    21598 propazine Clc1nc(NC(C)C 213 4768 http://www.s PHYSPROP
    21599 propanil Clc1ccc(NC(=O 92 4764 http://www.s PHYSPROP
    21600 propachlor CC(C)N(C(=O)C 77 4762 http://www.s PHYSPROP
    21601 pronethalol h CC(C)NCC(O)c 184 4761 http://www.s PHYSPROP x salt JCB
    21602 pronethalol CC(C)NCC(O)c 108 4761 http://www.s PHYSPROP
    21603 prometryne CSc1nc(NC(C)C 119 4760 http://www.s PHYSPROP
    21604 prometon COc1nc(NC(C) 91.5 4759 http://www.s PHYSPROP
    21605 promethazineCN(C)C(C)CN1 60 4758 http://www.s PHYSPROP
    21606 imidodicarbonClc1ccc(NC(= 129 4754 http://www.s PHYSPROP
    21607 proglumide O=C(NC(CCC(= 143.5 4753 http://www.s PHYSPROP
    21608 procyclidine OC(CCN1CCCC1 86 4750 http://www.s PHYSPROP
    21609 prochlorperazCN1CCN(CC1)C 228 4748 http://www.s PHYSPROP
    21610 prochloroperaCN1CCN(CC1)C 228 4748 http://www.s PHYSPROP
    21611 procaine Nc1ccc(cc1)C 61 4745 http://www.s PHYSPROP
    21612 probucol CC(C)(C)c2cc(S 125 4743 http://www.s PHYSPROP
    21613 probenecid O=S(=O)(N(CC 195 4742 http://www.s PHYSPROP
    21614 primidone CCC1(C(=O)NC 281.5 4740 http://www.s PHYSPROP
    21615 prilocaine O=C(Nc1ccccc 37.5 4737 http://www.s PHYSPROP
    21616 pridinol OC(CCN1CCCCC 120.5 4735 http://www.s PHYSPROP
    21617 pregnanediol CC(O)C1CCC2 245 4732 http://www.s PHYSPROP
    21618 pregnanediol CC(O)C1CCC2 243.5 4732 http://www.s PHYSPROP
    21619 allopregnane-CC(O)C1CCC2 218.5 4732 http://www.s PHYSPROP
    21620 prazosin O=C(N1CCN(CC 279 4724 http://www.s PHYSPROP
    21621 praziquantel O=C2CN(CC1c 136 4722 http://www.s PHYSPROP
    21622 prazepam Clc1ccc3c(c1 145.5 4721 http://www.s PHYSPROP
    21623 practolol CC(C)NCC(O)C 135 4715 http://www.s PHYSPROP
    21624 polythiazide NS(=O)(=O)c2c 214 4704 http://www.s PHYSPROP
    21625 picropodophylCOc1cc(cc(OC 228 4699 http://www.s PHYSPROP
    21626 amdinocillin pCC(C)(C)C(=O 119 4691 http://www.s PHYSPROP
    21627 piromidic acidO=C(O)C2=CN( 315 4689 http://www.s PHYSPROP
    21628 piribedil c1cc(cc2OCOc 98 4684 http://www.s PHYSPROP
    21629 piracetam O=C1CCCN1CC 152 4677 http://www.s PHYSPROP
    21630 pipemidic aci O=C(O)C2=CN 254 4665 http://www.s PHYSPROP
    21631 pindolol CC(C)NCC(O)C 171 4662 http://www.s PHYSPROP
    21632 pimpinellin COc2c1occc1 119 4659 http://www.s PHYSPROP
    21633 pilocarpol Cn2cncc2CC1 34 4653 http://www.s PHYSPROP
    21634 picotamide O=C(NCc1cccn 124 4649 http://www.s PHYSPROP
    21635 o-phthalaldehO=Cc1ccccc1 56.5 4642 http://www.s PHYSPROP
    21636 phthalylsulfatO=S(=O)(/N=C 273 4641 http://www.s PHYSPROP
    21637 phosalone CCOP(=S)(OCC 47.75 4629 http://www.s PHYSPROP
    21638 phloridzin Oc1ccc(cc1)C 110 4625 http://www.s PHYSPROP
    21639 benzenemethano
    OC(C(C)N)c1cc 77.75 4622 http://www.s PHYSPROP
    21640 phenylmethylsO=S(F)(=O)Cc1 93 4620 http://www.s PHYSPROP
    21641 phenylpropanOC(C(C)N)c1cc 101.25 4622 http://www.s PHYSPROP
    21642 phenylephrin OC(CNC)c1cc( 170.5 4618 http://www.s PHYSPROP
    21643 phenylbutazo O=C3C(CCCC)C 105 4617 http://www.s PHYSPROP
    21644 phenyl biguanN=C(N)NC(=N) 143 4616 http://www.s PHYSPROP
    21645 4-phenylbutyriO=C(O)CCCc1c 52 4611 http://www.s PHYSPROP
    21646 carbamic acid,NC(=O)OCCCc1 102 4606 http://www.s PHYSPROP
    21647 phenoxybenz CC(COc1ccccc 39 4604 http://www.s PHYSPROP
    21648 phenolphthaleOc1ccc(cc1)C3 262.5 4600 http://www.s PHYSPROP
    21649 phenobarbitalO=C1NC(=O)NC 174 4599 http://www.s PHYSPROP
    21650 2-phenyl-1h-i O=C2c1ccccc1 150 4596 http://www.s PHYSPROP
    21651 phenazine n1c3ccccc3nc 176.5 4593 http://www.s PHYSPROP
    21652 phenazopyridNc2nc(N)ccc2 139 4592 http://www.s PHYSPROP
    21653 p-phenacetin CCOc1ccc(cc1 137.5 4590 http://www.s PHYSPROP
    21654 phenacemide O=C(Cc1ccccc 215 4589 http://www.s PHYSPROP
    21655 peruvoside O=C1C=C(CO1 162.5 4587 http://www.s PHYSPROP
    21656 perphenazineOCCN1CCN(CC1 97 4586 http://www.s PHYSPROP
    21657 pericyazine OC1CCN(CC1)C 116.5 4585 http://www.s PHYSPROP
    21658 pergolide CSCC4CC1C(Cc 207.5 4583 http://www.s PHYSPROP
    21659 perazine CN1CCN(CC1)C 52 4582 http://www.s PHYSPROP
    21660 pentostatin OC3CNC=Nc2c 220 4577 http://www.s PHYSPROP
    21661 pentobarbital O=C1NC(=O)NC 130 4575 http://www.s PHYSPROP
    21662 pentazocine C/C(C)=CCN2C 146.3 4574 http://www.s PHYSPROP
    21663 pencillamine O=C(O)C(N)C(C 198.5 4565 http://www.s PHYSPROP
    21664 penbutolol CC(C)(C)NC[ 70 4562 http://www.s PHYSPROP
    21665 patulin O=C2C=C1C(= 111 4534 http://www.s PHYSPROP
    21666 methazole Clc1ccc(cc1C 123 4528 http://www.s PHYSPROP
    21667 papaverine COc1ccc(cc1O 147.5 4518 http://www.s PHYSPROP
    21668 palmidrol O=C(CCCCCCC 98.5 4509 http://www.s PHYSPROP
    21669 paclitaxel O=C(NC(c1ccc 216.5 4504 http://www.s PHYSPROP
    21670 p-nitrophenylaO=[N+]([O-])c 154 4500 http://www.s PHYSPROP
    21671 phenol, 4-[2- Oc1ccc(CC(C) 161 4494 http://www.s PHYSPROP
    21672 2,5-cyclohexaO=C1C=CC(=O 115.7 4489 http://www.s PHYSPROP
    21673 oxyphenbutazOc1ccc(cc1)N 96 4480 http://www.s PHYSPROP
    21674 oxymorphoneO=C1CCC5(O)C 248.5 4478 http://www.s PHYSPROP
    21675 oxymetazolin CC(C)(C)c2cc 182 4475 http://www.s PHYSPROP
    21676 oxycodone O=C1CCC5(O)C 219 4474 http://www.s PHYSPROP
    21677 oxibendazole O=C(OC)Nc1nc 230 4461 http://www.s PHYSPROP
    21678 oxybenzone O=C(c1ccc(cc 65.5 4471 http://www.s PHYSPROP
    21679 oxethazaine CC(C)(Cc1cccc 104 4460 http://www.s PHYSPROP
    21680 oxazepam Clc1ccc2NC(= 205.5 4455 http://www.s PHYSPROP
    21681 oxatomide O=C5Nc1ccccc 153.6 4454 http://www.s PHYSPROP
    21682 oxaprozin OC(=O)CCc1nc( 160.75 4453 http://www.s PHYSPROP
    21683 6-quinolineme[O-][N+](=O) 148 4451 http://www.s PHYSPROP
    21684 ouabain O=C1C=C(CO1) 200 4444 http://www.s PHYSPROP
    21685 ouabain octahO=C1C=C(CO1) 130 4444 http://www.s PHYSPROP
    21686 osalmid O=C(Nc1ccc(O 179 4441 http://www.s PHYSPROP
    21687 omeprazole Cc3c(OC)c(C) 156 4433 http://www.s PHYSPROP
    21688 ochratoxin a O=C(O)C(Cc1c 169 4419 http://www.s PHYSPROP
    21689 nylidrin OC(c1ccc(O)cc 111.5 4407 http://www.s PHYSPROP
    21690 narcotine COc3c5OCOc5c 176 4385 http://www.s PHYSPROP
    21691 noscapine COc3c5OCOc5c 176 4385 http://www.s PHYSPROP
    21692 d-norgestrel O=C2CCC3C4C 240 4383 http://www.s PHYSPROP
    21693 norgestrel O=C2CCC3C4C 206 4383 http://www.s PHYSPROP
    21694 norfloxacin O=C(O)C2=CN( 227.5 4380 http://www.s PHYSPROP
    21695 norethynodrelO=C2CCC=3C4 169.5 4378 http://www.s PHYSPROP
    21696 norethindron O=C2CCC3C4C 203.5 4377 http://www.s PHYSPROP
    21697 1,2-benzenedio
    Oc2ccc(CC(C)C 185.5 4375 http://www.s PHYSPROP
    21698 nomifensine Nc3cccc1c3CN 180 4371 http://www.s PHYSPROP
    21699 3,5-dinitrobe O=[N+]([O-])c 184 4355 http://www.s PHYSPROP
    21700 1,2,3-propanetO=[N+]([O-])O 13.5 4354 http://www.s PHYSPROP
    21701 nitrazepam [O-][N+](=O) 225 4350 http://www.s PHYSPROP
    21702 nimetazepam[O-][N+](=O)c 157 4340 http://www.s PHYSPROP
    21703 methanesulfon
    [O-][N+](=O)c 143.75 4339 http://www.s PHYSPROP
    21704 nifenazone O=C3C(NC(=O) 253 4332 http://www.s PHYSPROP
    21705 nifedipine CC=1NC(C)=C( 173 4330 http://www.s PHYSPROP
    21706 niclosamide Clc2cc(ccc2NC 230 4322 http://www.s PHYSPROP
    21707 niceritrol O=C(OCC(COC( 162 4321 http://www.s PHYSPROP
    21708 3,5-pyridinediCC=2NC(C)=C( 137 4319 http://www.s PHYSPROP
    21709 nialamide O=C(NNCCC(=O 151 4317 http://www.s PHYSPROP
    21710 neriifolin O=C1C=C(CO1 221 4302 http://www.s PHYSPROP
    21711 nefazodone Clc1cccc(c1) 83.5 4294 http://www.s PHYSPROP
    21712 nandrolone phO=C3CCC4C5CC 95.5 4282 http://www.s PHYSPROP
    21713 nalorphine Oc1ccc2CC5N 208.5 4270 http://www.s PHYSPROP
    21714 nalidixic acid O=C(O)C2=CN( 229.5 4268 http://www.s PHYSPROP
    21715 naled COP(=O)(OC)OC 27 4267 http://www.s PHYSPROP
    21716 nadolol CC(C)(C)NCC( 130 4258 http://www.s PHYSPROP
    21717 n-phenyl o-amO=C(O)c2cccc 183.5 4233 http://www.s PHYSPROP
    21718 deoxyepinephOc1ccc(CCNC) 188.5 4229 http://www.s PHYSPROP
    21719 n-methylepheOC(C(C)N(C)C) 87.5 4221 http://www.s PHYSPROP
    21720 acetamide, n CC(=O)NBr 103.5 4200 http://www.s PHYSPROP
    21721 1h-pyrrole-2,5O=C1C=CC(=O 45.5 4209 http://www.s PHYSPROP
    21722 deet [n,n,-di Cc1cccc(c1)C( -45 4133 http://www.s PHYSPROP
    21723 moxisylyte CC(=O)Oc1cc( 144.5 4110 http://www.s PHYSPROP
    21724 morphinan-3,6Oc1ccc2CC5N 254 4103 http://www.s PHYSPROP
    21725 o,p'-ddd Clc2ccccc2C(C( 77 4066 http://www.s PHYSPROP
    21726 minaprine Cc2cc(nnc2NC 122 4054 http://www.s PHYSPROP
    21727 midodrine COc1ccc(cc1C 150 4050 http://www.s PHYSPROP
    21728 midazolam Fc4ccccc4C2=N 159 4047 http://www.s PHYSPROP
    21729 2-propanamine
    CC(N)COc1c(C 204 4034 http://www.s PHYSPROP
    21730 metyrapone CC(C)(c1cccnc 50.5 4030 http://www.s PHYSPROP
    21731 metolazone NS(=O)(=O)c1 256 4026 http://www.s PHYSPROP
    21732 s-metolachlorClCC(=O)N(C(C -40 4025 http://www.s PHYSPROP
    21733 metolachlor ClCC(=O)N(C(C -62.1 4025 http://www.s PHYSPROP
    21734 metoclopramiNc1cc(OC)c(c 147.25 4024 http://www.s PHYSPROP
    21735 meticrane NS(=O)(=O)c2 236.5 4021 http://www.s PHYSPROP
    21736 metiazinic aci O=C(O)Cc1cc2 144 4020 http://www.s PHYSPROP
    21737 methysergideCCC(CO)NC(=O 195 4019 http://www.s PHYSPROP
    21738 17-a-methyl t O=C2CCC3(C)C 163 4017 http://www.s PHYSPROP
    21739 methylpredni OCC(=O)C4(O) 232.5 4016 http://www.s PHYSPROP
    21740 methyl methan
    CS(=O)(=O)OC 20 4013 http://www.s PHYSPROP
    21741 methylergonoCCC(CO)NC(=O 172 3997 http://www.s PHYSPROP
    21742 parathion metS=P(Oc1ccc(cc 35.5 3987 http://www.s PHYSPROP
    21743 2-methyl-3-chNS(=O)(=O)c2c 225 3978 http://www.s PHYSPROP
    21744 methoxyflura ClC(Cl)C(F)(F) -35 3973 http://www.s PHYSPROP
    21745 methoxychlorCOc1ccc(cc1)C 87 3972 http://www.s PHYSPROP
    21746 methoxsalen COc1c3occc3c 148 3971 http://www.s PHYSPROP
    21747 1,2-propanediNC(=O)OCC(O 93 3964 http://www.s PHYSPROP
    21748 methazolamidCN1N=C(SC1=N 213.5 3958 http://www.s PHYSPROP
    21749 metharbital O=C1NC(=O)N( 150.5 3957 http://www.s PHYSPROP
    21750 methamidophNP(=O)(OC)SC 46 3954 http://www.s PHYSPROP
    21751 methadone O=C(C(c1cccc 99.5 559067 http://www.s PHYSPROP
    21752 methacrylic acC=C(C)C(=O)O 16 3951 http://www.s PHYSPROP
    21753 metformin hydN=C(N)NC(=N) 224.5 3949 http://www.s PHYSPROP
    21754 metaraminol OC(c1cc(O)ccc 107.5 3945 http://www.s PHYSPROP
    21755 metaproterenOc1cc(cc(O)c1 100 3944 http://www.s PHYSPROP
    21756 mestranol COc3cc4CCC2C 150.5 3938 http://www.s PHYSPROP
    21757 mestanolone O=C3CC4CCC2C 192.5 3937 http://www.s PHYSPROP
    21758 mescaline COc1c(cc(cc1 35.5 3934 http://www.s PHYSPROP
    21759 benzoic acid, OC(=O)c1cc(N 283 3933 http://www.s PHYSPROP
    21760 mequitazine c3ccc4Sc5ccc 130.5 3926 http://www.s PHYSPROP
    21761 meprobamateO=C(N)OCC(C) 105 3924 http://www.s PHYSPROP
    21762 meprednisoneOCC(=O)C4(O) 202.5 3923 http://www.s PHYSPROP
    21763 2-piperidinec O=C(Nc1c(C)c 150.5 3922 http://www.s PHYSPROP
    21764 mephenytoin CCC1(NC(=O)N 136.5 3920 http://www.s PHYSPROP
    21765 demerol CN1CCC(CC1)( 270 3918 http://www.s PHYSPROP
    21766 2-methyl-1,4 O=C2C=C(C)C( 107 3915 http://www.s PHYSPROP
    21767 1-aminoadamaCC13CC2(C)CC 258 3914 http://www.s PHYSPROP
    21768 d-glucitol, 1- OC(C(O)CNC)C 128.5 3909 http://www.s PHYSPROP
    21769 megestrol aceCC(=O)C2(OC( 214 3908 http://www.s PHYSPROP
    21770 mefenamic acO=C(O)c2cccc 230.5 3904 http://www.s PHYSPROP
    21771 medrysone CC(=O)C3CCC4 156.5 3903 http://www.s PHYSPROP
    21772 medroxyproges
    CC(=O)C2(OC( 206.5 3902 http://www.s PHYSPROP
    21773 mecysteine hyO=C(OC)C(N)C 140.5 3900 http://www.s PHYSPROP x salt - AL
    21774 meclofenamicClc2ccc(C)c(C 257 3897 http://www.s PHYSPROP
    21775 mechlorethamClCCN(C)CCCl -60 3893 http://www.s PHYSPROP
    21776 mebendazole O=C(OC)Nc1nc 288.5 3890 http://www.s PHYSPROP
    21777 norphenazoneO=C2CC(C)=NN 129 3881 http://www.s PHYSPROP
    21778 mazindol Clc1ccc(cc1) 198.5 3880 http://www.s PHYSPROP
    21779 maprotiline CNCCCC24CCC( 93 3871 http://www.s PHYSPROP
    21780 malathion CCOC(=O)CC(S 2.8 3864 http://www.s PHYSPROP
    21781 lsd CCN(CC)C(=O) 82.5 3843 http://www.s PHYSPROP
    21782 lycorine OC2C=C4CCN3 280 3840 http://www.s PHYSPROP
    21783 loxapine CN1CCN(CC1)C 109.5 3827 http://www.s PHYSPROP
    21784 losartan OCc4c(Cl)nc( 184 3824 http://www.s PHYSPROP
    21785 lorazepam Clc3ccccc3C2= 167 3821 http://www.s PHYSPROP
    21786 loratadine Clc3cc4CCc1c 135 3820 http://www.s PHYSPROP
    21787 1-(2-chloroethO=C(NC1CCCC 90 3813 http://www.s PHYSPROP
    21788 lomefloxacin O=C(O)C2=CN( 239.75 3811 http://www.s PHYSPROP
    21789 lofepramine Clc1ccc(cc1) 105 3810 http://www.s PHYSPROP
    21790 pentamidine iCN2C(CCCC2CC 191 3808 http://www.s PHYSPROP
    21791 lobeline CN2C(CCCC2CC 130.5 3808 http://www.s PHYSPROP
    21792 linezolid CC(=O)NCC1OC 182 3792 http://www.s PHYSPROP
    21793 levallorphan tOc2ccc3CC1C 177 3775 http://www.s PHYSPROP
    21794 letrozole N#Cc1ccc(cc1) 182 3765 http://www.s PHYSPROP
    21795 leflunomide Cc2oncc2C(=O) 166.5 3762 http://www.s PHYSPROP
    21796 dodecanoic acO=C(O)CCCCC 43.2 3756 http://www.s PHYSPROP
    21797 labetalol O=C(N)c1cc(c 188 3734 http://www.s PHYSPROP
    21798 benzeneaceticNC(C(=O)O)c1 290 3732 http://www.s PHYSPROP
    21799 benzenepropano
    OC(Cc1ccccc1 98 3715 http://www.s PHYSPROP
    21800 kynurenic aci O=C(O)c1cc(O 282.5 3712 http://www.s PHYSPROP
    21801 4h-pyran-4-onO=C1C=C(CO) 153.5 3708 http://www.s PHYSPROP
    21802 kinetin n1cnc3ncnc3c 266.5 3698 http://www.s PHYSPROP
    21803 ketotifen CN1CC/C(CC1) 152.5 3695 http://www.s PHYSPROP
    21804 ketorolac O=C(O)C1CCn2 160.5 3694 http://www.s PHYSPROP
    21805 ketoprofen CC(C(=O)O)c1c 94 3693 http://www.s PHYSPROP
    21806 piperazine, 1- CC(=O)N1CCN( 146 3691 http://www.s PHYSPROP
    21807 ketanserin Fc1ccc(cc1)C 231 3690 http://www.s PHYSPROP
    21808 ketamine CNC1(CCCCC1= 92.5 3689 http://www.s PHYSPROP
    21809 5-hydroxy-1, Oc1cccc2c1C( 155 3674 http://www.s PHYSPROP
    21810 isoxsuprine Oc1ccc(cc1)C( 103 3651 http://www.s PHYSPROP
    21811 prothipendyl CN(C)C(C)CN1 110 3649 http://www.s PHYSPROP x salt - AL
    21812 d-glucitol, 1,4 [O-][N+](=O) 70 3648 http://www.s PHYSPROP
    21813 1,2-benzenedio
    Oc1ccc(cc1O) 170.5 3647 http://www.s PHYSPROP
    21814 isoproterenol Oc1ccc(cc1O) 153.5 3647 http://www.s PHYSPROP
    21815 3h-pyrazol-3-oCC(C)C=2C(=O 103 3646 http://www.s PHYSPROP
    21816 isopropanol CC(C)O -89.5 3644 http://www.s PHYSPROP
    21817 isonipecotic aO=C(O)C1CCN 336 3641 http://www.s PHYSPROP
    21818 isoniazid O=C(NN)c1ccn 171.4 3635 http://www.s PHYSPROP
    21819 isoflurane FC(F)(F)C(Cl)O 48.5 3631 http://www.s PHYSPROP
    21820 1h-purine-2,6CC(C)CN1c2nc 200.5 3627 http://www.s PHYSPROP
    21821 2',5'-dichlor Nc1nc(nc(N)n1 268.5 3621 http://www.s PHYSPROP
    21822 irinotecan CCC3(O)C=4C= 222.5 3619 http://www.s PHYSPROP
    21823 1h-indole-3-p O=C(O)CCc2cn 134.5 3613 http://www.s PHYSPROP
    21824 iopanoic acid Ic1cc(I)c(N)c( 155.2 3604 http://www.s PHYSPROP
    21825 iohexol OCC(O)CNC(=O) 177 3599 http://www.s PHYSPROP
    21826 8-quinolinol, Oc1c(I)cc(I)c2 210 3597 http://www.s PHYSPROP
    21827 iodoacetamidICC(N)=O 94.5 3596 http://www.s PHYSPROP
    21828 iodamide O=C(C)Nc1c(I) 255 3592 http://www.s PHYSPROP
    21829 inositol niacinO=C(OC6C(OC( 254.6 3589 http://www.s PHYSPROP
    21830 benzeneaceticO=C(O)C(C)c1 213.5 3587 http://www.s PHYSPROP
    21831 indomethacinClc1ccc(cc1)C 158 3584 http://www.s PHYSPROP
    21832 indole-3-carbiOCc2cnc1cccc 97.5 3581 http://www.s PHYSPROP
    21833 indapamide NS(=O)(=O)c1 161 3574 http://www.s PHYSPROP
    21834 imipramine CN(C)CCCN2c3 174.5 3568 http://www.s PHYSPROP
    21835 ifosfamide O=P1(NCCCl) 40 3562 http://www.s PHYSPROP
    21836 ifenprodil OC(C(C)N1CCC 114 3561 http://www.s PHYSPROP
    21837 uridine, 2'-de IC1=CN(C(=O) 263 3559 http://www.s PHYSPROP
    21838 1,2-propanedio
    OC(CO)COCCC 70.5 3553 http://www.s PHYSPROP
    21839 dexamethasonCC(=O)OCC(=O 263 3552 http://www.s PHYSPROP
    21840 betamethasonCC(=O)OCC(=O 232 3552 http://www.s PHYSPROP
    21841 lidocaine O=C(Nc1c(C)c 68.5 3548 http://www.s PHYSPROP
    21842 atropine CN3C1CCC3CC( 118.5 3534 http://www.s PHYSPROP
    21843 hyoscyamine CN3C1CCC3CC( 108.5 3534 http://www.s PHYSPROP
    21844 hydroxyurea NC(=O)NO 141 3530 http://www.s PHYSPROP
    21845 hydroxychloroCCN(CCO)CCCC 90 3526 http://www.s PHYSPROP
    21846 phenol, 4-(2-aOc1ccc(CC(C)N 125.5 3525 http://www.s PHYSPROP
    21847 p-hydroxyampOc1ccc(CC(C)N 125.5 3525 http://www.s PHYSPROP
    21848 hydroquinidinCOc1cc2c(cc1 278 82624 http://www.s PHYSPROP x salt JCB
    21849 hydroquinidinCOc1cc2c(cc1 168.5 82624 http://www.s PHYSPROP
    21850 hydromorphoO=C1CCC3C2C 266.5 3522 http://www.s PHYSPROP
    21851 hydroflumethiFC(F)(F)c1cc 270.5 3521 http://www.s PHYSPROP
    21852 hydrocotarninCN1Cc2c(OC) 56 3520 http://www.s PHYSPROP
    21853 hydrochlorothNS(=O)(=O)c2 274 3513 http://www.s PHYSPROP
    21854 hydralazine NNc2nncc1ccc 172.5 3511 http://www.s PHYSPROP
    21855 hycanthone CCN(CC)CCNc1 101.9 3508 http://www.s PHYSPROP
    21856 homatropin CN3C1CCC3CC( 99.5 3497 http://www.s PHYSPROP
    21857 hexabarital O=C1NC(=O)N( 146.5 3482 http://www.s PHYSPROP
    21858 hexestrol Oc1ccc(cc1)C( 186.5 3480 http://www.s PHYSPROP
    21859 hexachlorophClc2c(Cc1c(O)c 166.5 3472 http://www.s PHYSPROP
    21860 hetacillin OC(=O)C1N2C( 190 3470 http://www.s PHYSPROP
    21861 hesperidin COc1ccc(cc1O 262 3468 http://www.s PHYSPROP
    21862 hesperetine COc1ccc(cc1O 227.5 3467 http://www.s PHYSPROP
    21863 heptaminol hyCC(C)(O)CCCC 166 3464 http://www.s PHYSPROP x salt - AL
    21864 heptachlor ClC2=C(Cl)C3( 95.5 3463 http://www.s PHYSPROP
    21865 hecogenin O=C5CC2C(CC 266.5 3449 http://www.s PHYSPROP
    21866 halothane BrC(Cl)C(F)(F) -118 3441 http://www.s PHYSPROP
    21867 haloprogin Clc1cc(OCC#CI 113.5 3440 http://www.s PHYSPROP
    21868 haloperidol Fc1ccc(cc1)C( 151.5 3438 http://www.s PHYSPROP
    21869 guanidine N=C(N)N 50 3400 http://www.s PHYSPROP
    21870 guanfacine Clc1cccc(Cl)c 226 3399 http://www.s PHYSPROP
    21871 1,2-propanediOCC(O)COc1c 78.5 3396 http://www.s PHYSPROP
    21872 azulene, 1,4-dCC(C)c1ccc(C) 31.5 3395 http://www.s PHYSPROP
    21873 griseofulvin O=C2c3c(OC12 220 3392 http://www.s PHYSPROP
    21874 glyphosphate OC(=O)CNCP( 189.5 3376 http://www.s PHYSPROP
    21875 ammonium glyO=C(O)C7OC(O 209 3375 http://www.s PHYSPROP
    21876 glybuzole O=S(=O)(Nc1nn 163 3369 http://www.s PHYSPROP
    21877 glyburide O=C(NC1CCCCC 169 3368 http://www.s PHYSPROP
    21878 2-ethyl-2-phe CCC1(CCC(=O) 84 3367 http://www.s PHYSPROP
    21879 gliclazide Cc1ccc(cc1)S 181 3356 http://www.s PHYSPROP
    21880 glafenine OCC(O)COC(=O 169.5 3355 http://www.s PHYSPROP
    21881 gestonorone cCC(=O)C2(OC 123.5 3352 http://www.s PHYSPROP
    21882 2,5-dihydroxyOC(=O)c1cc(O 199.5 3350 http://www.s PHYSPROP
    21883 gemfibrozil O=C(O)C(C)(C 62 3345 http://www.s PHYSPROP
    21884 galanthamineOC1C=CC42CCN 126.5 3331 http://www.s PHYSPROP
    21885 bromuconazolBrC2CC(Cn1cnc 84 3326 http://www.s PHYSPROP
    21886 2-pyridinecarbOC(=O)c1ccc( 97 3324 http://www.s PHYSPROP
    21887 furosemide NS(=O)(=O)c2c 295 3322 http://www.s PHYSPROP x only one value here while many cluster ar
    21888 d-tagatose OC1C(O)C(O) 134.5 3308 http://www.s PHYSPROP
    21889 fosfosal OP(=O)(O)Oc1 169 3300 http://www.s PHYSPROP
    21890 fosfomycin O=P(O)(O)C1 94 3299 http://www.s PHYSPROP
    21891 flurbiprofen Fc2cc(ccc2c1c 110.5 3277 http://www.s PHYSPROP
    21892 fominoben O=C(CN(C)Cc2 122.75 3290 http://www.s PHYSPROP
    21893 flurazepam Fc3ccccc3C2= 79.5 3276 http://www.s PHYSPROP
    21894 fluprednisolo OCC(=O)C4(O) 210.5 3273 http://www.s PHYSPROP
    21895 prednisolone-OCC(=O)C4(O) 264.5 3273 http://www.s PHYSPROP
    21896 5-fluorouracil FC1=CNC(=O) 283 3268 http://www.s PHYSPROP
    21897 fluoromethal CC(=O)C4(O)C 297 3267 http://www.s PHYSPROP
    21898 fluocinonide CC(=O)OCC(=O 309 3265 http://www.s PHYSPROP
    21899 fluocinolone OCC(=O)C54OC 265.5 3264 http://www.s PHYSPROP
    21900 flunitrazepam[O-][N+](=O)c 166.5 3263 http://www.s PHYSPROP
    21901 flumazenil O=C(OCC)c3nc 202 3256 http://www.s PHYSPROP
    21902 flufenamic aciFC(F)(F)c1cc( 133.5 3254 http://www.s PHYSPROP
    21903 fludiazepam Fc3ccccc3C2=N 296 3252 http://www.s PHYSPROP
    21904 fludarabine Nc3nc(F)nc2c 260 3250 http://www.s PHYSPROP
    21905 flucytosine FC1=CNC(=O) 296 3249 http://www.s PHYSPROP
    21906 fluconazole OC(Cn1cncn1) 139 3248 http://www.s PHYSPROP
    21907 floxuridine FC1=CN(C(=O 150.5 3246 http://www.s PHYSPROP
    21908 1-propanone, O=C(CC)c1c(O 175.5 3245 http://www.s PHYSPROP
    21909 floctafenine OCC(O)COC(=O) 179.5 3243 http://www.s PHYSPROP
    21910 flecanide FC(F)(F)COc2c 146 3239 http://www.s PHYSPROP
    21911 fipronil FC(F)(F)S(=O)c 200.5 3235 http://www.s PHYSPROP
    21912 proscar CC(C)(C)NC(= 253 3233 http://www.s PHYSPROP
    21913 fexofenadine O=C(O)C(C)(C) 196 3231 http://www.s PHYSPROP
    21914 fenvalerate Clc1ccc(cc1)C 46.6 3230 http://www.s PHYSPROP
    21915 esfenvalerate Clc1ccc(cc1)C 59.5 3230 http://www.s PHYSPROP
    21916 fenthion Cc1cc(ccc1SC 7.5 3229 http://www.s PHYSPROP
    21917 fentanyl CCC(=O)N(C2C 87.5 3228 http://www.s PHYSPROP
    21918 fenofibrate O=C(c1ccc(Cl) 80.5 3222 http://www.s PHYSPROP
    21919 fenbufen O=C(CCC(=O)O 186 3218 http://www.s PHYSPROP
    21920 [1,1'-biphenylOC(=O)Cc1ccc( 160.5 3215 http://www.s PHYSPROP
    21921 felbamate NC(=O)OCC(CO 152 3214 http://www.s PHYSPROP
    21922 famotidine N/C(N)=N/c1n 163.5 3208 http://www.s PHYSPROP
    21923 exalamide NC(=O)c1ccc 71 3199 http://www.s PHYSPROP
    21924 etopside COc1cc(cc(O 243.5 3194 http://www.s PHYSPROP
    21925 etomidoline O=C4c1ccccc1 106.5 3193 http://www.s PHYSPROP
    21926 etilefrin OC(CNCC)c1cc 147.5 3190 http://www.s PHYSPROP
    21927 etodolac O=C(O)CC3(CC 146.5 3192 http://www.s PHYSPROP
    21928 ethylestrenol CC32CCC1C4C 77 3186 http://www.s PHYSPROP
    21929 ethyl loflazep Fc3ccccc3C2= 193.5 3183 http://www.s PHYSPROP
    21930 ethoxyzolami NS(=O)(=O)c1 189 3179 http://www.s PHYSPROP
    21931 2,4-imidazolidO=C2NC(c1ccc 94 3176 http://www.s PHYSPROP
    21932 ethosuximide CC1(CC)CC(= 65 3175 http://www.s PHYSPROP
    21933 ethopropazin CCN(CC)C(C)C 64.5 3174 http://www.s PHYSPROP
    21934 o-ethyl s,s-di CCCSP(=O)(SC -13 3173 http://www.s PHYSPROP
    21935 ethisterone O=C2CCC3(C)C 272 3172 http://www.s PHYSPROP
    21936 ethion S=P(SCSP(=S) -13 3171 http://www.s PHYSPROP
    21937 ethinyl estradiOc3cc4CCC2C( 183 3170 http://www.s PHYSPROP
    21938 cyclohexanol, O=C(N)OC1(C 96 3169 http://www.s PHYSPROP
    21939 diethyl ether CCOCC -116.3 3168 http://www.s PHYSPROP
    21940 benzamide, 2-CCOc1ccccc1C 133 3167 http://www.s PHYSPROP
    21941 ethaverine CCOc1ccc(cc1 100 3165 http://www.s PHYSPROP
    21942 ethambutol CCC(CO)NCCN 89 3164 http://www.s PHYSPROP
    21943 ethacrynic aciClc1c(ccc(OCC 122.5 3163 http://www.s PHYSPROP
    21944 estriol Oc3cc4CCC2C( 282 3154 http://www.s PHYSPROP
    21945 estradiol ben O=C(Oc3cc4CC 196 3147 http://www.s PHYSPROP
    21946 estazolam Clc2cc3C(=NC 228.5 3146 http://www.s PHYSPROP
    21947 erythromycin O
    e =C(OCC)CCC( 222 3141 http://www.s PHYSPROP
    21948 erythromycin CN(C)C3CC(C) 191 3140 http://www.s PHYSPROP
    21949 ergonovine CC(CO)NC(=O) 162 3137 http://www.s PHYSPROP
    21950 equilin Oc3cc4CC=C1C 239 3134 http://www.s PHYSPROP
    21951 epitiostanol OC2CCC1C3CC 127 3130 http://www.s PHYSPROP
    21952 pyrimidine,2 Cc1cc(nc(n1) 91 3129 http://www.s PHYSPROP
    21953 cholestan-3-olCC(C)CCCC(C) 185.5 3127 http://www.s PHYSPROP
    21954 cholestan-3-ol,CC(C)CCCC(C) 141.5 3127 http://www.s PHYSPROP
    21955 coprostanol CC(C)CCCC(C) 102 3127 http://www.s PHYSPROP
    21956 ubenimex NC(Cc1ccccc1 234.5 3125 http://www.s PHYSPROP
    21957 enoxolone O=C(O)C4(C)C 296 3117 http://www.s PHYSPROP
    21958 enoxacin O=C(O)C2=CN( 222 3116 http://www.s PHYSPROP
    21959 endothal OC(=O)C2C(C 144 3112 http://www.s PHYSPROP
    21960 endosulfan ClC2=C(Cl)C3( 106 3111 http://www.s PHYSPROP
    21961 emorfazone CCOC1=C(C=N 90 3108 http://www.s PHYSPROP
    21962 emodin Cc3cc2C(=O)c1 257 3107 http://www.s PHYSPROP
    21963 embelin OC1=C(CCCCC 142.5 3105 http://www.s PHYSPROP
    21964 dyphylline OCC(O)Cn2cnc 161.5 3070 http://www.s PHYSPROP
    21965 dydrogestero CC(=O)C2CCC 170 3069 http://www.s PHYSPROP
    21966 dromostanoloCCC(=O)OC3C 128 3058 http://www.s PHYSPROP
    21967 dropropizine OC(CN1CCN(CC 105 3057 http://www.s PHYSPROP
    21968 droperidol Fc1ccc(cc1)C 145.75 3056 http://www.s PHYSPROP
    21969 dromostanoloO=C3CC4CCC2 151 3055 http://www.s PHYSPROP
    21970 doxifluridine FC1=CN(C(=O 190 3047 http://www.s PHYSPROP
    21971 metyrosine Oc1ccc(CC(C)( 312.5 3013 http://www.s PHYSPROP
    21972 domperidone Clc4cc5NC(=O 242.5 3039 http://www.s PHYSPROP
    21973 diuron Clc1ccc(NC(=O 158 3008 http://www.s PHYSPROP
    21974 disulfoton CCSCCSP(=S)( -25 3006 http://www.s PHYSPROP
    21975 disulfiram CCN(CC)C(=S) 71.5 3005 http://www.s PHYSPROP
    21976 disopyramide CC(C)N(CCC(c1 94.75 3002 http://www.s PHYSPROP
    21977 dipyridamole OCCN(CCO)c2n 163 2997 http://www.s PHYSPROP
    21978 benzophenonO=C(c1ccccc1) 48.5 2991 http://www.s PHYSPROP
    21979 diphenhydramCN(C)CCOC(c1 168 2989 http://www.s PHYSPROP
    21980 diphenhydrami
    CN(C)CCOC(c1 168 2989 http://www.s PHYSPROP
    21981 1-octanamine,CCCCCCCCNCC 35.5 2984 http://www.s PHYSPROP
    21982 benzamide, 2-Cc1c(cc(cc1[N 177 2982 http://www.s PHYSPROP
    21983 dimorpholamiO=C(N(CCCC) 41.5 2981 http://www.s PHYSPROP
    21984 1,2-dimethyl- O=[N+]([O-])c 138.5 2980 http://www.s PHYSPROP
    21985 dimethoate COP(=S)(OC)S 52 2973 http://www.s PHYSPROP
    21986 2,4-oxazolidinO=C1NC(=O)C( 76.5 2972 http://www.s PHYSPROP
    21987 dimefline CN(C)Cc3c(cc 109.5 2969 http://www.s PHYSPROP
    21988 diltiazem CN(C)CCN1c3c 209.75 2967 http://www.s PHYSPROP
    21989 dihydrocodei COc1ccc2CC5 112.5 2955 http://www.s PHYSPROP
    21990 digitoxin O=C1C=C(CO1) 255.5 2953 http://www.s PHYSPROP
    21991 diflunisal OC(=O)c1cc(cc 215.5 2951 http://www.s PHYSPROP
    21992 diflucortoloneCCCCC(=O)OCC 195 2950 http://www.s PHYSPROP
    21993 diphenidol OC(CCCN1CCCC 104.5 2947 http://www.s PHYSPROP
    21994 1-piperazinec O=C(N1CCN(C) 48 2944 http://www.s PHYSPROP
    21995 endrin ClC4=C(Cl)C5( 228 21782117 http://www.s PHYSPROP
    21996 dieldrin ClC4=C(Cl)C5( 175.5 10292746 http://www.s PHYSPROP
    21997 inosine, 2',3' Oc3ncnc2c3n 161.5 2935 http://www.s PHYSPROP
    21998 dichlorvos COP(=O)(OC)O -60 2931 http://www.s PHYSPROP
    21999 dichlorophen Clc1c(cc(cc1C 228.7 2930 http://www.s PHYSPROP
    22000 phenol,2,2'-mOc2ccc(Cl)cc2 177.5 2929 http://www.s PHYSPROP
    22001 p,p'-ddt Clc1ccc(cc1)C( 108.5 2928 http://www.s PHYSPROP
    22002 p,p'-dde Clc1ccc(cc1)C( 89 2927 http://www.s PHYSPROP
    22003 2,6-dichlorobeN#Cc1c(Cl)ccc 144.5 2923 http://www.s PHYSPROP
    22004 dicamba COc1c(c(Cl)cc 115 2922 http://www.s PHYSPROP
    22005 dibromomethBrCBr -52.5 2916 http://www.s PHYSPROP
    22006 dibenzothiop c1cccc2sc3ccc 97 2915 http://www.s PHYSPROP
    22007 124-benzthidiClc1ccc2N=C( 330.5 2911 http://www.s PHYSPROP
    22008 diazepam Clc1ccc2c(c1) 132 2908 http://www.s PHYSPROP
    22009 betamethasonOCC(=O)C4(O) 232 2896 http://www.s PHYSPROP
    22010 deoxycorticosCC(=O)OCC(= 157 2894 http://www.s PHYSPROP
    22011 betamethasonOCC(=O)C4C(C 217 2893 http://www.s PHYSPROP
    22012 gestodene O=C2CCC3C4C 197.9 2892 http://www.s PHYSPROP
    22013 1,4-benzdiazeClc1ccc2NC(= 216.5 2890 http://www.s PHYSPROP
    22014 desipramine hCNCCCN2c3ccc 215.5 2888 http://www.s PHYSPROP x salt JCB
    22015 deoxycholic acO=C(O)CCC(C) 177 2881 http://www.s PHYSPROP
    22016 deltamethrin BrC(Br)=C/C3C 100 2876 http://www.s PHYSPROP
    22017 dehydrocholicO=C(O)CCC(C) 237 2869 http://www.s PHYSPROP
    22018 decanoic acid O=C(O)CCCCC 31.9 2863 http://www.s PHYSPROP
    22019 deferoxamineCC(=O)N(O)C 140 2867 http://www.s PHYSPROP
    22020 2(1h)-isoquin N=C(N)N1Cc2c 279 2860 http://www.s PHYSPROP
    22021 daunomycin CC(=O)C4(O)C 208.5 2852 http://www.s PHYSPROP
    22022 di(p-aminopheNc1ccc(cc1)S( 175.5 2849 http://www.s PHYSPROP
    22023 9,10-anthraceOc3cccc2C(=O 193 2845 http://www.s PHYSPROP
    22024 danazol C#CC2(O)CCC 225.6 2844 http://www.s PHYSPROP
    22025 dimethyl tetr Clc1c(C(=O)OC 155 2839 http://www.s PHYSPROP
    22026 cyproheptadi CN1CCC(CC1)= 112.8 2810 http://www.s PHYSPROP
    22027 cyclopropaneca
    ClC(Cl)=C/C3C 84 2809 http://www.s PHYSPROP
    22028 cypermethrin Cl/C(Cl)=C/C3 80.5 2809 http://www.s PHYSPROP
    22029 alpha-cypermeCl/C(Cl)=C/C3 79.5 2809 http://www.s PHYSPROP
    22030 cyclothiazide NS(=O)(=O)c4 234 2807 http://www.s PHYSPROP
    22031 cyclophospha O=P1(NCCCO1) 51.5 2804 http://www.s PHYSPROP
    22032 cyclopentana NC1CCCC1 -82.7 2803 http://www.s PHYSPROP
    22033 3-cyclopentyl NS(=O)(=O)c3 238 2801 http://www.s PHYSPROP
    22034 cyclooctanamNC1CCCCCCC1 -48 2800 http://www.s PHYSPROP
    22035 cyclofenil CC(=O)Oc1ccc 135.5 2795 http://www.s PHYSPROP
    22036 cyclandelate O=C(OC1CC(C) 56 2790 http://www.s PHYSPROP
    22037 coumaphos CCOP(=S)(OCC 93 2768 http://www.s PHYSPROP
    22038 pseudoyohimbO=C(OC)C2C( 268 2763 http://www.s PHYSPROP
    22039 alpha-yohimbO=C(OC)C2C( 243.5 2763 http://www.s PHYSPROP
    22040 convallatoxin O=C1C=C(CO1 238 2759 http://www.s PHYSPROP
    22041 conessine CN(C)C4CC5=C 125.5 2758 http://www.s PHYSPROP
    22042 mevastatin CC(CC)C(=O)O 152 2752 http://www.s PHYSPROP
    22043 8-quinolinol,5Oc1ccc(Cl)c2c 130 2715 http://www.s PHYSPROP
    22044 clotrimazole Clc1ccccc1C(c 148 2710 http://www.s PHYSPROP
    22045 2h-thieno[2,3-Clc3ccccc3C1 119 2709 http://www.s PHYSPROP
    22046 2-(2,6-dichlo Clc2cccc(Cl) 130 2701 http://www.s PHYSPROP
    22047 clonazepam [O-][N+](=O)c 237.5 2700 http://www.s PHYSPROP
    22048 chlorimipramiCN(C)CCCN2c3 189.5 2699 http://www.s PHYSPROP
    22049 clofoctol Clc2cc(Cl)ccc 78 2697 http://www.s PHYSPROP
    22050 2-(p-clphenoxClc1ccc(OC(C) 118.5 2695 http://www.s PHYSPROP
    22051 chlophedianolOC(CCN(C)C)(c 120 2693 http://www.s PHYSPROP
    22052 clofazimine Clc1ccc(cc1) 211 2692 http://www.s PHYSPROP
    22053 clobetasone-1ClCC(=O)C4(O 95 2690 http://www.s PHYSPROP
    22054 clobetasol-17 ClCC(=O)C4(O 196.25 2689 http://www.s PHYSPROP
    22055 8-quinolinol, Oc1c(I)cc(Cl) 178.5 2686 http://www.s PHYSPROP
    22056 clemizole Clc1ccc(cc1) 167 2680 http://www.s PHYSPROP
    22057 limettin COc2cc(cc1OC 149 2673 http://www.s PHYSPROP
    22058 ciprofibrate ClC2(Cl)CC2c1 115 2661 http://www.s PHYSPROP
    22059 1,8-cineole CC2(C)OC1(C) 1.5 2656 http://www.s PHYSPROP
    22060 cinchonidine OC(C2CC1CCN2 210.5 2655 http://www.s PHYSPROP
    22061 cimetidine Cc1ncnc1CSC 142 2654 http://www.s PHYSPROP
    22062 cilostazol O=C1CCc2cc( 160 2652 http://www.s PHYSPROP
    22063 ciclopirox CC=2C=C(C1CC 144 2647 http://www.s PHYSPROP
    22064 cyclacillin OC(=O)C2N3C( 182.5 2646 http://www.s PHYSPROP
    22065 cifenline C2C(C1=NCCN1 103.5 2645 http://www.s PHYSPROP
    22066 cyclopropanecC/C(C)=C/C1C 41 2642 http://www.s PHYSPROP
    22067 chrysanthemicC/C(C)=C/C1C 19 2642 http://www.s PHYSPROP
    22068 2(3h)-benzoxaClc1cc2NC(=O 191.5 2632 http://www.s PHYSPROP
    22069 chlorthalidon NS(=O)(=O)c1c 239 2631 http://www.s PHYSPROP
    22070 chlorpyrifos Clc1cc(Cl)c(C 42 2629 http://www.s PHYSPROP
    22071 chlorprophamClc1cc(NC(=O) 41 2627 http://www.s PHYSPROP
    22072 chlorpropami O=S(=O)(NC(= 128 2626 http://www.s PHYSPROP
    22073 maolate Clc1ccc(OCC( 90 2623 http://www.s PHYSPROP
    22074 8-quinolinol, Oc1c(Cl)cc(Cl 179.5 2621 http://www.s PHYSPROP
    22075 chloroquine CCN(CC)CCCC( 87 2618 http://www.s PHYSPROP
    22076 chlormezanonO=C1CCS(=O)( 116.2 2616 http://www.s PHYSPROP
    22077 chlormadinoneCC(=O)C2(OC( 213 2613 http://www.s PHYSPROP
    22078 chlorhexidine Clc2ccc(NC(= 134 2612 http://www.s PHYSPROP
    22079 chlorambucil O=C(O)CCCc1c 65 2607 http://www.s PHYSPROP
    22080 choral hydrat ClC(Cl)(Cl)C(O 57 2606 http://www.s PHYSPROP
    22081 1-hexadecanoCCCCCCCCCCC 49.3 2581 http://www.s PHYSPROP
    22082 cetirizine O=C(O)COCCN1 112.5 2577 http://www.s PHYSPROP
    22083 cephradine CC=3CSC2C(NC 140 2572 http://www.s PHYSPROP
    22084 cephaeline Oc4cc5CCNC(C 115.5 2564 http://www.s PHYSPROP
    22085 urea, n'-[3-ac CCN(CC)C(=O) 111 2563 http://www.s PHYSPROP
    22086 celecoxib NS(=O)(=O)c1c 158 2562 http://www.s PHYSPROP
    22087 cephalothin O=C(O)C=2N3C 160.25 2513 http://www.s PHYSPROP
    22088 carvedilol COc4ccccc4OC 114.5 2487 http://www.s PHYSPROP
    22089 carprofen O=C(O)C(C)c1c 197.5 2483 http://www.s PHYSPROP
    22090 1,3-bis(2-chloO=C(NCCCl)N( 31 2480 http://www.s PHYSPROP
    22091 carmofur O=C1NC(=O)C 110.5 2479 http://www.s PHYSPROP
    22092 carisoprodol O=C(NC(C)C)O 92 2478 http://www.s PHYSPROP
    22093 carbofuran CNC(=O)Oc1cc 151 2468 http://www.s PHYSPROP
    22094 carbidopa Oc1ccc(CC(C) 208 2465 http://www.s PHYSPROP
    22095 carbenoxolonO=C(O)CCC(=O 292.5 2463 http://www.s PHYSPROP
    22096 carbamazepinNC(=O)N2c3cc 190.2 2457 http://www.s PHYSPROP
    22097 captopril OC(=O)C1CCCN 106 2453 http://www.s PHYSPROP
    22098 cantharidin O=C2OC(=O)C 218 2449 http://www.s PHYSPROP
    22099 cannabinol Cc2cc3c1c(cc( 77 2447 http://www.s PHYSPROP
    22100 bicyclo(2.2.1) CC2(C)C1CC(= 179 2441 http://www.s PHYSPROP
    22101 camphor CC2(C)C1CC(= 180 2441 http://www.s PHYSPROP
    22102 (1r,4r)-(+)-ca CC2(C)C1CC(= 178.8 2441 http://www.s PHYSPROP
    22103 (+-)camphor CC2(C)C1CC(= 176 2441 http://www.s PHYSPROP
    22104 caffeine, citra O=C2c1n(C)cn 238 2424 http://www.s PHYSPROP x no citrate in caffeine
    22105 caffeine O=C2c1n(C)cn 238 2424 http://www.s PHYSPROP
    22106 butyl-p-amin Nc1ccc(cc1)C 58 2388 http://www.s PHYSPROP
    22107 butalbital O=C1NC(=O)NC 138.5 2387 http://www.s PHYSPROP
    22108 butabarbital O=C1NC(=O)NC 166.5 2385 http://www.s PHYSPROP
    22109 mylerlan O=S(C)(=O)OC 116 2384 http://www.s PHYSPROP
    22110 bupranolol Clc1ccc(C)cc1 221 2381 http://www.s PHYSPROP
    22111 bupivacaine Cc2cccc(C)c2 107.5 2380 http://www.s PHYSPROP
    22112 bunitrolol CC(C)(C)NCC( 164 2379 http://www.s PHYSPROP
    22113 bumetanide O=S(N)(=O)c2 230.5 2377 http://www.s PHYSPROP
    22114 bufexamic aciONC(=O)Cc1cc 154 2372 http://www.s PHYSPROP
    22115 bufalin O=C1C=CC(=C 242.5 2370 http://www.s PHYSPROP
    22116 bucolome O=C2C(CCCC) 84 2367 http://www.s PHYSPROP
    22117 8-quinolinol, Oc1c(Br)cc(Br 196 2359 http://www.s PHYSPROP
    22118 brotizolam Clc4ccccc4C2= 213 2357 http://www.s PHYSPROP
    22119 1,3-propanedi[O-][N+](=O)C 131.5 2356 http://www.s PHYSPROP
    22120 bromperidol Fc1ccc(cc1)C( 155 2354 http://www.s PHYSPROP
    22121 a-bromo-i-val CC(C)C(Br)C( 154 2353 http://www.s PHYSPROP
    22122 2-amino-3,5-dCN(Cc1cc(Br) 238 2348 http://www.s PHYSPROP
    22123 phenol, 2,2'-t Oc2c(Sc1cc(Cl) 188 2313 http://www.s PHYSPROP
    22124 2-propanol, 1-CC(C)NCC(O)C 100 2312 http://www.s PHYSPROP
    22125 phenol, 4,4'-( CC(=O)Oc1ccc( 133.5 2299 http://www.s PHYSPROP
    22126 biperiden OC(CCN1CCCCC 101 2289 http://www.s PHYSPROP
    22127 bicuculline CN2CCc1cc6O 194 2285 http://www.s PHYSPROP
    22128 bicalutamide Fc1ccc(cc1)S( 192 2284 http://www.s PHYSPROP
    22129 2,5-di-tert-b CC(C)(C)c1cc( 218 2283 http://www.s PHYSPROP
    22130 bevantolol COc1cc(ccc1O 137.5 2282 http://www.s PHYSPROP
    22131 2-propanol, 1 CC(C)NCC(O)C 71 2279 http://www.s PHYSPROP
    22132 bethanidine CN=C(NCc1ccc 196 2278 http://www.s PHYSPROP
    22133 beta-propiola O=C1CCO1 -33.4 2275 http://www.s PHYSPROP
    22134 beta-peltatin COc1cc(cc(OC 234 2273 http://www.s PHYSPROP
    22135 bergapten(e) COc1c3ccoc3c 188 2265 http://www.s PHYSPROP
    22136 benzthiazide NS(=O)(=O)c3 231.5 2253 http://www.s PHYSPROP
    22137 benzquinamidCCN(CC)C(=O) 131 2252 http://www.s PHYSPROP
    22138 benzo(a)pyre c1cc2c3ccc4cc 176.5 2246 http://www.s PHYSPROP
    22139 benzbromaro Brc1cc(cc(Br) 151 2243 http://www.s PHYSPROP
    22140 benzamidine hN=C(N)c1cccc 87 2242 http://www.s PHYSPROP x salt - AL
    22141 benzamide NC(=O)c1cccc 129.1 2241 http://www.s PHYSPROP
    22142 bentiromide Oc3ccc(CC(NC 241 2239 http://www.s PHYSPROP
    22143 bentazone CC(C)N1C(=O) 138 2238 http://www.s PHYSPROP
    22144 benefin [O-][N+](=O)c 66 2229 http://www.s PHYSPROP
    22145 bendroflumeth
    FC(F)(F)c1cc2 222 2225 http://www.s PHYSPROP
    22146 bendiocarb CNC(=O)Oc1cc 129.5 2224 http://www.s PHYSPROP
    22147 bendazac O=C(O)COc3nn 160 2223 http://www.s PHYSPROP
    22148 benazepril O=C(OCC)C(CC 148.5 2221 http://www.s PHYSPROP
    22149 2,6-piperidineCCC1(C)CC(=O 126.5 2220 http://www.s PHYSPROP
    22150 ethanone, 1-[ CC(C)NCC(O)C 115 2219 http://www.s PHYSPROP
    22151 barbital O=C1NC(=O)N 190 2206 http://www.s PHYSPROP
    22152 bamethan OC(CNCCCC)c1 124 2204 http://www.s PHYSPROP
    22153 2,2-bis(4-gly CC(C)(c2ccc( 10 2199 http://www.s PHYSPROP
    22154 benzenepropan
    Clc1ccc(cc1)C 207 2197 http://www.s PHYSPROP
    22155 azosemide NS(=O)(=O)c2c 219.5 2186 http://www.s PHYSPROP
    22156 diazene, dipheN(=N/c1ccccc1 68.5 2185 http://www.s PHYSPROP
    22157 azobenzene N(=N/c1ccccc1 68 2185 http://www.s PHYSPROP
    22158 azithromycin CN(C)C3CC(C) 114 2182 http://www.s PHYSPROP
    22159 methyl azinphCOP(=S)(OC)S 73 2181 http://www.s PHYSPROP
    22160 nonanedioc acO=C(O)CCCCC 106.5 2179 http://www.s PHYSPROP
    22161 azathioprine O=[N+]([O-]) 243.5 2178 http://www.s PHYSPROP
    22162 aurintricarboxOC(=O)C1=CC( 300 2172 http://www.s PHYSPROP
    22163 atrazine Clc1nc(NCC)nc 173 2169 http://www.s PHYSPROP
    22164 atenolol CC(C)NCC(O)C 147 2162 http://www.s PHYSPROP
    22165 astemizole Fc1ccc(cc1)C 149.1 2160 http://www.s PHYSPROP
    22166 acetylsalicylic O=C(C)Oc1ccc 135 2157 http://www.s PHYSPROP
    22167 aspartame O=C(O)CC(N)C 246.5 2155 http://www.s PHYSPROP
    22168 aprindine CCN(CC)CCCN( 120.5 2132 http://www.s PHYSPROP
    22169 antipyrine O=C2C=C(C)N( 114 2121 http://www.s PHYSPROP
    22170 hloralantipyri O=C2C=C(C)N( 68 2121 http://www.s PHYSPROP x Value clearly out of range EC
    22171 dichloralphenO=C2C=C(C)N( 68 2121 http://www.s PHYSPROP x Value clearly out of range EC
    22172 1,8-dihydroxyOc2cccc1Cc3c 179 2117 http://www.s PHYSPROP
    22173 antazoline C(c1ccccc1)N 120 2115 http://www.s PHYSPROP
    22174 anisomycin O=C(C)OC2C(C 140.5 2114 http://www.s PHYSPROP
    22175 1h-indene-1,3COc1ccc(cc1) 156.5 2112 http://www.s PHYSPROP
    22176 androstenedi O=C2CCC1C3C 158 2108 http://www.s PHYSPROP
    22177 anastrozole N#CC(C)(C)c1c 81.5 2102 http://www.s PHYSPROP
    22178 amygdalin OC3C(O)C(O)C 224.5 2095 http://www.s PHYSPROP
    22179 amsacrine CS(=O)(=O)Nc 235 2094 http://www.s PHYSPROP
    22180 ampicillin tri OC(=O)C2N3C( 198 2089 http://www.s PHYSPROP
    22181 amoxapine Clc1ccc2Oc4c 175.5 2085 http://www.s PHYSPROP
    22182 amobarbital O=C1NC(=O)NC 157 2079 http://www.s PHYSPROP
    22183 amitryptyline CN(C)CCC=C1c 196.5 2075 http://www.s PHYSPROP
    22184 amisulpride CCN2CCCC2CNC 126.5 2074 http://www.s PHYSPROP
    22185 2-aminothiazoNc1nccs1 93 2070 http://www.s PHYSPROP
    22186 ampyrone O=C2C(N)=C(C 109 2066 http://www.s PHYSPROP
    22187 theophylline O=C2c1ncnc1N 273 2068 http://www.s PHYSPROP
    22188 glycine, n-(4- O=C(NCC(=O)O 198.5 2063 http://www.s PHYSPROP
    22189 aminogluteth CCC1(CCC(=O) 149.5 2060 http://www.s PHYSPROP
    22190 amikacin NCCC(O)C(=O) 203.5 2057 http://www.s PHYSPROP
    22191 amantadine NC13CC2CC(CC 180 2045 http://www.s PHYSPROP
    22192 hexamethyl mCN(C)c1nc(nc( 173 2038 http://www.s PHYSPROP
    22193 alprenolol CC(C)NCC(O)C 108 2035 http://www.s PHYSPROP
    22194 vitamin e acetCC(=O)Oc2c(C -27.5 2033 http://www.s PHYSPROP
    22195 vitamin e CC(C)CCCC(C)C 3 2032 http://www.s PHYSPROP
    22196 .alpha.-d-glu OC1C(O)C(O) 168 2024 http://www.s PHYSPROP
    22197 alminoprofen O=C(O)C(C)c1 107 2013 http://www.s PHYSPROP
    22198 allylestrenol CC32CCC1C4C 80 2012 http://www.s PHYSPROP
    22199 allopurinol Oc2ncnc1nnc 350 2010 http://www.s PHYSPROP
    22200 isodrin Oc1ccc(cc1)C 241 4494 http://www.s PHYSPROP
    22201 aldrin ClC4(Cl)[C@@ 104 10292747 http://www.s PHYSPROP
    22202 albuterol OCc1cc(ccc1O 151 1999 http://www.s PHYSPROP
    22203 albendazole O=C(OC)Nc1nc 209 1998 http://www.s PHYSPROP
    22204 alachlor ClCC(=O)N(CO 40 1994 http://www.s PHYSPROP
    22205 aklomide O=C(N)c1ccc(c 172 1991 http://www.s PHYSPROP
    22206 adiphenine CCN(CC)CCOC( 113.5 1953 http://www.s PHYSPROP
    22207 acyclovir NC2=Nc1c(nc 255 1945 http://www.s PHYSPROP
    22208 actarit O=C(C)Nc1ccc 173 1941 http://www.s PHYSPROP
    22209 3,9-acridined CCOc1ccc2nc3 226 1940 http://www.s PHYSPROP
    22210 e-acetamidocaO=C(O)CCCCC 104.5 1928 http://www.s PHYSPROP
    22211 n-acetyltrypt O=C(O)C(NC(C 189.5 1925 http://www.s PHYSPROP
    22212 l-phenylalaninO=C(O)C(NC(C 172 1923 http://www.s PHYSPROP
    22213 acetylphenetuCCC(C(=O)NC( 100.5 1922 http://www.s PHYSPROP
    22214 acetamide, n-CC(=O)NO 90.5 1913 http://www.s PHYSPROP
    22215 acetazoleami O=S(N)(=O)c1 260.5 1909 http://www.s PHYSPROP
    22216 acetaminosaloOc2ccccc2C(= 187 1907 http://www.s PHYSPROP
    22217 acetamide, n-Oc1ccc(NC(C) 170 1906 http://www.s PHYSPROP
    22218 acephate O=C(C)NP(=O) 89 1905 http://www.s PHYSPROP
    22219 acemetacin Clc1ccc(cc1) 151.5 1904 http://www.s PHYSPROP
    22220 acebutolol CC(C)NCC(O)C 121 1901 http://www.s PHYSPROP
    22221 tacrine Nc1c3ccccc3n 183.5 1859 http://www.s PHYSPROP
    22222 calcimycin O=C(O)c1c(NC 181.5 1883 http://www.s PHYSPROP
    22223 8-quinolinol Oc1cccc2cccn 75.5 1847 http://www.s PHYSPROP
    22224 etofylline O=C2c1n(cnc1 158 1820 http://www.s PHYSPROP
    22225 1h-indole-3-e COc1cc2c(cc1 121.5 1767 http://www.s PHYSPROP
    22226 indole, 3-(2- CN(C)CCc2cnc 69.5 1766 http://www.s PHYSPROP
    22227 edoxudine CCC1=CN(C(= 152.5 1748 http://www.s PHYSPROP
    22228 azacitidine NC1=NC(=O)N 229 1739 http://www.s PHYSPROP
    22229 p-nonylphenoOc1ccc(CCCCC 42 1688 http://www.s PHYSPROP
    22230 phenytoin O=C1NC(=O)C( 296.5 1710 http://www.s PHYSPROP
    22231 benzoylhydrazO=C(NN)c1ccc 265 1679 http://www.s PHYSPROP
    22232 benzeneaceticOc1ccc(cc1OC 143.5 1675 http://www.s PHYSPROP
    22233 4-chlororesorcOc1ccc(Cl)c(O 107 1668 http://www.s PHYSPROP
    22234 4-aminopyridiNc1ccncc1 158.5 1664 http://www.s PHYSPROP
    22235 4-aminobenzaNC(=N)c1ccc( 182 1662 http://www.s PHYSPROP
    22236 3-nitropropion[O-][N+](=O) 62 1615 http://www.s PHYSPROP
    22237 adriamycin OCC(=O)C4(O) 230 1628 http://www.s PHYSPROP
    22238 1h-purine-2,6-O=C2NC(=O)N 288 1613 http://www.s PHYSPROP
    22239 3-methylchol Cc2ccc3cc1c5 180 1611 http://www.s PHYSPROP
    22240 benzamide, 3 O=C(N)c1cc(N 115.5 1583 http://www.s PHYSPROP
    22241 amitrole Nc1ncnn1 159 1577 http://www.s PHYSPROP
    22242 mdma hydrochCC(NC)Cc1ccc 150 1556 http://www.s PHYSPROP x salt - AL
    22243 borinic acid, NCCOB(c1cccc 193 1540 http://www.s PHYSPROP
    22244 2-aminofluor Nc1ccc2c3ccc 129 1484 http://www.s PHYSPROP
    22245 2-pyridinaminCc1ccnc(N)c1 100 1479 http://www.s PHYSPROP
    22246 2-amino-2-meCC(N)(CO)CO 110 1477 http://www.s PHYSPROP
    22247 2,4-db Clc1cc(Cl)cc 118 1444 http://www.s PHYSPROP
    22248 2,4-dinitroph O=[N+]([O-])c 114.8 1448 http://www.s PHYSPROP
    22249 2,4-d, methyl Clc1cc(Cl)ccc 119 1443 http://www.s PHYSPROP
    22250 2,4-dichlorop Clc1cc(Cl)ccc 140.5 1441 http://www.s PHYSPROP
    22251 2,4,6-tribrom Brc1cc(Br)cc( 95.5 1438 http://www.s PHYSPROP
    22252 2,4,5-trichlor Clc1cc(OCC(=O 153 1435 http://www.s PHYSPROP
    22253 quinestrol C#CC3(O)CCC 107.5 1407 http://www.s PHYSPROP
    22254 1h-imidazole, Cn1ccnc1 -6 1348 http://www.s PHYSPROP
    22255 mptp CN1CC=C(CC1) 40 1346 http://www.s PHYSPROP
    22256 piperazine, 1 COc1ccccc1N 38.5 1306 http://www.s PHYSPROP
    22257 1,2-dimethylhCNNC -9 1282 http://www.s PHYSPROP
    22258 o-phenanthrolc1ccnc3c1ccc 117 1278 http://www.s PHYSPROP
    22259 1,10-diamino NCCCCCCCCC 62.5 1277 http://www.s PHYSPROP
    22260 5,6,7,8-tetrahCN2CCc1cc5OC 116.5 1269 http://www.s PHYSPROP
    22261 benzeneaceticCC(O)(C(=O)O) 116.5 1263 http://www.s PHYSPROP
    22262 naprosyn O=C(O)C(C)c1 153 1262 http://www.s PHYSPROP
    22263 benzeneaceticOC(C(=O)O)c1 134 1253 http://www.s PHYSPROP
    22264 dl-mandelic acOC(C(=O)O)c1 122 1253 http://www.s PHYSPROP
    22265 a-hydroxyphenOC(C(=O)O)c1 119 1253 http://www.s PHYSPROP
    22266 benzeneaceticOC(C(=O)O)c1 119 1253 http://www.s PHYSPROP
    22267 scopolamine nOCC(c1ccccc1 80 1220 http://www.s PHYSPROP
    22268 (+)-isomenthoO[C@@H]1[C@ 79.5 40990 http://www.s PHYSPROP
    22269 menthol (l) O[C@H]1[C@H 43 15803 http://www.s PHYSPROP
    22270 cyclohexanol, CC(C)C1CCC(C 38 1216 http://www.s PHYSPROP
    22271 menthol CC(C)C1CCC(C 35 1216 http://www.s PHYSPROP
    22272 dizocilpine CC42NC(Cc1cc 68.75 1170 http://www.s PHYSPROP
    22273 methamphetam
    CC(NC)Cc1ccc 172.5 1169 http://www.s PHYSPROP x salt - AL
    22274 cianidanol Oc1ccc(cc1O) 214 1166 http://www.s PHYSPROP
    22275 urea NC(N)=O 132.7 1143 http://www.s PHYSPROP
    22276 uridine O=C1NC(=O)N 165 1144 http://www.s PHYSPROP
    22277 uracil O=C1C=CNC(= 338 1141 http://www.s PHYSPROP
    22278 trimethylaminCN(C)C -117.08 1114 http://www.s PHYSPROP
    22279 tryptamine NCCc2cnc1ccc 118 1118 http://www.s PHYSPROP
    22280 trehalose OC1C(OC(CO) 203 1111 http://www.s PHYSPROP
    22281 toluene Cc1ccccc1 -94.9 1108 http://www.s PHYSPROP
    22282 5-methyluraciCC1=CNC(=O) 316 1103 http://www.s PHYSPROP
    22283 thymidine CC1=CN(C(=O 186.5 1102 http://www.s PHYSPROP
    22284 mercaptoacetiO=C(O)CS -16.5 1101 http://www.s PHYSPROP
    22285 tetrahydrothi C1CCCS1 -96.1 1095 http://www.s PHYSPROP
    22286 taurine NCCS(=O)(=O) 328 1091 http://www.s PHYSPROP
    22287 sulfur dioxide O=S=O -72 1087 http://www.s PHYSPROP
    22288 sulfuric acid O=S(=O)(O)O 10.31 1086 http://www.s PHYSPROP
    22289 sucrose OC1C(OC(CO) 185.5 1083 http://www.s PHYSPROP
    22290 butanedioc acO=C(O)CCC(= 188 1078 http://www.s PHYSPROP
    22291 1,4-butanediam
    NCCCNCCCCN 301.5 1072 http://www.s PHYSPROP x salt JCB
    22292 spermine NCCCNCCCCN 29 1072 http://www.s PHYSPROP
    22293 l-sorbose OC(C(=O)CO)C 165 1070 http://www.s PHYSPROP
    22294 1,4-butanediaNCCCNCCCCN 258 1071 http://www.s PHYSPROP x salt JCB
    22295 shikimic acid OC1CC(=CC(O 186 1063 http://www.s PHYSPROP
    22296 l-cysteine, s- OC(=O)C(N)CS 206 1050 http://www.s PHYSPROP
    22297 dimethylsulfi CSC -98.3 1039 http://www.s PHYSPROP
    22298 quinolinic aci OC(=O)c1nccc 228.5 1037 http://www.s PHYSPROP
    22299 quinine salicy COc1cc2c(cc1 195 84989 http://www.s PHYSPROP x clearly out of range
    22300 quinine COc1cc2c(cc1 57 84989 http://www.s PHYSPROP x clearly out of range
    22301 quinic acid OC1(CC(O)C(O 162.5 1035 http://www.s PHYSPROP
    22302 pyruvic acid CC(=O)C(=O)O 13.8 1031 http://www.s PHYSPROP
    22303 pyridoxine Oc1c(CO)c(cn 160.5 1025 http://www.s PHYSPROP
    22304 pyridoxal-5-p Oc1c(C=O)c(c 255 1022 http://www.s PHYSPROP
    22305 pyridoxal Oc1c(C=O)c(c 165 1021 http://www.s PHYSPROP
    22306 pyridine c1ccccn1 -41.6 1020 http://www.s PHYSPROP
    22307 pyrazole c1ccnn1 68 1019 http://www.s PHYSPROP
    22308 2-pyrazineca NC(=O)c1cncc 192 1017 http://www.s PHYSPROP
    22309 1h-purine c1ncnc2ncnc1 216.5 1015 http://www.s PHYSPROP
    22310 propionic acidCCC(=O)O -21.1 1005 http://www.s PHYSPROP
    22311 pteridine n1ccnc2ncncc 139.5 1014 http://www.s PHYSPROP
    22312 1-propanol CCCO -126.1 1004 http://www.s PHYSPROP
    22313 pregnenoloneCC(=O)C1CCC 192 1000 http://www.s PHYSPROP
    22314 pyrophosphoriO=P(O)(O)OP( 61 996 http://www.s PHYSPROP
    22315 picolinic acid O=C(O)c1cccc 136.5 993 http://www.s PHYSPROP
    22316 phosphorylet O=P(O)(O)OC 242 990 http://www.s PHYSPROP
    22317 phosphoric acO=P(O)(O)O 42.35 979 http://www.s PHYSPROP
    22318 phenylethanoOC(CN)c1cccc 56.5 975 http://www.s PHYSPROP
    22319 phenol Oc1ccccc1 40.9 971 http://www.s PHYSPROP
    22320 phenanthrenec2cc3ccc1cccc 99.24 970 http://www.s PHYSPROP
    22321 ribose OC1C(CO)OC( 95 968 http://www.s PHYSPROP
    22322 pentachlorop Clc1c(O)c(Cl)c 174 967 http://www.s PHYSPROP
    22323 pantolactone O=C1OCC(C)( 92 964 http://www.s PHYSPROP
    22324 palmitic acid O=C(O)CCCCC 61.8 960 http://www.s PHYSPROP
    22325 hexadecanal CCCCCCCCCCC 35 959 http://www.s PHYSPROP
    22326 4-nitrophenolO=[N+]([O-])c 113.8 955 http://www.s PHYSPROP
    22327 4-aminobenzoiOC(=O)c1ccc( 188.5 953 http://www.s PHYSPROP
    22328 oxalic acid di O=C(O)C(=O) 101.5 946 http://www.s PHYSPROP
    22329 orotic acid OC(=O)C1=CC 345.5 942 http://www.s PHYSPROP
    22330 orotic acid m OC(=O)C1=CC 334 942 http://www.s PHYSPROP
    22331 water O 0 937 http://www.s PHYSPROP
    22332 1-octanol CCCCCCCCO -15.5 932 http://www.s PHYSPROP
    22333 n,n-dimethylan
    CN(C)c1ccccc1 2.5 924 http://www.s PHYSPROP
    22334 nitrous oxide [O-][N+]#N -90.81 923 http://www.s PHYSPROP
    22335 nitrogen oxid N=O -163.6 920 http://www.s PHYSPROP
    22336 nitric acid [O-][N+](=O)O -41.59 919 http://www.s PHYSPROP
    22337 nicotine CN2CCCC2c1c -79 917 http://www.s PHYSPROP
    22338 nicotinic acid O=C(O)c1cccn 236.6 913 http://www.s PHYSPROP
    22339 nicotinamide NC(=O)c1cccn 130 911 http://www.s PHYSPROP
    22340 naringenine Oc1ccc(cc1)C 251 907 http://www.s PHYSPROP
    22341 naphthalene c1cccc2ccccc1 80.2 906 http://www.s PHYSPROP
    22342 halostachine OC(CNC)c1ccc 44 889 http://www.s PHYSPROP
    22343 acetanilide O=C(C)Nc1ccc 114.3 880 http://www.s PHYSPROP
    22344 melatonin CC(=O)NCCc2c 117 872 http://www.s PHYSPROP
    22345 d-inositol OC1C(O)C(O)C 249.5 868 http://www.s PHYSPROP
    22346 methanol CO -97.6 864 http://www.s PHYSPROP
    22347 glycidylaldeh O=CC(C)=O -62 857 http://www.s PHYSPROP
    22348 methanethiol CS -123 855 http://www.s PHYSPROP
    22349 dl-tartaric aci O=C(O)C(O)C( 206 852 http://www.s PHYSPROP
    22350 d-tartaric acidO=C(O)C(O)C( 172.5 852 http://www.s PHYSPROP
    22351 tartaric acid O=C(O)C(O)C( 169 852 http://www.s PHYSPROP
    22352 meso-tartaric O=C(O)C(O)C( 147 852 http://www.s PHYSPROP
    22353 gentiobiose OC2C(COC1OC 86 849 http://www.s PHYSPROP
    22354 dl-lysine NC(CCCCN)C( 224 843 http://www.s PHYSPROP
    22355 thioctic acid O=C(O)CCCCC 47.75 841 http://www.s PHYSPROP
    22356 1,2-dithiolaneO=C(O)CCCCC 60.5 841 http://www.s PHYSPROP
    22357 lipoamide NC(=O)CCCCC 128 840 http://www.s PHYSPROP
    22358 leucine CC(C)CC(N)C( 293 834 http://www.s PHYSPROP
    22359 leucine CC(C)CC(N)C( 293 834 http://www.s PHYSPROP
    22360 d-leucine CC(C)CC(N)C( 293 834 http://www.s PHYSPROP
    22361 lanosta-8,24-dC/C(C)=CCCC( 140.5 833 http://www.s PHYSPROP
    22362 d-lyxose OC(C=O)C(O)C 106.5 831 http://www.s PHYSPROP
    22363 d-xylose OC(C=O)C(O)C 90.5 831 http://www.s PHYSPROP
    22364 thyroxine O=C(O)C(N)Cc2c 235.5 830 http://www.s PHYSPROP
    22365 2-piperidinecaO=C(O)C1CCC 264 826 http://www.s PHYSPROP
    22366 quinovose OC1C(O)C(C)O 139.5 817 http://www.s PHYSPROP
    22367 racepinephrinOc1ccc(cc1O) 211.5 815 http://www.s PHYSPROP
    22368 epinephrine Oc1ccc(cc1O) 211.5 815 http://www.s PHYSPROP
    22369 l-ornithine, n NC(CCCNC(N) 235.5 810 http://www.s PHYSPROP
    22370 ribitol OC(CO)C(O)C( 104 804 http://www.s PHYSPROP
    22371 arabitol OC(CO)C(O)C( 103 804 http://www.s PHYSPROP
    22372 xylitol OC(CO)C(O)C( 93.5 804 http://www.s PHYSPROP
    22373 hydroxyprolinO=C(O)C1CC( 274 802 http://www.s PHYSPROP
    22374 norvaline CCCC(N)C(=O) 307 801 http://www.s PHYSPROP
    22375 dl-norvaline CCCC(N)C(=O) 303 801 http://www.s PHYSPROP
    22376 butanedioic a O=C(O)C(=C)C 175 789 http://www.s PHYSPROP
    22377 iodine II 113.6 785 http://www.s PHYSPROP
    22378 indole-3-acetiO=C(O)Cc2cnc 168.5 780 http://www.s PHYSPROP
    22379 indole c1cccc2nccc1 52.5 776 http://www.s PHYSPROP
    22380 imidazole c1cncn1 90.5 773 http://www.s PHYSPROP
    22381 hydroxylamin NO 33 766 http://www.s PHYSPROP
    22382 hydrogen peroOO -0.43 763 http://www.s PHYSPROP
    22383 hydroquinoneOc1ccc(O)cc1 170.5 764 http://www.s PHYSPROP
    22384 homocysteineO=C(O)C(N)CC 232.5 757 http://www.s PHYSPROP
    22385 benzeneaceticOc1ccc(O)cc1 153 759 http://www.s PHYSPROP
    22386 butyric acid, O=C(O)C(N)CC 220 757 http://www.s PHYSPROP
    22387 1h-imidazole-NCCc1cncn1 86 753 http://www.s PHYSPROP
    22388 toxopyrimidinNc1nc(C)ncc1 198 756 http://www.s PHYSPROP
    22389 hydrocyanic aC#N -13.4 748 http://www.s PHYSPROP
    22390 glyoxylic acid O=CC(=O)O 98 740 http://www.s PHYSPROP
    22391 hydroxyaceticO=C(O)CO 79.5 737 http://www.s PHYSPROP
    22392 glycolaldehydO=CCO 97 736 http://www.s PHYSPROP
    22393 glycocholic acO=C(O)CNC(=O 166.5 735 http://www.s PHYSPROP
    22394 glycerophosphO=P(O)(O)OC -25 734 http://www.s PHYSPROP
    22395 glycerol OCC(O)CO 18.2 733 http://www.s PHYSPROP
    22396 propanal, 2,3-O=CC(O)CO 145 731 http://www.s PHYSPROP
    22397 glyceraldehydO=CC(O)CO 145 731 http://www.s PHYSPROP
    22398 glutathione O=C(NCC(=O)O 195 725 http://www.s PHYSPROP
    22399 pentanedioc aO=C(O)CCCC( 97.8 723 http://www.s PHYSPROP
    22400 formamide NC=O 2.55 693 http://www.s PHYSPROP
    22401 formaldehydeO=C -92 692 http://www.s PHYSPROP
    22402 ethanol CCO -114.1 682 http://www.s PHYSPROP
    22403 1,2-benzenediOc1ccc(CCN)c 219 661 http://www.s PHYSPROP x salt JCB
    22404 dopamine Oc1ccc(CCN)c 128 661 http://www.s PHYSPROP
    22405 dimethyl sulfoCS(C)=O 18.5 659 http://www.s PHYSPROP
    22406 5,6-dimethylbCc1cc2ncnc2c 205.5 655 http://www.s PHYSPROP
    22407 dimethylaminCNC -92.2 654 http://www.s PHYSPROP
    22408 n,n-dimethylgCN(C)CC(=O)O 185.5 653 http://www.s PHYSPROP
    22409 dihydroxy aceOCC(=O)CO 90 650 http://www.s PHYSPROP
    22410 2h-1-benzopyrO=C1CCc2ccc 25 640 http://www.s PHYSPROP
    22411 2,3-butanedioCC(=O)C(C)=O -1.2 630 http://www.s PHYSPROP
    22412 desthiobiotin O=C(O)CCCCC 157 623 http://www.s PHYSPROP
    22413 uridine, 2'-de O=C1NC(=O)N 163 620 http://www.s PHYSPROP
    22414 dl-proline O=C(O)C1CCC 205 594 http://www.s PHYSPROP
    22415 d-lactic acid O=C(O)C(C)O 52.8 592 http://www.s PHYSPROP
    22416 l-lactic acid O=C(O)C(C)O 53 592 http://www.s PHYSPROP
    22417 a-hydroxypropO=C(O)C(C)O 18 592 http://www.s PHYSPROP
    22418 lactic acid O=C(O)C(C)O 16.8 592 http://www.s PHYSPROP
    22419 d-glutamic aciOC(=O)CCC(N) 201 591 http://www.s PHYSPROP
    22420 glucaric acid OC(C(O)C(O)C 125.5 587 http://www.s PHYSPROP
    22421 d-gluconic aci OC(C(O)C(=O) 131 584 http://www.s PHYSPROP
    22422 d-alanine CC(N)C(=O)O 292 582 http://www.s PHYSPROP
    22423 cytarabine hy NC1=NC(=O)N 197.5 576 http://www.s PHYSPROP x salt - AL
    22424 cytarabine NC1=NC(=O)N 212.5 576 http://www.s PHYSPROP x salt - AL
    22425 dibenzofuran c1cccc2oc3cc 86.5 551 http://www.s PHYSPROP
    22426 l-cysteine, n-aCC(=O)NC(CS) 109.5 561 http://www.s PHYSPROP
    22427 6-aminohexano
    NCCCCCC(=O) 205 548 http://www.s PHYSPROP
    22428 3,4-dihydroxyOc1ccc(CC(=O 128.5 532 http://www.s PHYSPROP
    22429 phosphonoacet
    O=C(O)CP(=O) 144.5 531 http://www.s PHYSPROP
    22430 4-nitrobenzal O=[N+]([O-])c 107 526 http://www.s PHYSPROP
    22431 cyanic acid N#CO -86 525 http://www.s PHYSPROP
    22432 propionaldeh CCC=O -80 512 http://www.s PHYSPROP
    22433 malic acid O=C(O)C(O)CC 131 510 http://www.s PHYSPROP
    22434 l-proline, 5-oxO=C(O)C1CCC 184.7 485 http://www.s PHYSPROP
    22435 hippuric acid O=C(NCC(=O)O 191.5 451 http://www.s PHYSPROP
    22436 2-methoxypheOc1ccccc1OC 32 447 http://www.s PHYSPROP
    22437 octanal CCCCCCCC=O -23 441 http://www.s PHYSPROP
    22438 galactitol OC(C(O)CO)C( 189.5 440 http://www.s PHYSPROP
    22439 mannitol OC(C(O)CO)C( 168 440 http://www.s PHYSPROP
    22440 mannitol OC(C(O)CO)C( 168 440 http://www.s PHYSPROP
    22441 sorbitol OC(C(O)CO)C( 111 440 http://www.s PHYSPROP
    22442 a-estradiol Oc3cc4CCC2C( 221.5 437 http://www.s PHYSPROP
    22443 estradiol Oc3cc4CCC2C( 178.5 437 http://www.s PHYSPROP
    22444 m-chlorobenzo
    OC(=O)c1cc(Cl 158 434 http://www.s PHYSPROP
    22445 3-hydroxybutyO=C(O)CC(C)O 49 428 http://www.s PHYSPROP
    22446 b-hydroxybutyO=C(O)CC(C)O 46 428 http://www.s PHYSPROP
    22447 dl-aspartic aciO=C(O)CC(N)C 275 411 http://www.s PHYSPROP
    22448 aspartic acid O=C(O)CC(N)C 270 411 http://www.s PHYSPROP
    22449 2-pyrrolidinonCN2C(=O)CCC2 41 395 http://www.s PHYSPROP
    22450 phenol, 4-amiNc1ccc(O)cc1 187.5 392 http://www.s PHYSPROP
    22451 hydrogen sulf S -85.49 391 http://www.s PHYSPROP
    22452 3-isoxazolidin NC1CONC1=O 139.5 390 http://www.s PHYSPROP
    22453 2-nitropropanCC(C)[N+]([O- -91.3 387 http://www.s PHYSPROP
    22454 ornithine NCCCC(N)C(= 140 380 http://www.s PHYSPROP
    22455 pimelic acid O=C(O)CCCCC 106 376 http://www.s PHYSPROP
    22456 1,3,5-trihydr Oc1cc(O)cc(O) 218.5 352 http://www.s PHYSPROP
    22457 octanoic acid O=C(O)CCCCC 16.3 370 http://www.s PHYSPROP
    22458 octane CCCCCCCC -56.8 349 http://www.s PHYSPROP
    22459 arbutin Oc1ccc(cc1)O 199.5 339 http://www.s PHYSPROP
    22460 1,2-benzenediCc1cccc(O)c1 68 333 http://www.s PHYSPROP
    22461 salicylic acid OC(=O)c1cccc 159 331 http://www.s PHYSPROP
    22462 cytidine mon O=P(O)(O)OC 233 308 http://www.s PHYSPROP
    22463 citric acid OC(=O)CC(O)( 153 305 http://www.s PHYSPROP
    22464 epicholestrol CC(C)CCCC(C) 141.5 298 http://www.s PHYSPROP
    22465 cholic acid O=C(O)CCC(C) 198 297 http://www.s PHYSPROP
    22466 chlorohydroq Oc1cc(Cl)c(O) 108 295 http://www.s PHYSPROP
    22467 methane C -182.4 291 http://www.s PHYSPROP
    22468 chlorampheniO=[N+]([O-])c 150.5 292 http://www.s PHYSPROP
    22469 lactose OC2C(OC1OC( 201.5 5904 http://www.s PHYSPROP
    22470 maltose OC2C(OC1OC( 102.5 6019 http://www.s PHYSPROP
    22471 .beta.-d-glucoOC2C(OC1OC( 254 5904 http://www.s PHYSPROP
    22472 formic acid O=CO 8.3 278 http://www.s PHYSPROP
    22473 carbon dioxid O=C=O -56.5 274 http://www.s PHYSPROP
    22474 carbon monox[C-]#[O+] -205 275 http://www.s PHYSPROP
    22475 canavanine N=C(N)NOCCC 184 269 http://www.s PHYSPROP
    22476 cyclic amp Nc4ncnc3c4n 219.5 268 http://www.s PHYSPROP
    22477 butyric acid CCCC(=O)O -7.9 259 http://www.s PHYSPROP
    22478 1-butanol CCCCO -89.8 258 http://www.s PHYSPROP
    22479 butyraldehyd CCCC=O -99 256 http://www.s PHYSPROP
    22480 bis(4-nitroph OP(=O)(Oc1ccc 173.5 250 http://www.s PHYSPROP
    22481 benzene c1ccccc1 5.5 236 http://www.s PHYSPROP
    22482 benzoic acid O=C(O)c1cccc 122.4 238 http://www.s PHYSPROP
    22483 benzaldehydeO=Cc1ccccc1 -26 235 http://www.s PHYSPROP x repeating value clearly out of range cc
    22484 asparagine NC(=O)CC(N)C 234.5 231 http://www.s PHYSPROP
    22485 d-arginine, m NC(CCCNC(=N 217 227 http://www.s PHYSPROP x salt - AL
    22486 arginine hydroNC(CCCNC(=N 219 227 http://www.s PHYSPROP x salt - AL
    22487 l-arabinose OC1C(O)COC( 158 224 http://www.s PHYSPROP
    22488 2-aminobenzoiOC(=O)c1cccc 145 222 http://www.s PHYSPROP
    22489 androsterone O=C2CCC1C3C 185 220 http://www.s PHYSPROP
    22490 epiandrosteroO=C2CCC1C3C 178 220 http://www.s PHYSPROP
    22491 ammonia N -77.7 217 http://www.s PHYSPROP
    22492 alpha-ribazoleCc1cc2ncn(c2 198.5 206 http://www.s PHYSPROP
    22493 galactose OC1C(O)C(CO 170 201 http://www.s PHYSPROP
    22494 alpha-d-glucoOC1C(O)C(CO 146 201 http://www.s PHYSPROP
    22495 d-allose OC1C(O)C(CO 128 201 http://www.s PHYSPROP
    22496 d-altrose OC1C(O)C(CO 103.5 201 http://www.s PHYSPROP
    22497 glucose OC1C(O)C(CO 83 201 http://www.s PHYSPROP
    22498 allantoin O=C1NC(=O)N 238 199 http://www.s PHYSPROP
    22499 hexanedioic aOC(=O)CCCCC 153.2 191 http://www.s PHYSPROP
    22500 9h-purin-6-amiNc3ncnc2c3n 257.25 186 http://www.s PHYSPROP
    22501 adenosine Nc3ncnc1c3n 235.5 186 http://www.s PHYSPROP
    22502 n-acetylgluta O=C(C)NC(CCC 199 180 http://www.s PHYSPROP
    22503 acetone CC(C)=O -94.8 175 http://www.s PHYSPROP
    22504 acetamide CC(N)=O 81 173 http://www.s PHYSPROP
    22505 methylformamCC(N)=O -3.8 173 http://www.s PHYSPROP x Vast majority of literature values support
    22506 acetaldehyde CC=O -123.37 172 http://www.s PHYSPROP
    22507 acetic acid CC(=O)O 16.6 171 http://www.s PHYSPROP
    22508 cholesta-5,7-dCC(C)CCCC(C) 150.5 167 http://www.s PHYSPROP
    22509 5-hydroxytrypO=C(O)C(N)Cc 299 141 http://www.s PHYSPROP
    22510 p-hydroxybenzOC(=O)c1ccc( 214.5 132 http://www.s PHYSPROP
    22511 p-hydroxyphen
    Oc1ccc(CC(=O 152 124 http://www.s PHYSPROP
    22512 4-hydroxybenO=Cc1ccc(O)c 117 123 http://www.s PHYSPROP
    22513 p-hydroxybenzOCc1ccc(O)cc 124.5 122 http://www.s PHYSPROP
    22514 3-pyridineacetOC(=O)Cc1ccc 144 106 http://www.s PHYSPROP
    22515 m-hydroxybenz
    OCc1cc(O)ccc 73 100 http://www.s PHYSPROP
    22516 acetoacetic acCC(=O)CC(=O) 36.5 94 http://www.s PHYSPROP
    22517 3-cyanopyridi N#Cc1cccnc1 51 78 http://www.s PHYSPROP
    22518 prasterone O=C2CCC1C3C 140.5 75 http://www.s PHYSPROP
    22519 2,5-dichlorop Clc1ccc(Cl)c(O 59 65 http://www.s PHYSPROP
    22520 butanoic acid,CCC(=O)C(=O) 33 57 http://www.s PHYSPROP
    22521 pentanedioic aOC(=O)C(=O)C 115.5 50 http://www.s PHYSPROP
    22522 2-keto-l-gulonOC(C(=O)C(=O 171 49 http://www.s PHYSPROP
    22523 butanoic acid,CC(C)C(=O)C( 31.5 48 http://www.s PHYSPROP
    22524 tartronic acid O=C(O)C(O)C( 157 44 http://www.s PHYSPROP
    22525 2,3-dihydroxyOc1c(cccc1O) 204 18 http://www.s PHYSPROP
    22526 androstan-3-oO=C3CC4CCC2 181 14 http://www.s PHYSPROP
    22527 1-amino-2-pr CC(O)CN 25 3 http://www.s PHYSPROP x mp listed is that of (2S) or (2R)-1-amino-2
    22528 inositol monoOP(=O)(O)OC1 195 8 http://www.s PHYSPROP
    22529 feprazone C/C(C)=CCC2C 156.5 32612 http://www.s PHYSPROP
    22530 cafaminol OCCN(C)c2nc1 105 32824 http://www.s PHYSPROP
    22531 8-nonynoic acO=C(O)CCCCC 19 32836 http://www.s PHYSPROP
    22532 isocarbamid O=C1NCCN1C( 95.5 32837 http://www.s PHYSPROP
    22533 benzaldehyde,Clc1cc(C=O)cc 65 32882 http://www.s PHYSPROP
    22534 flubendazole Fc1ccc(cc1)C 260 32932 http://www.s PHYSPROP
    22535 cyclobendazolO=C(OC)Nc1nc 250.5 32933 http://www.s PHYSPROP
    22536 9h-fluoren-9-o[O-][N+](=O)c 293.5 32970 http://www.s PHYSPROP
    22537 8-nonenoic acO=C(O)CCCCC 5 32985 http://www.s PHYSPROP
    22538 pirprofen O=C(O)C(C)c1 99 33051 http://www.s PHYSPROP
    22539 morclofone Clc1ccc(cc1) 91.5 33063 http://www.s PHYSPROP
    22540 cyclohexanol, O=C(C)OC1CCC -50 33188 http://www.s PHYSPROP
    22541 naphthalene, 2CCC1Cc2ccccc -42.8 33214 http://www.s PHYSPROP
    22542 de 71 Brc2cc(Oc1ccc -5 33255 http://www.s PHYSPROP
    22543 benzene, 1,1'-Brc2c(Oc1cc(Br 200 33256 http://www.s PHYSPROP
    22544 saytex bt 93 O=C4c1c(Br)c( 445 33278 http://www.s PHYSPROP
    22545 2,3',4',5-tetr Clc1ccc(cc1Cl) 106 33280 http://www.s PHYSPROP
    22546 1h-indole, 2,3[O-][N+](=O) 93 33305 http://www.s PHYSPROP
    22547 procymidone Clc1cc(cc(Cl) 166 33326 http://www.s PHYSPROP
    22548 chlomethoxyniClc2cc(Cl)ccc 113.5 33334 http://www.s PHYSPROP
    22549 propanenitrileClc2nc(NC1CC 170 33358 http://www.s PHYSPROP
    22550 1h-imidazole-5CC(c1ccccc1) 67 33418 http://www.s PHYSPROP
    22551 hc blue no. 2 OCCN(CCO)c1c 95.5 33439 http://www.s PHYSPROP
    22552 fluchloralin [O-][N+](=O)c 42 33448 http://www.s PHYSPROP
    22553 fluothiuron Clc1cc(ccc1SC 113.5 33526 http://www.s PHYSPROP
    22554 butralin [O-][N+](=O)c 60 33600 http://www.s PHYSPROP
    22555 acesulfame CC1=CC(=O)NS 123.25 33607 http://www.s PHYSPROP
    22556 terbumeton COc1nc(NCC)n 123.5 33617 http://www.s PHYSPROP
    22557 3,5-dichloroanClc1cc(OC)cc(C 41 33621 http://www.s PHYSPROP
    22558 2,3,7-trichlor Clc1cc2Oc3ccc 162 33643 http://www.s PHYSPROP
    22559 isoproturon O=C(Nc1ccc(cc 158 33695 http://www.s PHYSPROP
    22560 acebutolol hy [Cl-].O=C(Nc1 142 33788 http://www.s PHYSPROP x salt
    22561 orbencarb Clc1ccccc1CS 9 33829 http://www.s PHYSPROP
    22562 propanoic acidCC(O)C(=O)O 41 34041 http://www.s PHYSPROP
    22563 diflubenzuronClc2ccc(NC(=O 239 34065 http://www.s PHYSPROP
    22564 sulprofos CSc1ccc(OP(= -15 34067 http://www.s PHYSPROP
    22565 1,10-decanediOCCCCCCCCC 74 34095 http://www.s PHYSPROP
    22566 imazalil base Clc2ccc(C(OCC 52.7 34116 http://www.s PHYSPROP
    22567 2-amino-4,6-dCc1c(cc(cc1N) 174.5 34123 http://www.s PHYSPROP
    22568 1-chlorodibenClc2cccc1Oc3 104.5 34148 http://www.s PHYSPROP
    22569 acetamide, n-O=C(C)Nc1ccc 207 34195 http://www.s PHYSPROP
    22570 1,2,3,4,6,7,8 Clc2cc1Oc3c(Cl 264 34207 http://www.s PHYSPROP
    22571 heptachlorodiClc2cc1Oc3c(Cl 264 34207 http://www.s PHYSPROP
    22572 muldamine CC1CCC(NC1)C 210.5 34280 http://www.s PHYSPROP
    22573 camazepam CN(C)C(=O)OC 173.5 34285 http://www.s PHYSPROP
    22574 2-propanol, 1 CN(C)CC(C)O 124 34412 http://www.s PHYSPROP x took bp instead of mp JCB
    22575 rovral (iprodi O=C2CN(C(=O)N 136 34418 http://www.s PHYSPROP
    22576 4-piperidinamiNC1CC(C)(C)N 17 34423 http://www.s PHYSPROP
    22577 pyridine, 4-et CCc1cc(C)nc(C 97 34470 http://www.s PHYSPROP
    22578 isoquinoline-6Oc1cc2CN(C)C 255 34632 http://www.s PHYSPROP
    22579 iopronic acid O=C(O)C(CC)CO 130 34680 http://www.s PHYSPROP
    22580 acetamide, 2,2ClC(Cl)C(=O) 5.5 34686 http://www.s PHYSPROP
    22581 perfluidone O=S(=O)(c1ccc 143 34724 http://www.s PHYSPROP
    22582 benzoic acid, OC(=O)c1cc(N) 188 34733 http://www.s PHYSPROP
    22583 fluorescamineO=C4OC1(OC=C 154.5 34768 http://www.s PHYSPROP
    22584 etrimfos CCc1nc(OCC)c -3.35 34830 http://www.s PHYSPROP
    22585 naphthalene, c1ccc3ccccc3c 59.5 34905 http://www.s PHYSPROP
    22586 antor ClCC(=O)N(CC 49.5 34920 http://www.s PHYSPROP
    22587 2,8-dichlorod Clc1ccc2Oc3cc 151 35013 http://www.s PHYSPROP
    22588 2,7-dichlorod Clc1ccc2Oc3cc 209 35013 http://www.s PHYSPROP
    22589 dibenzofuran,Clc3cc1c(oc2c1 233 35019 http://www.s PHYSPROP
    22590 octachlorodibClc1c2oc3c(c2c 258 35020 http://www.s PHYSPROP
    22591 2,7-dibromodiBrc1ccc2Oc3c 193 35032 http://www.s PHYSPROP
    22592 1,2,3,4,7,8-h Clc1cc2Oc3c(Cl 273 35060 http://www.s PHYSPROP
    22593 2-chlorodibenClc1ccc2Oc3c 88 35061 http://www.s PHYSPROP
    22594 1,2,4-trichlor Clc1cc(Cl)c(C 128 35062 http://www.s PHYSPROP
    22595 1,2,3,4,7-pen Clc1ccc2Oc3c(C 195 35063 http://www.s PHYSPROP
    22596 1,2,4,6,7,9-h Clc2cc(Cl)c(Cl 238 35064 http://www.s PHYSPROP
    22597 dimalone O=C(OC)C2C1 38 35099 http://www.s PHYSPROP
    22598 4-hexyloxyaniNc1ccc(OCCCC 44 35159 http://www.s PHYSPROP
    22599 tris(1,3-dichl ClC(OP(=O)(OC 26.7 35184 http://www.s PHYSPROP
    22600 ticrynafen O=C(c1ccc(OCC 149 35204 http://www.s PHYSPROP
    22601 1,2,3,7,8-pen Clc1cc2Oc3cc( 240 35228 http://www.s PHYSPROP
    22602 pendimethali [O-][N+](=O)c 56.5 35265 http://www.s PHYSPROP
    22603 diclofop Clc2cc(Cl)ccc 120 35447 http://www.s PHYSPROP
    22604 4-methoxy-3, Cc1cc(ccc1OC) 62.3 35550 http://www.s PHYSPROP
    22605 metamitron O=C1C(=NN=C( 166.9 35563 http://www.s PHYSPROP
    22606 bupirimate CCNc1nc(C)c( 50.5 35588 http://www.s PHYSPROP
    22607 propanamide,O=C(Nc1c(C)c 256 35632 http://www.s PHYSPROP
    22608 tricyclazole Cc1cccc2sc3n 187 35726 http://www.s PHYSPROP
    22609 bezafibrate O=C(NCCc1ccc( 186 35728 http://www.s PHYSPROP
    22610 methyl 4-chloClc1cc(c(cc1) 44 35805 http://www.s PHYSPROP
    22611 1,3-hexadieneC=CC=CCC -102.4 35840 http://www.s PHYSPROP
    22612 benzaldehyde,O=[N+]([O-])c 167 35874 http://www.s PHYSPROP
    22613 bifenox Clc2cc(Cl)ccc 85 35891 http://www.s PHYSPROP
    22614 daimuron O=C(Nc1ccc(C) 203 35899 http://www.s PHYSPROP
    22615 nitrofluorfen Clc2cc(ccc2Oc 68 35973 http://www.s PHYSPROP
    22616 oxyfluorfen Clc2cc(ccc2Oc 84 35974 http://www.s PHYSPROP
    22617 triadimefon CC(C)(C)C(=O) 82.3 36029 http://www.s PHYSPROP
    22618 fluoridamid O=S(=O)(Nc1cc 176 36084 http://www.s PHYSPROP
    22619 lonidamine O=C(O)c3nn(Cc 207 36170 http://www.s PHYSPROP
    22620 morazone CC4=C(CN1CCO 149.5 36216 http://www.s PHYSPROP
    22621 2,3,6-trichlor Clc1c(OC)c(Cl) 45 36263 http://www.s PHYSPROP
    22622 vinclozolin O=C1N(C(=O)OC 108 36278 http://www.s PHYSPROP
    22623 ipt (isoprothi CC(C)OC(=O)C 54 36283 http://www.s PHYSPROP
    22624 dimethachlor ClCC(=O)N(CC 46 36319 http://www.s PHYSPROP
    22625 2,3-dibromodiBrc1cc2Oc3cc 158 36322 http://www.s PHYSPROP
    22626 2,3-dibromo-7Brc1cc2Oc3cc( 316 36325 http://www.s PHYSPROP
    22627 2,3,7,8-tetra Brc1cc2Oc3cc( 334 36326 http://www.s PHYSPROP
    22628 2,3-dichloro-7Clc1cc2Oc3cc( 223 36327 http://www.s PHYSPROP
    22629 2,3-dibromo-7Brc1cc2Oc3cc( 210 36328 http://www.s PHYSPROP
    22630 1,3,7,8-tetrac Clc1cc2Oc3cc( 194 36329 http://www.s PHYSPROP
    22631 1-chloro-anthClc2cccc1cc3c 83.5 36337 http://www.s PHYSPROP
    22632 butyl nonanoaO=C(CCCCCCC -38 36339 http://www.s PHYSPROP
    22633 acetimidoqui O=C1C=C/C(= 74.5 36356 http://www.s PHYSPROP
    22634 vx CCOP(C)(=O)S -51 36386 http://www.s PHYSPROP
    22635 2,3,7,8-tetra Clc1cc2c3cc(Cl 227 36507 http://www.s PHYSPROP
    22636 hexazinone CN(C)C2=NC(= 116 36542 http://www.s PHYSPROP
    22637 naphthalene,hFC(F)(F)C1(F)C -70 36551 http://www.s PHYSPROP
    22638 diclofop-methClc2cc(Cl)ccc 40 36557 http://www.s PHYSPROP
    22639 vomitoxin CC3=C[C@H]4 152 36584 http://www.s PHYSPROP
    22640 cloethocarb CNC(=O)Oc1cc 80 36591 http://www.s PHYSPROP
    22641 2-ethylanthraCCc1ccc2cc3c 152 36820 http://www.s PHYSPROP
    22642 permethrin Cl/C(Cl)=C/C3 34 36845 http://www.s PHYSPROP
    22643 cyclopropaneca
    Cl/C(Cl)=C/C3 45.5 36845 http://www.s PHYSPROP
    22644 cyclopropaneca
    Cl/C(Cl)=C/C3 64 36845 http://www.s PHYSPROP
    22645 pinazepam Clc1ccc2c(c1 141 36899 http://www.s PHYSPROP
    22646 exifone Oc2ccc(C(=O)c 270 36906 http://www.s PHYSPROP
    22647 naproanilide O=C(Nc1ccccc 128 36918 http://www.s PHYSPROP
    22648 2,2',3,4,4',5' Clc1cc(Cl)c(Cl) 83 36981 http://www.s PHYSPROP
    22649 flamprop-m-isFc1ccc(cc1Cl) 73 37022 http://www.s PHYSPROP
    22650 flamprop-m-isFc1ccc(cc1Cl) 84 37022 http://www.s PHYSPROP
    22651 flamprop-m-mFc1ccc(cc1Cl) 85 37023 http://www.s PHYSPROP
    22652 flamprop-metFc1ccc(cc1Cl) 85 37023 http://www.s PHYSPROP
    22653 trolox c O=C(O)C1(C)CC 189 37117 http://www.s PHYSPROP
    22654 1-tridecanamiCCCCCCCCCCC 27.4 37235 http://www.s PHYSPROP
    22655 benzene, 1,2, Clc1c(OC)c(Cl) 88.5 37243 http://www.s PHYSPROP
    22656 (2,4,5-trichlo Clc1cc(OCC(=O 39 37250 http://www.s PHYSPROP
    22657 flurenol-butylO=C(OCCCC)C3 71 37279 http://www.s PHYSPROP
    22658 ethylene glyco[O-][N+](=O) -22.3 37281 http://www.s PHYSPROP
    22659 mefluidide O=S(=O)(Nc1cc 184 37346 http://www.s PHYSPROP
    22660 suriclone CN1CCN(CC1)C 280 37353 http://www.s PHYSPROP
    22661 1,2,3-trichlo Clc1ccc(OC)c(C 69.5 37440 http://www.s PHYSPROP
    22662 1,2,2,3-tetra BrC(Br)(CBr)C 10.5 37466 http://www.s PHYSPROP
    22663 2-heptanol, 5 CC(CC)CCC(C) -61 37555 http://www.s PHYSPROP
    22664 tetramethylbeCc1cc(cc(C)c1 198 37605 http://www.s PHYSPROP
    22665 1,4-dioxacycl O=C1CCCCCCC 18 37664 http://www.s PHYSPROP
    22666 triadimenol (dCC(C)(C)C(O)C 133.5 37749 http://www.s PHYSPROP
    22667 triadimenol (dCC(C)(C)C(O)C 138.2 37749 http://www.s PHYSPROP
    22668 triadimenol CC(C)(C)C(O)C 135.5 37749 http://www.s PHYSPROP
    22669 ethalfluralin [O-][N+](=O)c 55.5 37761 http://www.s PHYSPROP
    22670 dimethipin O=S1(=O)CCS( 165 37765 http://www.s PHYSPROP
    22671 triclopyr Clc1cc(Cl)c(C 149 37801 http://www.s PHYSPROP
    22672 pyridate O=C(SCCCCCCC 27 37831 http://www.s PHYSPROP
    22673 mepronil CC(C)Oc1cccc 92.5 37994 http://www.s PHYSPROP
    22674 butibufen CCC(C(=O)O)c1 52 38005 http://www.s PHYSPROP
    22675 isouron O=C(Nc1cc(on1 119.5 38009 http://www.s PHYSPROP
    22676 sufentanil CCC(=O)N(c1c 97 38043 http://www.s PHYSPROP
    22677 sufentanil citrCCC(=O)N(c1c 136.5 38043 http://www.s PHYSPROP
    22678 benzophenone,
    O=[N+]([O-])c 105 38087 http://www.s PHYSPROP
    22679 benzoic acid, Clc1cc(cc(Cl) 291.5 38359 http://www.s PHYSPROP
    22680 1-bromo-2,3- Clc1cccc(Br)c1 60 38364 http://www.s PHYSPROP
    22681 2,3,4,7,8-pen Clc1cc3c(cc1Cl 196 38417 http://www.s PHYSPROP
    22682 dibenzofuran,Clc1cc3c(cc1Cl 202 38423 http://www.s PHYSPROP
    22683 dibenzofuran,Clc3cc2c(oc1c2 164 38424 http://www.s PHYSPROP
    22684 dibenzofuran,Clc1cc3c(cc1Cl 195 38425 http://www.s PHYSPROP
    22685 dibenzofuran,Clc1cc2oc3cc(C 225 38427 http://www.s PHYSPROP
    22686 dibenzofuran,Clc2cc3oc1c(cc 206 38428 http://www.s PHYSPROP
    22687 2-heptadecanCC(O)CCCCCC 54 38542 http://www.s PHYSPROP
    22688 furalaxyl O=C(N(C(C)C( 70 38763 http://www.s PHYSPROP
    22689 1,2,3,6,7,8-h Clc2cc1Oc3c(Oc 285 38799 http://www.s PHYSPROP
    22690 closantel Clc3cc(NC(=O) 217.8 38827 http://www.s PHYSPROP
    22691 1,2-dinitroan [O-][N+](=O)c 341 38849 http://www.s PHYSPROP
    22692 hexachlorodibClc2cc1Oc3c(Cl 250 38919 http://www.s PHYSPROP
    22693 1-naphthaleneN#Cc1ccc(N)c 175.5 39064 http://www.s PHYSPROP
    22694 1,2,4,7,8-pen Clc1cc2Oc3c(C 206 39071 http://www.s PHYSPROP
    22695 1,2,4,7,8-pen Clc1cc2c(cc1Cl 237 39074 http://www.s PHYSPROP
    22696 dibenzofuran,Clc1cc2oc3ccc( 210 39079 http://www.s PHYSPROP
    22697 ofurace O=C2OCCC2N(C 145.5 39084 http://www.s PHYSPROP
    22698 lorcainide CC(C)N1CCC(CC 263 39116 http://www.s PHYSPROP
    22699 hexabromobipBrc2cc(c1cc(Br 72 39145 http://www.s PHYSPROP
    22700 lidofenin O=C(Nc1c(C)c 202 39159 http://www.s PHYSPROP
    22701 laurocapram O=C1CCCCCN1 -7 39176 http://www.s PHYSPROP
    22702 1h-benzotriazC=CCN3CCCC3 139 39202 http://www.s PHYSPROP
    22703 fluridone CN1C=C(C(=O)C 154.5 39255 http://www.s PHYSPROP
    22704 fenarimol OC(c1ccccc1Cl 118 39394 http://www.s PHYSPROP
    22705 clorsulon Nc1cc(c(cc1S( 203 39399 http://www.s PHYSPROP
    22706 benzenemethan
    Clc1cc(CO)cc(C 80.5 39404 http://www.s PHYSPROP
    22707 furmecyclox Cc2cc(C(=O)N 33 39512 http://www.s PHYSPROP
    22708 dibenzofuran,Clc3cc2c(oc1c2 239.5 39644 http://www.s PHYSPROP
    22709 fenapanil N#CC(CCCC)(C 161 39671 http://www.s PHYSPROP
    22710 nitrothal-isop O=[N+]([O-])c 65 39827 http://www.s PHYSPROP
    22711 benzenemethano
    Clc1c(COC(=O) 52 39949 http://www.s PHYSPROP
    22712 benzenemethan
    NCc2ccccc2Sc 97 40019 http://www.s PHYSPROP
    22713 1,3,6,8-tetrac Clc2cc1Oc3cc( 219 40110 http://www.s PHYSPROP
    22714 acifluorfen Clc2cc(ccc2Oc 150 40113 http://www.s PHYSPROP
    22715 dibenzofuran,Clc3cccc2c3oc1 190 40136 http://www.s PHYSPROP
    22716 fenothiocarb CN(C)C(=O)SC 40.5 40198 http://www.s PHYSPROP
    22717 2-methyl-4-phCc1cc(ccc1N)c 43 40311 http://www.s PHYSPROP
    22718 bromethalin CN(c1c(Br)cc(B 150.5 40463 http://www.s PHYSPROP
    22719 ethylamine, 2Cc1ccc(cc1)O 154.7 41247 http://www.s PHYSPROP
    22720 salsoline COc1cc2C(C)N 221.5 42492 http://www.s PHYSPROP
    22721 2-propen-1-ol,CC(=C)COC(=O 201.3 42871 http://www.s PHYSPROP
    22722 nnk (carcinog O=C(CCCN(C)N 63 43038 http://www.s PHYSPROP
    22723 fenpropathrinCC3(C)C(C(=O) 47 43074 http://www.s PHYSPROP
    22724 fenpropathrinCC3(C)C(C(=O) 47 43074 http://www.s PHYSPROP
    22725 dibenzofuran,Clc2cc1oc3cc(C 207 43168 http://www.s PHYSPROP
    22726 triflumuron O=C(NC(=O)Nc1 195 43172 http://www.s PHYSPROP
    22727 chlorsulfuron Cc2nc(NC(=O) 176 43209 http://www.s PHYSPROP
    22728 nicorandil O=C(NCCO[N+] 92.5 43240 http://www.s PHYSPROP
    22729 cyromazine Nc2nc(N)nc(N 224.9 43550 http://www.s PHYSPROP
    22730 flutolanil CC(C)Oc1cccc( 104.5 43579 http://www.s PHYSPROP
    22731 fenoxaprop etO=C(OCC)C(C) 84 43609 http://www.s PHYSPROP
    22732 fenoxaprop-etO=C(OCC)C(C) 90 43609 http://www.s PHYSPROP
    22733 fenoxaprop-etO=C(OCC)C(C) 84.5 43609 http://www.s PHYSPROP
    22734 1,2,3,7-tetrac Clc1cc2Oc3cc( 172 44468 http://www.s PHYSPROP
    22735 pentachlorodiClc2cccc1Oc3c( 220 44469 http://www.s PHYSPROP
    22736 metazachlor O=C(CCl)N(Cn1 85 44885 http://www.s PHYSPROP
    22737 dibenzofuran,Clc3cc2c(oc1c2 219 45248 http://www.s PHYSPROP
    22738 dibenzofuran,Clc1cc2c(cc1)o 178 45283 http://www.s PHYSPROP
    22739 butanesulfonicCCCCS(=O)(=O -15.2 45294 http://www.s PHYSPROP
    22740 hexanesulfoniO=S(=O)(O)CC 16.1 45296 http://www.s PHYSPROP
    22741 proglinazine eClc1nc(NCC(= 110 45451 http://www.s PHYSPROP
    22742 piroctone CC=1C=C(CC(C 108 45575 http://www.s PHYSPROP
    22743 buprofezin CC(C)(C)/N=C 105 45678 http://www.s PHYSPROP
    22744 fluroxypyr O=C(O)COc1nc( 232 45757 http://www.s PHYSPROP
    22745 dis. a. 6 [O-][N+](=O)c 118 45848 http://www.s PHYSPROP
    22746 cyprofuram O=C3OCCC3N(C 95 45860 http://www.s PHYSPROP
    22747 haloxyfop O=C(O)C(C)Oc1 107.5 46140 http://www.s PHYSPROP
    22748 haloxyfop-metO=C(OC)C(C)Oc 56 46141 http://www.s PHYSPROP
    22749 fluazifop-p-buO=C(OCCCC)C(C 5 46142 http://www.s PHYSPROP
    22750 fluazifop - butO=C(OCCCC)C(C 13 46142 http://www.s PHYSPROP
    22751 butyl methox COc1ccc(cc1)C 83.5 46261 http://www.s PHYSPROP
    22752 dibenzofuran,Clc1ccc2c(c1)o 190 46326 http://www.s PHYSPROP
    22753 dibenzofuran,Clc1ccc2oc3c(c 210 46391 http://www.s PHYSPROP
    22754 alfentanil CCC(=O)N(c1c 140.8 46451 http://www.s PHYSPROP
    22755 benalaxyl CC(N(C(=O)Cc1 79 46525 http://www.s PHYSPROP
    22756 dibenzofuran,Clc2cc3oc1c(cc 177 46613 http://www.s PHYSPROP
    22757 fomesafen Clc2cc(ccc2Oc 220 46694 http://www.s PHYSPROP
    22758 chlozolinate CC1(OC(=O)N(C 112.6 46710 http://www.s PHYSPROP
    22759 acifran [usan: CC1(OC(=CC1= 176 46712 http://www.s PHYSPROP
    22760 cupreine Oc1cc2c(cc1) 202 46715 http://www.s PHYSPROP
    22761 fenoxycarb O=C(OCC)NCCO 53 46739 http://www.s PHYSPROP
    22762 fenoxycarb O=C(OCC)NCCO 53.5 46739 http://www.s PHYSPROP
    22763 acetamide, n-(CC(=O)Nc1ccc2 262.5 46753 http://www.s PHYSPROP
    22764 2h-thiopyran, CC1CCCCS1 -58 46843 http://www.s PHYSPROP
    22765 heptane, 3-ethCCC(CC)CCCC -114.9 46880 http://www.s PHYSPROP
    22766 helenalin O=C2C=CC1C(C 167.5 47175 http://www.s PHYSPROP
    22767 9h-fluorene-9NC(=O)C3(CCC 94.5 47194 http://www.s PHYSPROP
    22768 sulfometuron O=C(Nc1nc(C) 202 47881 http://www.s PHYSPROP
    22769 metsulfuron- Cc2nc(NC(=O) 162 47883 http://www.s PHYSPROP
    22770 2,3,4,4',5-penClc1c(cc(Cl)c( 98 47913 http://www.s PHYSPROP
    22771 bromobutide CC(C)(C)C(Br) 180.1 47944 http://www.s PHYSPROP
    22772 2,8-dichlorod Clc1ccc3c(c1) 184 48004 http://www.s PHYSPROP
    22773 piperazine, 1- CN1CCNCC1 -6 48024 http://www.s PHYSPROP
    22774 flupirtine Nc1nc(ccc1NC 115.5 48119 http://www.s PHYSPROP
    22775 diclobutrazol OC(C(Cc1ccc(C 148 48148 http://www.s PHYSPROP
    22776 tecloftalam Clc1c(c(c(Cl)c 198.5 48292 http://www.s PHYSPROP
    22777 quizalofop-p-eO=C(OCC)C(C) 76.5 48336 http://www.s PHYSPROP
    22778 quizalofop-ethO=C(OCC)C(C) 92 48336 http://www.s PHYSPROP
    22779 fluoroglycofenClc2cc(ccc2Oc 65 48457 http://www.s PHYSPROP
    22780 cetamolol CC(C)(C)NCC( 96.5 48483 http://www.s PHYSPROP
    22781 oxadixyl O=C2OCCN2N(C 104 48518 http://www.s PHYSPROP
    22782 br-n(246-meph
    Cc1cc(C)c(Br 199 48922 http://www.s PHYSPROP
    22783 imazapyr CC1(N=C(NC1= 171 49445 http://www.s PHYSPROP
    22784 imazaquin CC1(N=C(NC1= 221 49446 http://www.s PHYSPROP
    22785 imazethapyr CC1(N=C(NC1= 171 49447 http://www.s PHYSPROP
    22786 fluroxypyr-meCC(CCCCCC)OC( 59 49451 http://www.s PHYSPROP
    22787 naphthalene, 5CCc2cccc1CCC -44.5 49459 http://www.s PHYSPROP
    22788 clomazone Clc2ccccc2CN 25 49469 http://www.s PHYSPROP
    22789 bensulfuron-mO=C(Nc1nc(cc 187 49630 http://www.s PHYSPROP
    22790 dibenzofuran,Clc3cccc1c3oc2 177 49760 http://www.s PHYSPROP
    22791 1,3,4,6,8-pen Clc3cc1c(oc2c1 204 49787 http://www.s PHYSPROP
    22792 phosmethylanClc1ccccc1N( 42 49790 http://www.s PHYSPROP
    22793 4'-(trifluorom OC(=O)c2ccccc 170 49895 http://www.s PHYSPROP
    22794 ethanol, 2-[( Nc1ncc2ncn( 189 49900 http://www.s PHYSPROP
    22795 1,6-dibromodiBrc2cccc1Oc3 207 50743 http://www.s PHYSPROP
    22796 1,4-naphthalen
    CC(=O)Oc2c1c 91.5 50751 http://www.s PHYSPROP
    22797 2-phenoxy-butO=C(O)C(CC)O 98 52253 http://www.s PHYSPROP
    22798 2-monoiododiIc1ccc2Oc3cc 95 53024 http://www.s PHYSPROP
    22799 s-phenylmercaO=C(O)CSc1cc 65 53706 http://www.s PHYSPROP
    22800 3,7-dinitroflu [O-][N+](=O)c 203.5 54140 http://www.s PHYSPROP
    22801 2,8-dibromodiBrc1ccc2Oc3c 145 54149 http://www.s PHYSPROP
    22802 2-monobromod
    Brc1ccc2Oc3c 90 54181 http://www.s PHYSPROP
    22803 1-monobromod
    Brc2cccc1Oc3 104 54182 http://www.s PHYSPROP
    22804 aripiprazole Clc4cccc(N3C 139.25 54790 http://www.s PHYSPROP
    22805 pentabromoeBrC(Br)C(Br)(B 56.5 54929 http://www.s PHYSPROP
    22806 p-diisopropy OOC(C)(C)c1cc 33.5 54950 http://www.s PHYSPROP
    22807 n,4-dinitrosomO=NN(C)c1ccc 101 54952 http://www.s PHYSPROP
    22808 hydrazinecarbNC(=O)NNc1cc 172 54963 http://www.s PHYSPROP
    22809 vinyl 2-ethylh C=COCC(CCCC -100 54965 http://www.s PHYSPROP
    22810 2-butanone, 4COc1ccc(CCC( 8 54968 http://www.s PHYSPROP
    22811 benzene, 1,4- O=C=Nc1ccc(c 97.5 54970 http://www.s PHYSPROP
    22812 metaldehyde (CC1OC(C)OC(C 246 54981 http://www.s PHYSPROP
    22813 butanoic acid,CCCCCCCCOC( -55.6 54989 http://www.s PHYSPROP
    22814 1,3-propanedio
    CCCCC(CO)(CO 43.8 54997 http://www.s PHYSPROP
    22815 4-morpholine NCCCN1CCOC -15 55014 http://www.s PHYSPROP
    22816 peroxide, bis( Clc2cc(Cl)ccc 106 55032 http://www.s PHYSPROP
    22817 propanoic acidCCCCCCCCOC( -42.6 55048 http://www.s PHYSPROP
    22818 ethane, 1,1,1,ClC(Cl)(Cl)C(Cl -95.3 55055 http://www.s PHYSPROP
    22819 ethane, 1,1,2,ClC(Cl)C(Cl)(Cl -82.6 55056 http://www.s PHYSPROP
    22820 pentachlorofl ClC(Cl)(Cl)C(Cl 101.3 55058 http://www.s PHYSPROP
    22821 perfluoroisob F/C(F)=C(/C(F) -130 55060 http://www.s PHYSPROP
    22822 3,3-dichloro- ClC(Cl)C(F)(F)C -94 55063 http://www.s PHYSPROP
    22823 hydroxypethidCN1CCC(CC1)( 110 55068 http://www.s PHYSPROP
    22824 bicyclo 3.1.1 CC2(C)C1CC2C 24 55074 http://www.s PHYSPROP
    22825 cis-verbenol CC2(C)C1CC2C 65 55074 http://www.s PHYSPROP
    22826 pyrocatechol, Brc1c(O)c(O)c 191 55075 http://www.s PHYSPROP
    22827 benzoyl azide O=C(/N=N#N)c 32 55080 http://www.s PHYSPROP
    22828 pentanoic acidO=C(CCCC)OC -92.8 55084 http://www.s PHYSPROP
    22829 4-pentenoic aC=CCCC(=O)O -22.5 55085 http://www.s PHYSPROP
    22830 butane, 2-chl CC(C)(Cl)CC -73.5 55090 http://www.s PHYSPROP
    22831 trichloroacet ClC(Cl)(Cl)C(N 142 55091 http://www.s PHYSPROP
    22832 methylnitroa [O-][N+](=O)C 38 55095 http://www.s PHYSPROP
    22833 benzenamine,CCCCN(CCCC)c -32.2 55101 http://www.s PHYSPROP
    22834 o-methoxypheO=C(C)Oc1ccc 31.5 55102 http://www.s PHYSPROP
    22835 1,2,3-propanetO=C(OCC(OC(= 76 55103 http://www.s PHYSPROP
    22836 4-morpholine OCCN1CCOCC -1.6 55110 http://www.s PHYSPROP
    22837 octadecanoic aO=C(CCCCCCC 79 55120 http://www.s PHYSPROP
    22838 peroxide, dietCCOOCC -70 55121 http://www.s PHYSPROP
    22839 formic acid, h O=COCCCCCC -62.6 55123 http://www.s PHYSPROP
    22840 1,1,1,2-tetra BrC(Br)(Br)CBr 0 55125 http://www.s PHYSPROP
    22841 octanoic acid,O=C(CCCCCCC -34.8 55131 http://www.s PHYSPROP
    22842 pentanoyl chl CCCCC(Cl)=O -110 55132 http://www.s PHYSPROP
    22843 benzenamine,O=[N+]([O-])N 47.3 55135 http://www.s PHYSPROP
    22844 diethylene diglO=[N+]([O-]) -11.3 55142 http://www.s PHYSPROP
    22845 2-hydroxy-4- O=Cc1ccc(C)c 60.5 55144 http://www.s PHYSPROP
    22846 triafur Nc1nnc(s1)c2o 280 55149 http://www.s PHYSPROP
    22847 benzene, 1-chlFC(F)(F)c1cc(c 22 55156 http://www.s PHYSPROP
    22848 2,5-bis(1-azir COCCOC=1C(= 80 55158 http://www.s PHYSPROP
    22849 1,5-hexadien-C=CC#CC=C -88 55165 http://www.s PHYSPROP
    22850 allylidenediacC=CC(OC(=O)C -37.6 55168 http://www.s PHYSPROP
    22851 3-nonanone CCCCCCC(=O) -8 55177 http://www.s PHYSPROP
    22852 methylchlorosC[SiH2]Cl -135 55185 http://www.s PHYSPROP
    22853 ammonium steO=C(CCCCCCC 22 55192 http://www.s PHYSPROP
    22854 octyl gallate Oc1cc(cc(O)c 102.5 55194 http://www.s PHYSPROP
    22855 methane, dibrBrC(Br)F -78 55219 http://www.s PHYSPROP
    22856 octanoic acid, CCCCCCCCOC( -18.1 55233 http://www.s PHYSPROP
    22857 5-nitrobenzotr[O-][N+](=O)c 217 55240 http://www.s PHYSPROP
    22858 2-pentadecanCC(=O)CCCCC 39.5 55242 http://www.s PHYSPROP
    22859 dichlorosilaneCl[SiH2]Cl -122 55266 http://www.s PHYSPROP
    22860 1,1,1-trichlor ClC(Cl)(Cl)C(F) -80 55276 http://www.s PHYSPROP
    22861 octanoic acid CCCCCCCOC(= -10.6 55278 http://www.s PHYSPROP
    22862 heptanoic acidO=C(CCCCCC) -50 55341 http://www.s PHYSPROP
    22863 3-(2-ethyl-butOC(=O)CCOCC 32.5 55413 http://www.s PHYSPROP
    22864 3-chloro-(1,1' Oc1c(cccc1Cl) 6 55449 http://www.s PHYSPROP
    22865 bezitramide CCC(=O)N5c1c 147 55675 http://www.s PHYSPROP
    22866 hydantoin, 1- O=C1N(Cl)C(= 163.5 55703 http://www.s PHYSPROP
    22867 dodemorph CC1CN(CC(C) 71 55760 http://www.s PHYSPROP
    22868 pentanedinitrN#CCCC(Br)(C 52 55806 http://www.s PHYSPROP
    22869 tetrabromobisp
    Brc1cc(cc(Br) 119 55823 http://www.s PHYSPROP
    22870 carbamic acid,O=C(NCCCC)O 66 55933 http://www.s PHYSPROP
    22871 1,3-pentadienC=CC=CC -87.4 56020 http://www.s PHYSPROP
    22872 flumetralin Clc2cccc(F)c2 102 56023 http://www.s PHYSPROP
    22873 2-amino-3,4-dCc2cc1ncccc1 297 56075 http://www.s PHYSPROP
    22874 lactofen Clc2cc(ccc2Oc 45 56077 http://www.s PHYSPROP
    22875 benoxacor ClC(Cl)C(=O) 107.6 56101 http://www.s PHYSPROP
    22876 dimethyl diet C[Si](C)(OCC) -87 56117 http://www.s PHYSPROP
    22877 1-buten-3-yneC#CC(=C)C -113 56118 http://www.s PHYSPROP
    22878 propanoyl chl CCC(Cl)=O -94 56119 http://www.s PHYSPROP
    22879 propanoyl chloCC(C)C(Cl)=O -90 56120 http://www.s PHYSPROP
    22880 propanoic aci O=C(O)C(C)S 12 56121 http://www.s PHYSPROP
    22881 5-tert-butyl-2 O=[N+]([O-])c1 110 56123 http://www.s PHYSPROP
    22882 2-t-butylcycloO=C(C)OC1CCC 34.95 56126 http://www.s PHYSPROP
    22883 ethanol, 2-(e CCN(CCO)c1cc 37 56130 http://www.s PHYSPROP
    22884 acridine, 3,6- CN(C)c1cc2nc3 165 56136 http://www.s PHYSPROP
    22885 benzofuran, 4,CC1CCc2occ(C 86 56137 http://www.s PHYSPROP
    22886 4-hydroxy-3-mOc1ccc(cc1OC 115 56139 http://www.s PHYSPROP
    22887 1,3-dichloro- FC(F)(Cl)C(F)(F -97 56144 http://www.s PHYSPROP
    22888 scilliroside CC(=O)OC5CC2 169 56145 http://www.s PHYSPROP
    22889 methanol, (1,3,
    OCN(CO)c1nc( 137 56150 http://www.s PHYSPROP
    22890 benzene, 1-meCc1ccc(cc1)C( -20 56173 http://www.s PHYSPROP
    22891 1h-purin-6-amn2cnc(NCc1cc 234.5 56177 http://www.s PHYSPROP
    22892 bromodifluor BrC(F)F -145 56193 http://www.s PHYSPROP
    22893 propane, 2-is CC(C)(C)/N=C 85.5 56197 http://www.s PHYSPROP
    22894 2-pentanethioCC(S)CCC -169 56209 http://www.s PHYSPROP
    22895 1-naphthalenea
    O=C(OCC)Cc2c 88.5 56212 http://www.s PHYSPROP
    22896 tert-butyldie CC(C)(C)N(CC 42 56213 http://www.s PHYSPROP
    22897 pentanoic acidO=C(CCCC)OC -78.8 56216 http://www.s PHYSPROP
    22898 4-vinylphenol C=Cc1ccc(O)c 73.5 56234 http://www.s PHYSPROP
    22899 phenol, 4-eth Oc1ccc(cc1OC -7 56245 http://www.s PHYSPROP
    22900 ethyl hydropeCCOO -100 56252 http://www.s PHYSPROP
    22901 bis(trichloromClC(Cl)(Cl)S(= 37 56258 http://www.s PHYSPROP
    22902 thiazole, 4,5- Cc1scnc1C 83.5 56286 http://www.s PHYSPROP
    22903 metazocine Oc2ccc3CC1C( 144 56292 http://www.s PHYSPROP
    22904 metazocine Oc2ccc3CC1C( 233.5 56292 http://www.s PHYSPROP
    22905 clonitazene [O-][N+](=O)c 75.5 56301 http://www.s PHYSPROP
    22906 3,4-hexanedi CCC(=O)C(=O) -10 56310 http://www.s PHYSPROP
    22907 1-undecanethiCCCCCCCCCCC -3 56332 http://www.s PHYSPROP
    22908 butanoic acid,CCCCCCCOC(= -57.5 56351 http://www.s PHYSPROP
    22909 2-butene (iso CC=CC -139.3 56442 http://www.s PHYSPROP x wrong isomer JCB
    22910 trans-2-butenCC=CC -105.5 56442 http://www.s PHYSPROP
    22911 2-amino-9h-pyNc1ccc2c3ccc 202 56541 http://www.s PHYSPROP
    22912 perimethazin OC1CCN(CC1)C 137.5 56600 http://www.s PHYSPROP
    22913 ethyl mentha CC(C)C1CCC(C 88 56632 http://www.s PHYSPROP
    22914 2,3,3',4,4',6- Clc1cc(Cl)c(Cl) 107 56757 http://www.s PHYSPROP
    22915 2,2',3,4,4',6- Clc1cc(Cl)c(Cl 73 56765 http://www.s PHYSPROP
    22916 2',3,4,5,5'-pe Clc1cc(cc(Cl)c 105 56773 http://www.s PHYSPROP
    22917 2,4,4',6-tetra Clc2cc(Cl)cc(C 65 56792 http://www.s PHYSPROP
    22918 quinazolidin- O=C2NC=Nc1c 217.5 56797 http://www.s PHYSPROP
    22919 moquizone O=C(CN1CCOCC 136 56892 http://www.s PHYSPROP
    22920 1-hydroxyadaOC13CC2CC(CC 247 57726 http://www.s PHYSPROP x clearly out of range JCB
    22921 acetamide, n-tCC(=O)NC13CC 148.5 57727 http://www.s PHYSPROP
    22922 cyclohexyl meO=P(C)(F)OC1 -30 58069 http://www.s PHYSPROP
    22923 tetradecanenitCCCCCCCCCCC 19 58227 http://www.s PHYSPROP
    22924 borneol CC12CCC(CC1O 207 58234 http://www.s PHYSPROP
    22925 d-borneol CC12CCC(CC1O 208 58234 http://www.s PHYSPROP
    22926 isoborneol CC12CCC(CC1O 213 58234 http://www.s PHYSPROP
    22927 apotropine CN3C1CCC3CC( 62 58243 http://www.s PHYSPROP
    22928 2(1h)-quinolinO=C1CCc2ccc 163.5 58328 http://www.s PHYSPROP
    22929 benzenepropan
    O=C(CC#N)c1c 80.5 58331 http://www.s PHYSPROP
    22930 benzenepropan
    O=C(O)C(Cc1c 90 58332 http://www.s PHYSPROP
    22931 benzenepropan
    ClC(=O)CCc1c -2 58333 http://www.s PHYSPROP
    22932 sulfametrole COc2nsnc2NS( 149.5 58466 http://www.s PHYSPROP
    22933 phenamidine N=C(N)c1ccc(c 215.5 58474 http://www.s PHYSPROP
    22934 n-methylnicotO=C(NC)c1ccc 103.5 58476 http://www.s PHYSPROP
    22935 cyclam C1NCCCNCCN 185 58489 http://www.s PHYSPROP
    22936 p-hydroxybenO=C(N)c1ccc( 161.5 58563 http://www.s PHYSPROP
    22937 diphencypronO=C2C(=C2c1c 119 58568 http://www.s PHYSPROP
    22938 2,5-thiophenyc1csc(c1)c2cc 93.5 58578 http://www.s PHYSPROP
    22939 1-dime aminoCN(C)c2cccc1 219.5 58587 http://www.s PHYSPROP
    22940 xanthotoxol Oc1c3occc3cc 251.5 58600 http://www.s PHYSPROP
    22941 n-(p-aminobenO=C(NC(CCC(= 173 58647 http://www.s PHYSPROP
    22942 1,10-phenanthCc1nc3c(cc1)c 159.5 58734 http://www.s PHYSPROP
    22943 trimethyl iso CC(C)C(C)(C(C 60 58789 http://www.s PHYSPROP
    22944 fenclofenac Clc2cc(Cl)ccc 112 58860 http://www.s PHYSPROP
    22945 24nh2pyrimidNc2nc(N)ncc2 154 58910 http://www.s PHYSPROP
    22946 py 11 Clc1cc(Cl)nc( 220.5 58968 http://www.s PHYSPROP
    22947 1(3h)-isobenz Brc1cc(cc(Br) 278.5 59012 http://www.s PHYSPROP
    22948 ethanedioyl diClC(=O)C(Cl)= -16 59021 http://www.s PHYSPROP
    22949 2-propanone, BrC(Br)C(=O)C 79.5 59022 http://www.s PHYSPROP
    22950 sulfaloxic acidO=S(=O)(NC(= 162.5 59051 http://www.s PHYSPROP
    22951 mepixanox O=C3c4ccccc4 159.5 59116 http://www.s PHYSPROP
    22952 resorantel Brc2ccc(NC(=O 229 59124 http://www.s PHYSPROP
    22953 trofosfamide O=P1(OCCCN1C 50.5 59129 http://www.s PHYSPROP
    22954 clospirazine Clc4ccc5Sc1c 155 59138 http://www.s PHYSPROP
    22955 benzenesulfonO=S(=O)(NN)c 102 59146 http://www.s PHYSPROP
    22956 3h-2,1-benzoxa
    O=C2OS(=O)(= 129.5 59152 http://www.s PHYSPROP
    22957 1,4-dicl-2,3- O=C2c1ccccc1C 295 59154 http://www.s PHYSPROP
    22958 diphenylcarbaO=C(Cl)N(c1cc 83 59164 http://www.s PHYSPROP
    22959 pellotine Oc2c(OC)c(cc 111.5 59165 http://www.s PHYSPROP
    22960 physodic acid CCCCCC(=O)Cc 205 59174 http://www.s PHYSPROP
    22961 rutecarpine O=C3c5ccccc5 260 59175 http://www.s PHYSPROP
    22962 terofenamateClc2ccc(C)c(C 73.5 59185 http://www.s PHYSPROP
    22963 etofibrate Clc1ccc(cc1) 100 59197 http://www.s PHYSPROP
    22964 nicofibrate Clc1ccc(cc1)O 48.5 59198 http://www.s PHYSPROP
    22965 4-nitrobenzyl O=[N+]([O-])c 99 59402 http://www.s PHYSPROP
    22966 benzene, 1-is O=C=Nc1ccc(cc 57 59403 http://www.s PHYSPROP
    22967 n-phenylglyci O=C(O)CNc1cc 127.5 59416 http://www.s PHYSPROP
    22968 2-propanone, C/C(C)=NNc1c 42 59417 http://www.s PHYSPROP
    22969 disulfide, bis Cc2ccc(SSc1cc 47.5 59418 http://www.s PHYSPROP
    22970 benzenemethaCc1ccc(CN)cc1 12.5 59426 http://www.s PHYSPROP
    22971 benzene, 1,4- C=Cc1ccc(C=C 31 59432 http://www.s PHYSPROP
    22972 benzonitrile, O=Cc1ccc(C#N 100.5 59433 http://www.s PHYSPROP
    22973 4-piperidinol, OC1CCN(C)CC 29 59438 http://www.s PHYSPROP
    22974 benzenethiol,Sc1ccc(Br)cc1 73 59439 http://www.s PHYSPROP
    22975 2-pyrrolidinonO=C1CCC(C)N 43 59445 http://www.s PHYSPROP
    22976 piperazine, 2- CC1CNCCN1 62 59447 http://www.s PHYSPROP
    22977 disulfide, bis CC(C)(C)SSC(C -5 59450 http://www.s PHYSPROP
    22978 decanedioyl dClC(=O)CCCCC -2.5 59462 http://www.s PHYSPROP
    22979 1,3-pentadienC=C(C)C=C(/C) -114 59470 http://www.s PHYSPROP
    22980 1-pentanone, O=C(CCCC)c1c -9.4 59482 http://www.s PHYSPROP
    22981 cyclotrisilaza C[Si]1(C)N[Si] -10 59483 http://www.s PHYSPROP
    22982 cyclotetrasila C[Si]1(C)N[Si] 97.5 59489 http://www.s PHYSPROP
    22983 silane, tetrap c1ccccc1[Si]( 236.5 59493 http://www.s PHYSPROP
    22984 silane, chloro C[SiH](C)Cl -111 59496 http://www.s PHYSPROP
    22985 protheobromiCC(O)CN2C(=O 141 59508 http://www.s PHYSPROP
    22986 benzoic acid, 2Clc1c(cc(Cl)c 166.5 59509 http://www.s PHYSPROP
    22987 benzaldehyde,O=Cc2ccc(Oc1 24.5 59526 http://www.s PHYSPROP
    22988 1,1,1-trichlor ClC(Cl)(Cl)C(C 50.5 59540 http://www.s PHYSPROP
    22989 propane, 1,2,3FC(Cl)(F)C(Cl)( -72 59542 http://www.s PHYSPROP
    22990 benzeneaceticOC(C(=O)OC)(c 75.8 59546 http://www.s PHYSPROP
    22991 barbituric aci CC1(C(=O)NC( 220 59547 http://www.s PHYSPROP
    22992 2,2-bis(4-hyd Oc1ccc(cc1)C( 120.5 59553 http://www.s PHYSPROP
    22993 2-ethyl-2-metCC(CC)(CO)CO 40.3 59556 http://www.s PHYSPROP
    22994 2-amino-5-chlClc1cnc(N)cc1 137 59561 http://www.s PHYSPROP
    22995 1,2,3,4,5,6,7 C1CCCc2cc3C 78 59568 http://www.s PHYSPROP
    22996 benzene, 1,1'-C(CCc1ccccc1) 52.5 59569 http://www.s PHYSPROP
    22997 lumiflavine Cc2cc3N=C1C( 320 59571 http://www.s PHYSPROP
    22998 silane, dimethC[SiH2]C -150 59572 http://www.s PHYSPROP
    22999 pentaerythritoC=CC2OCC1(C 44.5 59603 http://www.s PHYSPROP
    23000 tripentaerythrOCC(COCC(CO 249 59604 http://www.s PHYSPROP
    23001 1,3-propanediCC(CCC)(CO)C 62.5 59605 http://www.s PHYSPROP
    23002 ethane, 1,1,2-BrC(Br)CBr -29.3 59607 http://www.s PHYSPROP
    23003 ethene, tetra Br/C(Br)=C(/B 56.5 59617 http://www.s PHYSPROP
    23004 phenol, 4,4'-( CC(C)(C)c1cc( 114.4 59622 http://www.s PHYSPROP
    23005 propatyl nitraO=[N+]([O-])O 51.5 59642 http://www.s PHYSPROP
    23006 benzene, 1,2,4Cc1cc(C)c(C)c 21 59673 http://www.s PHYSPROP
    23007 tridecan-3-ol CCC(O)CCCCC 32 59682 http://www.s PHYSPROP
    23008 1-propanone, O=C(CC)c1ccc( 48 59691 http://www.s PHYSPROP
    23009 acediasulfoneO=S(=O)(c1ccc 194 59823 http://www.s PHYSPROP
    23010 p-toluenesulf Cc1ccc(cc1)S( 110 59829 http://www.s PHYSPROP
    23011 hexaconazole OC(CCCC)(Cn1c 111 59833 http://www.s PHYSPROP
    23012 benzoic acid, Oc1ccc(cc1)C( 230.5 59865 http://www.s PHYSPROP
    23013 phenolphthaloOc1ccc(cc1)C( 201.5 59866 http://www.s PHYSPROP
    23014 propanedioic aO=C(OCC)C(C( 16.5 59885 http://www.s PHYSPROP
    23015 n-phenylsucciO=C2CCC(=O)N 156 59890 http://www.s PHYSPROP
    23016 naphthalene, Brc1ccc(Br)c2 83 59892 http://www.s PHYSPROP
    23017 1,2-benzenedic
    O=C(N(CC)CC) 36 59897 http://www.s PHYSPROP
    23018 9,10-anthraceCC(C)(C)c2ccc 99 59903 http://www.s PHYSPROP
    23019 2,2'-dichlorobClc2cc(N)ccc2 165 59909 http://www.s PHYSPROP
    23020 fervenulin O=C2N=C1C(= 178.5 59912 http://www.s PHYSPROP
    23021 xanthoxyletin O=C1C=Cc2c(O 133 59919 http://www.s PHYSPROP
    23022 3,6-dihydroxyCOC1=C(O)C(= 202.5 59926 http://www.s PHYSPROP
    23023 methanone, (2O=C(c1ccccc1C 67 59928 http://www.s PHYSPROP
    23024 1-naphthaleneClS(=O)(=O)c2 68 59930 http://www.s PHYSPROP
    23025 benzoic acid, OC(=O)c2ccccc 146 59933 http://www.s PHYSPROP
    23026 tricromyl O=C1c2ccccc 68 59939 http://www.s PHYSPROP
    23027 8-quinolinecarO=C(O)c1cccc 187 59951 http://www.s PHYSPROP
    23028 3h-pyrazol-3- Cc1ccc(cc1)N 137.5 59960 http://www.s PHYSPROP
    23029 4-(t-butyl)ph Oc2ccccc2C(=O 62 59965 http://www.s PHYSPROP
    23030 chloranilic aci OC=1C(=O)C(C 283.5 59971 http://www.s PHYSPROP
    23031 ethyl 703 CC(C)(C)c1cc( 93.5 59976 http://www.s PHYSPROP
    23032 benzene, 1,4- COc1ccc(cc1[N 72.5 60006 http://www.s PHYSPROP
    23033 salicylhydroxaO=C(NO)c1ccc 168 60011 http://www.s PHYSPROP
    23034 benzoyl chloriO=C(Cl)c1ccc(C 16.5 60012 http://www.s PHYSPROP
    23035 2-amino-4-chlOC(=O)c1ccc(C 232 60013 http://www.s PHYSPROP
    23036 xanthoxylin COc1cc(cc(O) 82 60021 http://www.s PHYSPROP
    23037 benzene, 1,2- BrCc1ccccc1C 95 60032 http://www.s PHYSPROP
    23038 benzenemethaC(c1ccccc1)N( 69 60047 http://www.s PHYSPROP
    23039 c.i. azoic cou O=C(Nc1ccc(c 212 60052 http://www.s PHYSPROP
    23040 5h-thiachromiCc1nc2N=C3SC 228.8 60072 http://www.s PHYSPROP
    23041 2,7-naphthalen
    O=S(=O)(O)c1c 199 60073 http://www.s PHYSPROP
    23042 naphthol as O=C(Nc1ccccc 248.5 60085 http://www.s PHYSPROP
    23043 1,1'-biphenyl OC(=O)c1ccc(c 228 60090 http://www.s PHYSPROP
    23044 6-quinolinamin
    CN(C)c1ccc2nc 101 60091 http://www.s PHYSPROP
    23045 benzaldehyde,COc1ccc(cc1C 52 60092 http://www.s PHYSPROP
    23046 3,4-dimethoxyCOc1cc(ccc1O 62.75 60093 http://www.s PHYSPROP
    23047 acetamide, 2-SCC(=O)Nc1cc 111.5 60099 http://www.s PHYSPROP
    23048 2-naphthalenoO=C(Oc1ccc2c 107 60100 http://www.s PHYSPROP
    23049 n-methylformaCN(C=O)c1ccc 14.5 60103 http://www.s PHYSPROP
    23050 1,3-benzenediO=C(Oc1cccc( -90 60108 http://www.s PHYSPROP x clearly out of range JCB
    23051 1,2-ethanedioO=C(OCCO)c1c 45 60113 http://www.s PHYSPROP
    23052 1,2-ethanedioO=C(OCCOC(=O 73.5 60116 http://www.s PHYSPROP
    23053 o-ethoxyphenCCOc1ccccc1 29 60121 http://www.s PHYSPROP
    23054 2-chlor-5-meth
    Cc1ccc(Cl)c(N 29.5 60136 http://www.s PHYSPROP
    23055 2,5-furandioneO=C1C=C(Cl)C 33 60138 http://www.s PHYSPROP
    23056 benzenamine,COc1ccc(N)c(c 124 60158 http://www.s PHYSPROP
    23057 5-nitrosalicyl O=Cc1cc(ccc1O 129 60173 http://www.s PHYSPROP
    23058 benzenesulfonNc1ccc(cc1)S( 68.5 60187 http://www.s PHYSPROP
    23059 benzenesulfoni
    OS(=O)(=O)c1 286 60189 http://www.s PHYSPROP
    23060 boronic acid, OB(O)c1ccccc 219 60191 http://www.s PHYSPROP
    23061 alpha-bromosBrC(=C)c1cccc -44 60192 http://www.s PHYSPROP
    23062 picadex S=C(S)N1CCN 228 60193 http://www.s PHYSPROP
    23063 1,3-benzenediOC(=O)c1cc(c 360 60197 http://www.s PHYSPROP
    23064 benzenesulfiniOS(=O)c1ccc(C 99 60211 http://www.s PHYSPROP
    23065 benzenesulfonOS(=O)(=O)c2c 206 60229 http://www.s PHYSPROP
    23066 n-(p-methoxy COc2ccc(Nc1cc 102 60232 http://www.s PHYSPROP
    23067 butanamide, nOc1ccc(NC(=O 139.5 60237 http://www.s PHYSPROP
    23068 boroxin, trim COB1OB(OC)O 10 60242 http://www.s PHYSPROP
    23069 sulfamidochryO=S(N)(=O)c2 249.5 60257 http://www.s PHYSPROP
    23070 s-benzylmercaO=C(O)CSCc1c 61 60259 http://www.s PHYSPROP
    23071 ches O=S(=O)(O)C 320 60260 http://www.s PHYSPROP
    23072 phenocoll CCOc1ccc(cc1 100.5 60263 http://www.s PHYSPROP
    23073 octadecanoic aO=C(OC1CCCC 44 60265 http://www.s PHYSPROP
    23074 p-aminophenyNc1ccc(CCO)c 109 60266 http://www.s PHYSPROP
    23075 benzenesulfonNc1ccc(cc1)S( 171 60271 http://www.s PHYSPROP
    23076 benzene, 1,4- CCCCOc1ccc(O 45.5 60273 http://www.s PHYSPROP
    23077 nonanedioic acCCC(CC)COC( -45 60282 http://www.s PHYSPROP
    23078 thioperoxydicaCC(C)OC(=S)SS 55 60285 http://www.s PHYSPROP
    23079 octadecanoic aO=C(OCCOCCO 40 60296 http://www.s PHYSPROP
    23080 1,3,4-thiadiaz Cc1nnc(N)s1 224.5 60308 http://www.s PHYSPROP
    23081 dodecanoic acO=C(O)C(Br)C 32 60338 http://www.s PHYSPROP
    23082 decanoyl chloClC(=O)CCCCC -34.5 60340 http://www.s PHYSPROP
    23083 tetradecanoylClC(=O)CCCC -1 60344 http://www.s PHYSPROP
    23084 octadecane, 1CCCCCCCCCCC 20 60346 http://www.s PHYSPROP
    23085 1-(hydroxymetCC1(C)C(=O)N 100 60357 http://www.s PHYSPROP
    23086 sulfaproxylineNc1ccc(cc1)S( 172.5 60359 http://www.s PHYSPROP
    23087 moskene [O-][N+](=O)c 132.5 60362 http://www.s PHYSPROP
    23088 9,10-dioxo-9, O=C(O)c2ccc3 291 60382 http://www.s PHYSPROP
    23089 2,4-dinitrosorO=Nc1c(O)ccc 168 60387 http://www.s PHYSPROP
    23090 benzoic acid, CNc1ccccc1C( 180.5 60420 http://www.s PHYSPROP
    23091 quinoline, 1, COc1ccc2NCC 42.5 60461 http://www.s PHYSPROP
    23092 benzaldehyde,CCN(CC)c1ccc 41 60462 http://www.s PHYSPROP
    23093 benzenamine,CCN(CC)c1ccc 87.5 60463 http://www.s PHYSPROP
    23094 benzaldehyde,COc1cc(ccc1O 64.5 60464 http://www.s PHYSPROP
    23095 n-sulfanilyl-3 Nc1ccc(cc1)S( 222.5 60466 http://www.s PHYSPROP
    23096 n-butyl 4-nit O=[N+]([O-])c 35.5 60469 http://www.s PHYSPROP
    23097 chloaminopheO=S(N)(=O)c1c 254.5 60483 http://www.s PHYSPROP
    23098 m-nitrobenze O=S(N)(=O)c1c 167 60485 http://www.s PHYSPROP
    23099 3,3'-methylenOC(=O)c1cc(cc 243.5 60490 http://www.s PHYSPROP
    23100 1,4-piperazin OCCN1CCN(CC 134.75 60496 http://www.s PHYSPROP
    23101 propanedinitrN#C/C(C#N)= 66 60497 http://www.s PHYSPROP
    23102 diphenolin aciOc1ccc(cc1)C( 171.5 60518 http://www.s PHYSPROP
    23103 2-propanone, C/C(C)=NO 61 60524 http://www.s PHYSPROP
    23104 2,5-pyrrolidi O=C1CCC(=O) 174 60528 http://www.s PHYSPROP
    23105 2,6-anthracene
    O=S(=O)(O)c3c 300 60539 http://www.s PHYSPROP
    23106 viridicatin OC1=C(c2cccc 268 60543 http://www.s PHYSPROP
    23107 benz(cd)indol O=C1Nc3cccc2 175.5 60558 http://www.s PHYSPROP
    23108 benzoic acid, CCOc1ccccc1C 20.7 60586 http://www.s PHYSPROP
    23109 benzoic acid, O=C(C)Oc2ccc 96 60590 http://www.s PHYSPROP
    23110 methanone, ph
    O=C(c1ccccc1) 56.5 60596 http://www.s PHYSPROP
    23111 mesulphen Cc1ccc2Sc3ccc 123 60604 http://www.s PHYSPROP
    23112 phenoxazine c1ccc2Oc3ccc 156 60610 http://www.s PHYSPROP
    23113 1,3-benzenedio
    Oc1cc(O)c(Cl) 113 60631 http://www.s PHYSPROP
    23114 pentanoic acidO=C(CCCC)OC -70.7 60659 http://www.s PHYSPROP
    23115 dodecanoic acOCCOCCOC(=O 17.5 60661 http://www.s PHYSPROP
    23116 pyridazine, 3, Clc1ccc(Cl)nn 67.5 60662 http://www.s PHYSPROP
    23117 hexanoyl chloCCCCCC(Cl)=O -87 60671 http://www.s PHYSPROP
    23118 musk tibetineO=[N+]([O-])c1 135.5 60681 http://www.s PHYSPROP
    23119 1,2-ethanediaC(CNc1ccccc1 74 60747 http://www.s PHYSPROP
    23120 7h-benzo[c]cac1cccc3c1ccc 134 60784 http://www.s PHYSPROP
    23121 4,7-phenanthrc2cc1ncccc1c 177 60796 http://www.s PHYSPROP
    23122 1,2,5,6-diben c1ccc2c3Cc4c 174.5 60805 http://www.s PHYSPROP
    23123 1,2,4-benzotrin1cnnc2ccccc 75.8 60815 http://www.s PHYSPROP
    23124 thioxanthene c1ccc2Sc3ccc 128.5 60819 http://www.s PHYSPROP
    23125 2h-1,2,3-triaz c1cnnn1 23 60839 http://www.s PHYSPROP
    23126 1h-tetrazole c1nnnn1 157 60842 http://www.s PHYSPROP
    23127 1,2,3,5,6-pen S1CSSCSS1 60.5 60844 http://www.s PHYSPROP
    23128 cyclopentade C1CCCCCCCCC 61.3 60848 http://www.s PHYSPROP
    23129 perfluorododeFC(F)(C(F)(F)C( 108 60867 http://www.s PHYSPROP
    23130 2-cf3 benzimi FC(F)(F)c1nc2 209.5 60882 http://www.s PHYSPROP
    23131 octafluoronapFc2c1c(F)c(F)c 87.5 60886 http://www.s PHYSPROP
    23132 1,3,5-trifluor Fc1cc(F)cc(F)c 3.5 60889 http://www.s PHYSPROP
    23133 1,1'-biphenyl,Fc2ccccc2c1cc 73.5 60900 http://www.s PHYSPROP
    23134 4-hydroxy-7-t FC(F)(F)c1cc2 267.5 60903 http://www.s PHYSPROP
    23135 naphthalene, Fc1ccc2ccccc2 61 60904 http://www.s PHYSPROP
    23136 1,3-benzodioxo
    O=C(OC)c1cc 53 60911 http://www.s PHYSPROP
    23137 1,5-difluoro-2Fc1cc(F)c(cc1 73 60919 http://www.s PHYSPROP
    23138 4-(trifluormetFC(F)(F)Oc1cc 152 60933 http://www.s PHYSPROP
    23139 m-fluorophenyFc1cc(CC(=O)O 43 60937 http://www.s PHYSPROP
    23140 perfluoroadipiFC(F)(C(F)(F)C 134 60959 http://www.s PHYSPROP
    23141 1,2-dicl-3,3,4 FC1(F)C(F)(F)C -70 60960 http://www.s PHYSPROP
    23142 butanoic acid,FC(F)(C(=O)OC( -43 60962 http://www.s PHYSPROP
    23143 5-thiazolecarbFC(F)(F)c1nc( 186.5 60975 http://www.s PHYSPROP
    23144 sulbentine S=C3SCN(Cc1c 101.5 61005 http://www.s PHYSPROP
    23145 m-(trifluoromFC(F)(F)c1ccc 77 61014 http://www.s PHYSPROP
    23146 methane, tribBrC(Br)(Br)F -73.6 61026 http://www.s PHYSPROP
    23147 trifluoroacet FC(F)(F)C(N)= 72.5 61036 http://www.s PHYSPROP
    23148 undecafluoro-FC(F)(C(F)(F)C( -119 61045 http://www.s PHYSPROP
    23149 hexane, tridecFC(F)(C(F)(F)C( -46 61052 http://www.s PHYSPROP
    23150 butanoic acid,FC(F)(C(F)(F)C -86 61060 http://www.s PHYSPROP
    23151 difluorodiethyCC[Si](F)(F)CC -78.7 61067 http://www.s PHYSPROP
    23152 2,4,6-trifluoroFc1cc(F)c(N)c( 35 61084 http://www.s PHYSPROP
    23153 benzene, 1,4-dFc1ccc(F)cc1[ -11.7 61086 http://www.s PHYSPROP
    23154 4-fluoro-3-nit O=[N+]([O-])c 97.5 61087 http://www.s PHYSPROP
    23155 a,a,a-trifluor- FC(F)(F)c1ccc 14.5 61101 http://www.s PHYSPROP
    23156 butane, 2,2,3,ClC(Cl)(C(Cl)(C 83.5 61128 http://www.s PHYSPROP
    23157 perfluoroglutaFC(F)(C(F)(F) 80 61144 http://www.s PHYSPROP
    23158 1,5-pentanedio
    FC(F)(C(F)(F)C 79.5 61148 http://www.s PHYSPROP
    23159 butanedioic acFC(F)(C(=O)O) 119 61150 http://www.s PHYSPROP
    23160 perfluoro-4-mFC1(F)N(C(F)(F -80 61156 http://www.s PHYSPROP
    23161 benzene, 2-chlO=[N+]([O-])c1 63 61168 http://www.s PHYSPROP
    23162 2-fluoroacetanO=C(C)Nc1ccc 78 61177 http://www.s PHYSPROP
    23163 benzene, 1-fluFC(F)(F)c1ccc( -41.7 61190 http://www.s PHYSPROP
    23164 p-trifluorome FC(F)(F)c1ccc( 46 61191 http://www.s PHYSPROP
    23165 benzoyl chloriO=C(Cl)c1ccc( 9 61196 http://www.s PHYSPROP
    23166 benzonitrile, N#Cc1cc(F)ccc -16 61197 http://www.s PHYSPROP
    23167 p-fluorophenoO=C(O)COc1cc 104.25 61199 http://www.s PHYSPROP
    23168 benzene, 1-etC=Cc1ccc(F)cc -34.5 61200 http://www.s PHYSPROP
    23169 propane, 2,2-dCC(C)(F)F -104.8 61212 http://www.s PHYSPROP
    23170 propane, 1-chlCC(F)(F)CCl -56.2 61213 http://www.s PHYSPROP
    23171 1,1,1-trifluo BrCC(F)(F)F -93.9 61215 http://www.s PHYSPROP
    23172 butane, 1,1,1,FC(F)(C(F)(F)C( -68 61234 http://www.s PHYSPROP
    23173 decane, heneiFC(F)(C(F)(F)C( 66 61237 http://www.s PHYSPROP
    23174 ethyl pentafl FC(F)(C(=O)OC 75.5 61245 http://www.s PHYSPROP
    23175 1,1,2-trichlor Cl/C(Cl)=C(/Cl 114.6 61255 http://www.s PHYSPROP x wrong sign - mp cannot be above bp JCB
    23176 hfc-227ea (heFC(F)(F)C(F)C( -127.1 61257 http://www.s PHYSPROP
    23177 benzoic acid, OC(=O)c1c(F)c 160 61264 http://www.s PHYSPROP
    23178 decafluorobipFc1c(c(F)c(F)c 67.5 61266 http://www.s PHYSPROP
    23179 o-trifluorome FC(F)(F)c1ccc 45.5 61273 http://www.s PHYSPROP
    23180 2-fluorobenz O=C(N)c1cccc 118 61279 http://www.s PHYSPROP
    23181 2-nitro-4-fluo Cc1ccc(F)cc1[ 27 61280 http://www.s PHYSPROP
    23182 benzene, 2-fluFc1cc(C)ccc1[ 53.2 61281 http://www.s PHYSPROP
    23183 a,a,a-trifluor-oFC(F)(F)c1ccc 18 61287 http://www.s PHYSPROP
    23184 o-fluorophenylFc1ccccc1CC( 63 61294 http://www.s PHYSPROP
    23185 benzenamine,Fc1ccc(N)c(C) 14.2 61297 http://www.s PHYSPROP
    23186 benzoyl fluori FC(=O)c1ccccc -28 61314 http://www.s PHYSPROP
    23187 trifluorometh FC(F)(F)Oc1cc -50 61325 http://www.s PHYSPROP
    23188 benzene, 1-etCCOc1ccc(F)c -8.5 61333 http://www.s PHYSPROP
    23189 benzenemethan
    OCc1ccc(F)cc1 23 61337 http://www.s PHYSPROP
    23190 hfc-245fa FC(F)CC(F)(F)F -102 61345 http://www.s PHYSPROP
    23191 2,4-diaminopyNc1ccnc(N)c1 107 61351 http://www.s PHYSPROP
    23192 1,2,4-triazine O=C1NC(=O)C 274.5 61352 http://www.s PHYSPROP
    23193 2,6-dimethyl- Nc1cc(C)nc(C) 183 61354 http://www.s PHYSPROP
    23194 11-fluoro-undO=C(O)CCCCC 36 61359 http://www.s PHYSPROP
    23195 formamidine N=CN 81 61362 http://www.s PHYSPROP
    23196 benzenesulfonCc1ccc(cc1)S( 83 61371 http://www.s PHYSPROP
    23197 atranorin O=Cc2c(O)cc(C 195 61380 http://www.s PHYSPROP
    23198 1,8-naphthal Nc1cccc2cccc 66.5 61381 http://www.s PHYSPROP
    23199 1h,5h-benzo[ijC1Cc2cccc3CC 40 61383 http://www.s PHYSPROP
    23200 benzofurazan,[O-][n+]1onc2 70 61388 http://www.s PHYSPROP
    23201 dictamnine COc2c3ccoc3n 133.5 61397 http://www.s PHYSPROP
    23202 phenol, 2,3,5 Oc1c(Cl)c(Cl)c 116 61400 http://www.s PHYSPROP
    23203 dipyrocetyl O=C(C)Oc1ccc 149 61404 http://www.s PHYSPROP
    23204 bromanyl BrC=1C(=O)C( 293 61410 http://www.s PHYSPROP
    23205 phenol, 2,3,4,Cc1c(C)c(C)cc 85.3 61411 http://www.s PHYSPROP
    23206 2,5-dimethyl- Oc1cc(C)cc(O) 163 61412 http://www.s PHYSPROP
    23207 1h-2-benzopyO=C2OC=Cc1c 47 61416 http://www.s PHYSPROP
    23208 4h-1-benzopyrO=C2CCOc1cc 36.5 61418 http://www.s PHYSPROP
    23209 benzaldehyde,CCOc1cccc(C= 67 61425 http://www.s PHYSPROP
    23210 1,2-benzenediOc1c(CCCCCC 59.5 61426 http://www.s PHYSPROP
    23211 furan, 2-coco-O=C(C(=O)c1c 164 61427 http://www.s PHYSPROP
    23212 2,2'-bithioph c1csc(c1)c2cc 33 61428 http://www.s PHYSPROP
    23213 nicotelline n1cc(ccc1)c2c 147.5 61431 http://www.s PHYSPROP
    23214 benzene, 1,2- COc1cc(C)ccc 24 61434 http://www.s PHYSPROP
    23215 2h-pyran-2-onOC1=CC=COC 93.8 61438 http://www.s PHYSPROP
    23216 phenol, 3-penOc1cc(CCCCC 53.5 61454 http://www.s PHYSPROP
    23217 d-valerolacto O=C1C=CC=C -12.5 61462 http://www.s PHYSPROP
    23218 2h-pyran-2-o O=C1C=CC=C 8.5 61462 http://www.s PHYSPROP
    23219 1h-1,4-diazepC1CCNCCN1 43.5 61471 http://www.s PHYSPROP
    23220 propane, 1,1'-CCCOCOCCC -97.3 61473 http://www.s PHYSPROP
    23221 octadec-9-ynoO=C(O)CCCCC 48 61475 http://www.s PHYSPROP
    23222 1-hexacosanolCCCCCCCCCCC 80 61478 http://www.s PHYSPROP
    23223 2,2,2-tribrom BrC(Br)(Br)C( 53.5 61488 http://www.s PHYSPROP
    23224 anilinephthaleNc1ccc(cc1)C3 203 61490 http://www.s PHYSPROP
    23225 sulfamethylthCc2csc(NS(=O) 237 61501 http://www.s PHYSPROP
    23226 1,8-naphthaleO=C(O)c1cccc 260 61511 http://www.s PHYSPROP
    23227 fluorescin O=C(O)c4cccc 126 61512 http://www.s PHYSPROP
    23228 6-formyl-2,3- COc1ccc(C=O) 150 61517 http://www.s PHYSPROP
    23229 maclurin Oc1ccc(cc1O) 222.5 61520 http://www.s PHYSPROP
    23230 1h-isoindole-1O=C2c1ccccc1 210 61522 http://www.s PHYSPROP
    23231 anthracene, 9Brc2c1ccccc1c 226 61529 http://www.s PHYSPROP
    23232 benylimidobi COc1ccc(cc1)C 90 61535 http://www.s PHYSPROP
    23233 galipine COc1ccc(cc1O 115.5 61536 http://www.s PHYSPROP
    23234 phenol, 2,3,4-Cc1c(C)ccc(O) 81 61538 http://www.s PHYSPROP
    23235 duroquinone CC=1C(=O)C(C 111.5 61539 http://www.s PHYSPROP
    23236 2,5-cyclohexadFC=1C(=O)C(F 184 61540 http://www.s PHYSPROP
    23237 2,5-cyclohexaO=C1C=C(C)C( 72.5 61542 http://www.s PHYSPROP
    23238 diploicin Clc2c1Oc3c(OC 232 61544 http://www.s PHYSPROP
    23239 2,4-dinitrobe O=[N+]([O-])c 72 61548 http://www.s PHYSPROP
    23240 benzenesulfeny
    ClSc1ccc(cc1[ 99 61549 http://www.s PHYSPROP
    23241 2-isopropyl-4 CC(C)c1cc2c(C 32.3 61551 http://www.s PHYSPROP
    23242 2-aminobenzaO=Cc1ccccc1N 39 61553 http://www.s PHYSPROP
    23243 1-naphthalenol
    Oc2cccc1CCCC 70 61556 http://www.s PHYSPROP
    23244 2,6-dimethox COC1=CC(=O) 256 61560 http://www.s PHYSPROP
    23245 1h-imidazole, O=C(n1cncc1) 119 61561 http://www.s PHYSPROP
    23246 2(1h)-naphthaO=C1Cc2ccccc 18 61564 http://www.s PHYSPROP
    23247 1,1'-biphenyl -Oc1cc(cc(O)c1 310 61566 http://www.s PHYSPROP
    23248 guaiacol benz O=C(Oc1ccccc 57.5 61569 http://www.s PHYSPROP
    23249 1,1'-biphenyl c1ccccc1Nc2cc 247 61577 http://www.s PHYSPROP
    23250 1,3-di-6-quinoO=C(Nc1cc2cc 262 61578 http://www.s PHYSPROP
    23251 b,b'-dinaphth c3cccc4ccc(Nc 172.2 61580 http://www.s PHYSPROP
    23252 1,3-benzenedio
    Oc1cc(O)ccc1 72.5 61584 http://www.s PHYSPROP
    23253 6-benzothiazoNc1ccc2ncsc2 87 61585 http://www.s PHYSPROP
    23254 1,2-benzenediNc2ccccc2Nc1 79.5 61594 http://www.s PHYSPROP
    23255 ethanone, 2-bO=C(CBr)c1ccc 96.5 61599 http://www.s PHYSPROP
    23256 hordenine Oc1ccc(CCN(C 117.5 61609 http://www.s PHYSPROP
    23257 cyclopropane,COC1CC1 -119 61618 http://www.s PHYSPROP
    23258 propanedioic aCC(C)(C)OC(= -6 61619 http://www.s PHYSPROP
    23259 silane, diethylCC[SiH2]CC -134.3 61632 http://www.s PHYSPROP
    23260 octaphenyl tetO1[Si](O[Si](O 200.5 61642 http://www.s PHYSPROP
    23261 succisulfone O=S(=O)(c1cc 157 61645 http://www.s PHYSPROP
    23262 n1-(4-so2nh2-Nc1ccc(cc1)S( 137 61646 http://www.s PHYSPROP
    23263 picrolonic aci [O-][N+](=O)c 116 61657 http://www.s PHYSPROP
    23264 acetamide, n-[O-][N+](=O)c 102.5 61663 http://www.s PHYSPROP
    23265 3h-benzofura O=C1Cc2cccc 50 61668 http://www.s PHYSPROP
    23266 benzeneacetoni
    O=[N+]([O-])c 117 61672 http://www.s PHYSPROP
    23267 1-octacosanolCCCCCCCCCCC 83.3 61689 http://www.s PHYSPROP
    23268 2-propanol, 1 CC(C)(O)CCl -20 61692 http://www.s PHYSPROP
    23269 barbituric aci O=C1NC(=O)NC 156 61698 http://www.s PHYSPROP
    23270 barbituric acidO=C1NC(=O)NC 168.5 61699 http://www.s PHYSPROP
    23271 silicon tetraa O=C(C)O[Si]( 110 61702 http://www.s PHYSPROP
    23272 guaiacol phos COc3ccccc3OP 91 61703 http://www.s PHYSPROP
    23273 propanamide,CC(C)C(N)=O 128 61707 http://www.s PHYSPROP
    23274 meconin COc1c(ccc2CO 102.5 61717 http://www.s PHYSPROP
    23275 1h-imidazole-4OC(=O)c1ncnc 288 61722 http://www.s PHYSPROP
    23276 9,10-anthraceOc2ccc3C(=O) 353.8 61725 http://www.s PHYSPROP
    23277 napthalene-1,Oc1cccc2ccc( 180.5 61739 http://www.s PHYSPROP
    23278 1,6-naphthaleOc2cccc1cc(O 138 61740 http://www.s PHYSPROP
    23279 buclosamide O=C(NCCCC)c1 91.5 61743 http://www.s PHYSPROP
    23280 o-acetylbenzoiOC(=O)c1cccc 114.5 61749 http://www.s PHYSPROP
    23281 4-aminoquinolNc1ccnc2cccc 154.8 61751 http://www.s PHYSPROP
    23282 acetylsalicylic O=C(C)Oc1ccc 51.5 61759 http://www.s PHYSPROP
    23283 3,3'-bipyridin n1cc(ccc1)c2c 68 61762 http://www.s PHYSPROP
    23284 (4-pyridyl)-2- c1cc(ccn1)c2c 61.5 61763 http://www.s PHYSPROP
    23285 ethanone, 2-hO=C(CO)c1ccc 90 61765 http://www.s PHYSPROP x clearly out of range JCB
    23286 n-m-tolyl-benO=C(Nc1cc(C)c 125 61771 http://www.s PHYSPROP
    23287 1,4-benzenediOc1cc(Br)c(O) 111.5 61777 http://www.s PHYSPROP
    23288 2,6-di-t-butyl CC(C)(C)c1ccc 2.2 61785 http://www.s PHYSPROP
    23289 (3-nitrophenyO=[N+]([O-])c -10 61789 http://www.s PHYSPROP
    23290 benzoyl chlor O=C(Cl)c1ccc( 42 61790 http://www.s PHYSPROP
    23291 benzene, (3-bBrCCCOc1cccc 10.7 61797 http://www.s PHYSPROP
    23292 benzene, (2-bBrCCOc1ccccc 39 61801 http://www.s PHYSPROP
    23293 benzene, 1-b BrCc1ccc(Br)c 63 61802 http://www.s PHYSPROP
    23294 p-bromobenzyl
    ClCc1ccc(Br)c 50 61803 http://www.s PHYSPROP
    23295 1-bromo-2-io BrCCI 28 61806 http://www.s PHYSPROP
    23296 2-butanol, 2- NC(=O)OC(C)( 86 61808 http://www.s PHYSPROP
    23297 2-butynoic aciCC#CC(=O)O 78 61810 http://www.s PHYSPROP
    23298 nitroscanate [O-][N+](=O)c 110 61821 http://www.s PHYSPROP
    23299 leucinocaine Nc1ccc(cc1)C 158 61904 http://www.s PHYSPROP
    23300 isofezolac O=C(O)Cc2c(c( 200 61931 http://www.s PHYSPROP
    23301 lonazolac O=C(O)Cc1cn(n 150.5 61957 http://www.s PHYSPROP
    23302 letosteine OC(=O)C1NC( 142 61958 http://www.s PHYSPROP
    23303 24-nh2pyrimidNc2nc(N)ncc2C 226.5 62004 http://www.s PHYSPROP
    23304 isonixin O=C(Nc1c(C)c 266.5 62011 http://www.s PHYSPROP
    23305 lotrifen Clc1ccc(cc1)c 239 62098 http://www.s PHYSPROP
    23306 sulfaperine O=S(=O)(Nc1nc 262.5 62158 http://www.s PHYSPROP
    23307 disulfamide O=S(N)(=O)c1c 260 62160 http://www.s PHYSPROP
    23308 fluindione Fc1ccc(cc1)C 120 62167 http://www.s PHYSPROP
    23309 acetamide, n-CC(=O)NC(N) 218 62179 http://www.s PHYSPROP
    23310 4-pyrimidinamNc1ccncn1 155 62181 http://www.s PHYSPROP
    23311 ammonium palO=C(CCCCCCC 22 62193 http://www.s PHYSPROP
    23312 1-triacontanolCCCCCCCCCCC 88 62194 http://www.s PHYSPROP
    23313 ethyne, chloroC#CCl -126 62197 http://www.s PHYSPROP
    23314 trimethyl bor CB(C)C -161.5 62201 http://www.s PHYSPROP
    23315 trithiocarboniS=C(S)S -30 62204 http://www.s PHYSPROP
    23316 phosphine, tr CP(C)C -85 62205 http://www.s PHYSPROP
    23317 tribromochlo BrC(Br)(Br)Cl 55 62206 http://www.s PHYSPROP
    23318 2-butanamine,CC(C)(N)CC -105 62208 http://www.s PHYSPROP
    23319 chlorodimethyl
    CC(C)(Cl)C(=O 31 62209 http://www.s PHYSPROP
    23320 a-naphtholphtOc2ccc(c1cccc 254 62215 http://www.s PHYSPROP
    23321 o-cresolphthaOc1ccc(cc1C)C 223 62217 http://www.s PHYSPROP
    23322 diethyl sulfon CCS(=O)(=O)C 73.5 62226 http://www.s PHYSPROP
    23323 1,3-propanedio
    O=C(C)OCC(CO 83.5 62229 http://www.s PHYSPROP
    23324 butane, 1,1'-s CCCCS(=O)(=O 45 62236 http://www.s PHYSPROP
    23325 1-butyne, 3-mC#CC(C)C -89.7 62241 http://www.s PHYSPROP
    23326 3,3,3-trichlor O=C(O)C(O)C(C 125 62250 http://www.s PHYSPROP
    23327 benzene, 1,1'-Cc1ccc(cc1)S( 159 62252 http://www.s PHYSPROP
    23328 ethyl phenyl sO=S(=O)(CC)c 42 62254 http://www.s PHYSPROP
    23329 1-chloro-8-ni [O-][N+](=O)c 95.8 62262 http://www.s PHYSPROP
    23330 9-phenyl-acri c1cccc2nc4ccc 184 62263 http://www.s PHYSPROP
    23331 n,n-diphenyl O=C(OCC)N(c1 72 62272 http://www.s PHYSPROP
    23332 phenanthrene,Cc2c3ccccc3c 144 62277 http://www.s PHYSPROP
    23333 1,2-benzenedic
    O=C(OCCOCC) 34 62281 http://www.s PHYSPROP
    23334 2,5-cyclohexaCOC1=C(OC)C( 59.5 62289 http://www.s PHYSPROP
    23335 2,6-dinitroani O=[N+]([O-])c 141.5 62291 http://www.s PHYSPROP
    23336 benzoic acid, O=[N+]([O-])c -13 62292 http://www.s PHYSPROP
    23337 benzenamine,CCN(CC)c1ccc -60 62295 http://www.s PHYSPROP
    23338 propiophenone
    O=C(CC(c1cccc 96 62298 http://www.s PHYSPROP
    23339 formamide, n,O=CN(c1ccccc 73.5 62300 http://www.s PHYSPROP
    23340 5-nitro isoqui [O-][N+](=O)c 110 62303 http://www.s PHYSPROP
    23341 urea, n,n'-di- O=C(Nc2cccc1 296 62305 http://www.s PHYSPROP
    23342 4-hydroxy-2-mOc1cc(C)nc2c 234 62307 http://www.s PHYSPROP
    23343 benzoic acid, Oc1ccccc1C(= 97 62310 http://www.s PHYSPROP
    23344 benzene, 2-io Cc1cccc(C)c1I 11.2 62314 http://www.s PHYSPROP
    23345 1,4-benzenediCc1c(O)ccc(O) 224 62317 http://www.s PHYSPROP
    23346 propanedioic aO=C(C(=O)OC -30 62322 http://www.s PHYSPROP
    23347 benzoyl chloriO=C(Cl)c1cccc -4 62327 http://www.s PHYSPROP
    23348 2-chlorobenz O=C(N)c1cccc 143 62328 http://www.s PHYSPROP
    23349 benzene, 1-iodIc1ccccc1[N+] 54 62332 http://www.s PHYSPROP
    23350 benzoic acid, CN(C)c1ccccc 72 62335 http://www.s PHYSPROP
    23351 ethyl 2-nitro O=[N+]([O-]) 30 62340 http://www.s PHYSPROP
    23352 benzoic acid, OC(=O)c1ccc( 140 62350 http://www.s PHYSPROP
    23353 8-chloroquinoClc1cccc2cccn -20 62355 http://www.s PHYSPROP
    23354 4-chloroquinoClc1ccnc2cccc 34.5 62356 http://www.s PHYSPROP
    23355 4-hydroxyquinOc1ccnc2cccc 201 62357 http://www.s PHYSPROP
    23356 1-propanone, O=C(C(C)C)c1c -1.3 62359 http://www.s PHYSPROP
    23357 3,3'-diaminodO=C(c1cc(N)cc 173.5 62360 http://www.s PHYSPROP
    23358 methanone, ( COc1ccc(cc1)C 61.5 62361 http://www.s PHYSPROP
    23359 benzoic acid, OC(=O)c1ccc(c 199 62362 http://www.s PHYSPROP
    23360 methanone, biCc1ccc(cc1)C( 96.5 62363 http://www.s PHYSPROP
    23361 4,4'-dihydrox O=C(c1ccc(O)c 210 62365 http://www.s PHYSPROP
    23362 2-cyanobenzylClCc1ccccc1C 61 62367 http://www.s PHYSPROP
    23363 naphthalene, c1ccc2CC=CCc 25 62370 http://www.s PHYSPROP
    23364 n-methyl-o-nitCNc1ccccc1[N+ 38 62372 http://www.s PHYSPROP
    23365 6-chloroquinoClc1ccc2ncccc 43.8 62378 http://www.s PHYSPROP
    23366 3,3'-dihydrox Oc1cc(ccc1)c2 124.8 62380 http://www.s PHYSPROP
    23367 2,2'-binaphth c1cccc2ccc(cc 188.3 62381 http://www.s PHYSPROP
    23368 6-phenylquinoc1cc(cc2cccnc 110 62383 http://www.s PHYSPROP
    23369 1,2,4-benzenetO=C(C)Oc1cc( 99 62384 http://www.s PHYSPROP
    23370 1,4-diphenylpc1cc(ccc1)N2 165 62388 http://www.s PHYSPROP
    23371 4-benzylbiphec1ccccc1Cc2cc 85 62389 http://www.s PHYSPROP
    23372 2,4-dimethox COc1cc(ccc1C 72 62390 http://www.s PHYSPROP
    23373 quinoline, 2-( BrC(Br)(Br)c1 128 62393 http://www.s PHYSPROP
    23374 methanediol, 2O=C(C)OC(OC( 53.3 62396 http://www.s PHYSPROP
    23375 benzoic acid, Oc3ccccc3C(= 95.5 62397 http://www.s PHYSPROP
    23376 bis(2-naphthyc3cccc4ccc(Oc 105 62398 http://www.s PHYSPROP
    23377 benzaldehyde,O=Cc1cc(C)cc 56 62399 http://www.s PHYSPROP
    23378 nicotinic acid,O=C(OCC)c1cc 8.5 62402 http://www.s PHYSPROP
    23379 furan-2-carboxO=C(OCc1ccco 27.5 62416 http://www.s PHYSPROP
    23380 2,4-dioxo-pentO=C(CC(C)=O) 18 62421 http://www.s PHYSPROP
    23381 n,n'-diethyl-o O=C(NCC)C(= 175 62423 http://www.s PHYSPROP
    23382 oxalic acid dipO=C(OCCC)C( -44.3 62427 http://www.s PHYSPROP
    23383 3-pentanethioCCC(S)CC -110.8 62433 http://www.s PHYSPROP
    23384 phenol, 2,4-biCC(C)(C)c1cc( 51 62437 http://www.s PHYSPROP
    23385 bis(2-methylpCc2ccccc2OC( 60 62446 http://www.s PHYSPROP
    23386 butanedioic acCOC(=O)C(=C) 38 62453 http://www.s PHYSPROP
    23387 benzene, (1-c C=C(Cl)c1cccc -23 62463 http://www.s PHYSPROP
    23388 3-methylbenzCc1cccc(c1)C( 95 62466 http://www.s PHYSPROP
    23389 3,5-dinitrobenO=[N+]([O-])c 94 62468 http://www.s PHYSPROP
    23390 5-hydroxyisoph
    OC(=O)c1cc(c 293 62470 http://www.s PHYSPROP
    23391 benzoic acid, Ic1cc(ccc1)C( 54.5 62471 http://www.s PHYSPROP
    23392 benzoic acid, O=[N+]([O-])c 78 62472 http://www.s PHYSPROP
    23393 3-hydroxy-4-nO=[N+]([O-])c 230 62477 http://www.s PHYSPROP
    23394 m-nitrobenzylO=[N+]([O-])c 30.5 62479 http://www.s PHYSPROP
    23395 decanoic acid,O=C(O)C(CCC 38.5 62482 http://www.s PHYSPROP
    23396 4-methylphenCc1ccc(cc1)C( 51 62483 http://www.s PHYSPROP
    23397 benzoic acid, Ic1ccc(cc1)C( 114.8 62484 http://www.s PHYSPROP
    23398 4-methylbenzCc1ccc(cc1)C( 162 62485 http://www.s PHYSPROP
    23399 p-nitrobenzyl O=[N+]([O-])c 96.5 62486 http://www.s PHYSPROP
    23400 glycerol-beta-[O-][N+](=O) 54 62491 http://www.s PHYSPROP
    23401 dibenzylsulfo O=S(=O)(Cc1cc 152 62493 http://www.s PHYSPROP
    23402 ethanediamideO=C(Nc1ccccc 254 62499 http://www.s PHYSPROP
    23403 oxalic acid di O=C(OC1CCCC 43.5 62500 http://www.s PHYSPROP
    23404 benzene, 1-meCc2ccc(Cc1ccc -30 62501 http://www.s PHYSPROP x freezes at -15C after 16 days http://usefu
    23405 p-tolyltolueneCc2ccc(Cc1ccc 125 62501 http://www.s PHYSPROP x clearly a liquid at rt http://usefulchem.wi
    23406 4-ethyl-diphe CCc2ccc(Cc1cc -24 62502 http://www.s PHYSPROP
    23407 benzenamine,Cc1ccc(cc1)Nc 79.8 62504 http://www.s PHYSPROP
    23408 di(4-methylphCc1ccc(cc1)Sc 57.3 62505 http://www.s PHYSPROP
    23409 butanedioic acO=C(Oc1ccccc 121 62511 http://www.s PHYSPROP
    23410 3-propylphenoOc1cc(CCC)cc 26 62513 http://www.s PHYSPROP
    23411 3-ethoxynitroCCOc1cccc(c1) 36 62519 http://www.s PHYSPROP
    23412 phenoxyacetaNC(=O)COc1cc 102 62524 http://www.s PHYSPROP
    23413 phenylazide N#N=Nc1cccc -27.5 62529 http://www.s PHYSPROP
    23414 pyridine, 2-pr CCCc1ccccn1 2 62530 http://www.s PHYSPROP
    23415 o-phenyl car O=C(N)Oc1ccc 150 62532 http://www.s PHYSPROP
    23416 benzenamine,Cc1ccc(NO)cc 96 62542 http://www.s PHYSPROP
    23417 acetamide, n-CC(=O)NC(=O 180.5 62546 http://www.s PHYSPROP
    23418 hexadecanoic O=C(CCCCCCC 64 62548 http://www.s PHYSPROP
    23419 octanoic acid,O=C(CCCCCCC -1 62549 http://www.s PHYSPROP
    23420 n,n'-dipropyluCCCNC(=O)NC 105 62552 http://www.s PHYSPROP
    23421 ethanol, 2-chlClCCOC(=O)OC 8 62554 http://www.s PHYSPROP
    23422 hexadecanoic O=C(CCCCCCC
    a 72 62556 http://www.s PHYSPROP
    23423 dodecanoic aciO=C(CCCCCCC 56.6 62557 http://www.s PHYSPROP
    23424 heptanoic acidCCCCCCCOC(= -33 62559 http://www.s PHYSPROP
    23425 octanoic acid,O=C(CCCCCCC -46.2 62560 http://www.s PHYSPROP
    23426 isonitrobutan CC(C)C[N+]([O -76.85 62576 http://www.s PHYSPROP
    23427 2,5-diiodothi Ic1ccc(I)s1 41.5 62577 http://www.s PHYSPROP
    23428 3,5-dibromopyBrc1cncc(Br)c 112 62578 http://www.s PHYSPROP
    23429 benzene, 1,3- BrCc1cccc(CBr 77 62581 http://www.s PHYSPROP
    23430 1,3-benzenedOCc1cccc(CO) 57 62582 http://www.s PHYSPROP
    23431 acetonitrile, N#CCc1cccc(c 33.5 62583 http://www.s PHYSPROP
    23432 heptanoic aci O=C(CCCCCC) -12.4 62584 http://www.s PHYSPROP
    23433 tetradecanoic O=C(CCCCCCC 53.4 62585 http://www.s PHYSPROP
    23434 carbamic acid,NC(=O)NC(=O 196.5 62588 http://www.s PHYSPROP
    23435 acetic acid, (e O=C(O)CSCC -8.5 62595 http://www.s PHYSPROP
    23436 2-methyl-4-niCC(C)CC[N+]([ 97 62604 http://www.s PHYSPROP
    23437 octadecanoic aCC(C)CCOC(= 25.5 62605 http://www.s PHYSPROP
    23438 1,5-hexadiyneC#CCCC#C -6 62610 http://www.s PHYSPROP
    23439 1,4-butanediolO=C(C)OCCCC 12 62618 http://www.s PHYSPROP
    23440 ethanol, 2,2'- O=C(C)OCCOC 18 62619 http://www.s PHYSPROP
    23441 acetonitrile, 2N#CCNCC#N 70 62621 http://www.s PHYSPROP
    23442 octanamide NC(=O)CCCCC 108 62622 http://www.s PHYSPROP
    23443 thiocyanic aci N#CSCCSC#N 90 62624 http://www.s PHYSPROP
    23444 3-tetradecan CCC(=O)CCCC 34 62626 http://www.s PHYSPROP
    23445 1,8-octanedioOCCCCCCCCO 63 62628 http://www.s PHYSPROP
    23446 hexadecanamNC(=O)CCCCC 107 62629 http://www.s PHYSPROP
    23447 heptane, 1,1'-CCCCCCCSCCC 70 62630 http://www.s PHYSPROP
    23448 2-nonadecanoCC(=O)CCCCC 57 62631 http://www.s PHYSPROP
    23449 hexadecanenitCCCCCCCCCCC 31 62632 http://www.s PHYSPROP
    23450 octadec-1-yneCCCCCCCCCCC 22.5 62633 http://www.s PHYSPROP
    23451 1,2-dibromo-1BrC(Cl)(Cl)C(Br 202.5 62634 http://www.s PHYSPROP
    23452 sulfasomizole O=S(=O)(Nc1cc 192 62641 http://www.s PHYSPROP
    23453 benzene, 1,1',c1ccccc1C(=C( 225 62645 http://www.s PHYSPROP
    23454 1,2,5,6-tetra Oc3ccc2c(C(= 340 62648 http://www.s PHYSPROP
    23455 1,3-isobenzofuO=C1OC(=O)c2c1 327.5 62649 http://www.s PHYSPROP
    23456 1,3-dimethyl-2Cc1c(cc(c(C)c 184 62650 http://www.s PHYSPROP
    23457 2-chloro-4-meCc1cc(Cl)nc2c 59 62656 http://www.s PHYSPROP
    23458 1,2,4,5-benzenCOC(=O)c1cc( 144 62662 http://www.s PHYSPROP
    23459 benzene, 1,2,4CC(C)c1cc(c(c 118.4 62663 http://www.s PHYSPROP
    23460 5-chloroquinoClc1cccc2nccc 45 62665 http://www.s PHYSPROP
    23461 1,2,3,4-tetrahc1ccc2NCCCc2 20 62667 http://www.s PHYSPROP
    23462 benzoic acid, O=C(O)c1cccc 191 62668 http://www.s PHYSPROP
    23463 1-cyclohexeneO=C(O)C=1CC 38 62677 http://www.s PHYSPROP
    23464 octadecanoic aO=C(Oc1cccc 52 62684 http://www.s PHYSPROP
    23465 butanoic acid,O=C(CCl)CC(= -8 62690 http://www.s PHYSPROP
    23466 octadecanoic O=C(CCCCCCC 72 62691 http://www.s PHYSPROP
    23467 1,3-diacetylurCC(=O)NC(=O) 154.5 62693 http://www.s PHYSPROP
    23468 tetradecanamNC(=O)CCCCC 104 62698 http://www.s PHYSPROP
    23469 chlorodiiodo ClC(I)I -4 62699 http://www.s PHYSPROP
    23470 pentane, undeFC(F)(C(F)(F)C( -50 62700 http://www.s PHYSPROP
    23471 1,2,5-trimeth Cc2cccc1c2ccc 33.5 62707 http://www.s PHYSPROP
    23472 3',4',5-trichlo Clc2ccc(NC(=O 247 62712 http://www.s PHYSPROP
    23473 1,2,3,4-tetrahOc2c(OC)c(cc 187.5 62716 http://www.s PHYSPROP
    23474 octanoic acid, NC(CCCCCC)C 270 62727 http://www.s PHYSPROP
    23475 dodecanoic acO=C(CCCCCCC 41.8 62731 http://www.s PHYSPROP
    23476 succinic acid O=C(CCC(=O) -10.8 62732 http://www.s PHYSPROP
    23477 1,7-diaminoh NCCCCCCCN 28.9 62737 http://www.s PHYSPROP
    23478 6-2 ftoh FC(F)(C(F)(F)C -35 62741 http://www.s PHYSPROP
    23479 tetrafluorophtFc1c(c(c(F)c( 163 62748 http://www.s PHYSPROP
    23480 tetrafluorophtO=C1OC(=O)c2c 95 62749 http://www.s PHYSPROP
    23481 pentafluoroa Fc1c(c(F)c(F)c 130.5 62750 http://www.s PHYSPROP
    23482 2,3,4,5,6-pen Fc1c(c(F)c(F)c 147 62751 http://www.s PHYSPROP
    23483 benzoic acid, Cc1c(F)c(F)c( 174 62752 http://www.s PHYSPROP
    23484 2,3,5,6-tetraf Fc1c(F)cc(F)c 92 62756 http://www.s PHYSPROP
    23485 pentafluorophFc1c(CC(=O)O) 109 62757 http://www.s PHYSPROP
    23486 4-nitrosoben Nc1ccc(N=O)c 173.5 62778 http://www.s PHYSPROP
    23487 1h-imidazole, c1ccc(cc1)c2n 149.3 62795 http://www.s PHYSPROP
    23488 clofenamide O=S(N)(=O)c1c 207 62797 http://www.s PHYSPROP
    23489 methylphospho
    CP(F)(F)=O -37.2 62813 http://www.s PHYSPROP
    23490 1,2,2,3-tetrac FC(Cl)(F)C(Cl)( -42.9 62818 http://www.s PHYSPROP
    23491 8-2 ftoh FC(F)(C(F)(F)C 47 62822 http://www.s PHYSPROP
    23492 hfc-245 (pent FCC(F)(F)C(F)F -82 62827 http://www.s PHYSPROP
    23493 bromoacetamBrCC(N)=O 89 62834 http://www.s PHYSPROP
    23494 1,3-butadiene,F/C(F)=C(F)C(F -132 62837 http://www.s PHYSPROP
    23495 propanedioic aO=C(OCC)C(Br -54 62838 http://www.s PHYSPROP
    23496 2-butyne, 1,1,FC(F)(F)C#CC(F -117.4 62855 http://www.s PHYSPROP
    23497 tetrafluoroet FC1(F)OC1(F)F -118 62865 http://www.s PHYSPROP
    23498 pyridine, 4-(1 CC(C)c1ccncc1 -54.9 62875 http://www.s PHYSPROP
    23499 benzene, 1-io Ic1ccc(OC)cc1 53 62877 http://www.s PHYSPROP
    23500 4-bromobenz O=C(N)c1ccc(B 191.5 62884 http://www.s PHYSPROP
    23501 cyclohexaneprO=C(O)CCC1C 16 62903 http://www.s PHYSPROP
    23502 di-thiophen-2O=C(c1sccc1)c 90 62914 http://www.s PHYSPROP
    23503 2,4-dimethoxyCOc1cc(cc(O) 70 62925 http://www.s PHYSPROP
    23504 benzene, 1,2- COc1cc(ccc1OC 98 62928 http://www.s PHYSPROP
    23505 4-trifluormet FC(F)(F)c1ccc 31 62931 http://www.s PHYSPROP
    23506 ethanone, 1-( CC(=O)c2ccc1 101 62933 http://www.s PHYSPROP
    23507 ethanol, 2-(1- OCCOc2cccc1c 45 62934 http://www.s PHYSPROP
    23508 benzene, 1-meCc2ccccc2Cc1 6.6 62938 http://www.s PHYSPROP
    23509 benzene, 1,1'-CCCC(c1ccccc1 27 62952 http://www.s PHYSPROP
    23510 dipentamethyS=C(SC(=S)N1 110 62961 http://www.s PHYSPROP
    23511 di-p-tolyl-car Cc2ccc(/N=C=N 58.5 62962 http://www.s PHYSPROP
    23512 2-(trifluorom FC(F)(F)c2ccc 61 62963 http://www.s PHYSPROP
    23513 3-(trifluorom FC(F)(F)c1ccc 52.5 62965 http://www.s PHYSPROP
    23514 4-(trifluorom FC(F)(F)c1ccc 115 62966 http://www.s PHYSPROP
    23515 benzene, 1,1'-O=[N+]([O-])c 181 62975 http://www.s PHYSPROP
    23516 2-butynedioic O=C(C#CC(=O 1.5 63002 http://www.s PHYSPROP
    23517 nonanoyl chloClC(=O)CCCCC -60.5 63017 http://www.s PHYSPROP
    23518 1-dodecyne CCCCCCCCCCC -19 63019 http://www.s PHYSPROP
    23519 1-pentadecynC#CCCCCCCCC 10 63022 http://www.s PHYSPROP
    23520 cyclopropana NC1CC1 -35.4 63025 http://www.s PHYSPROP
    23521 1,2-dimethyl- CC=1CCCC=1C -90.4 63026 http://www.s PHYSPROP
    23522 cyclohexanecaN#CC1CCCCC1 11 63031 http://www.s PHYSPROP
    23523 cyclohexyl-hy OOC1CCCCC1 -20 63032 http://www.s PHYSPROP
    23524 4-aminobenzo-
    Nc1cccc2nsnc 68 63042 http://www.s PHYSPROP
    23525 benzenamine,Cc1cccc(C)c1N -36 63049 http://www.s PHYSPROP
    23526 nicotinonitril N#Cc1c(C)cc( 286 63052 http://www.s PHYSPROP
    23527 2,3,5,6-tetraf Fc1cc(F)c(F)c( 38 63054 http://www.s PHYSPROP
    23528 benzenamine,CC(C)(C)c1ccc 17 63057 http://www.s PHYSPROP
    23529 1,2,3,4-tetra OOC2CCCc1cc 56 63062 http://www.s PHYSPROP
    23530 indole, 3-carbO=C(O)c2cnc1 206.5 63063 http://www.s PHYSPROP
    23531 2,3-naphthal Nc1cc2ccccc2 199 63067 http://www.s PHYSPROP
    23532 piperidine, 4- c1cc(ccc1)C2 60.5 63068 http://www.s PHYSPROP
    23533 1,3-dioxane, 2c1cc(ccc1)C2 41 63069 http://www.s PHYSPROP
    23534 benzonitrile, Fc1c(C#N)c(F)c 2.4 63077 http://www.s PHYSPROP
    23535 piperidine, 1- O=C(c1ccccc1 49 63087 http://www.s PHYSPROP
    23536 2-propanone, O=C(C)C(c1ccc 46 63102 http://www.s PHYSPROP
    23537 9-oxo-9h-fluorO=C(O)c2ccc3 341 63108 http://www.s PHYSPROP
    23538 silane, triphenc1ccccc1[SiH] 42.4 63117 http://www.s PHYSPROP
    23539 silanol, triphe O[Si](c1ccccc 154.8 63119 http://www.s PHYSPROP
    23540 p-anisic anhydCOc1ccc(cc1) 94.5 63122 http://www.s PHYSPROP
    23541 1,1,2-trichlor ClCC(Cl)(Cl)F -140 63131 http://www.s PHYSPROP
    23542 chlorosulfuric ClS(=O)(=O)O -70 63132 http://www.s PHYSPROP
    23543 2-propanone, BrCC(=O)CBr 26 63145 http://www.s PHYSPROP
    23544 acetic acid, o CC(=O)OCCCC 34.5 63160 http://www.s PHYSPROP
    23545 hexadecane, 1C=COCCCCCCC 16 63163 http://www.s PHYSPROP
    23546 3-nitrothioph [O-][N+](=O)c 78.5 63166 http://www.s PHYSPROP
    23547 1,4-benzenediOc1ccc(O)cc1 90 63180 http://www.s PHYSPROP
    23548 phosphonic diClP(=O)(Cl)c1 1 63182 http://www.s PHYSPROP
    23549 4-methoxybenz
    COc1ccc(CCl)c 24.5 63185 http://www.s PHYSPROP
    23550 2,6-dimethylqCc1ccc2nccc(C 22 63197 http://www.s PHYSPROP
    23551 benzoxazole, c1cccc2oc(nc1 103 63220 http://www.s PHYSPROP
    23552 methanone, biO=C(c1ccccc1 59.5 63228 http://www.s PHYSPROP
    23553 formamide oxCN=O 2.5 63264 http://www.s PHYSPROP
    23554 undecafluoro-FC(C(F)(F)C(F)( -115 63270 http://www.s PHYSPROP
    23555 cyclopropylbec1ccccc1C2CC -31 63300 http://www.s PHYSPROP
    23556 2,4(1h,3h)-py CN1C(=O)C=C 120 63310 http://www.s PHYSPROP
    23557 1h-indole, 1,3Cc2cn(C)c1ccc 142 63318 http://www.s PHYSPROP
    23558 benzenamine,Nc1ccc(Br)cc1 111.5 63320 http://www.s PHYSPROP
    23559 1,3-dimethyl- Cc1c(Cl)c(C)c( 223 63327 http://www.s PHYSPROP
    23560 3-methoxysalicOc1c(cccc1OC 151 63328 http://www.s PHYSPROP
    23561 phenol, 4-(1,1Cc1cc(cc(C)c1 82.4 63338 http://www.s PHYSPROP
    23562 1-methyl-4-ni[O-][N+](=O)c 71.5 63342 http://www.s PHYSPROP
    23563 2-naphthaleneO=C(OC)c1cc2 75.5 63350 http://www.s PHYSPROP
    23564 1-propanone, O=C(CCN1CCCC
    1 211.5 63359 http://www.s PHYSPROP
    23565 2-chloro-2,3, CC(C)(C)C(C)(C 136 63378 http://www.s PHYSPROP
    23566 n-methylolmeC=C(C)C(=O)N -37 63394 http://www.s PHYSPROP
    23567 propane, 2-(e CC(C)(C)OC=C -112 63406 http://www.s PHYSPROP
    23568 1,3-dithiole-2 S=C1SC=CS1 49 63439 http://www.s PHYSPROP
    23569 4-cyclopentenO=C1C=CC(=O 37 63443 http://www.s PHYSPROP
    23570 2,4-dimethyl- Cc1cnc(C)n1 92 63444 http://www.s PHYSPROP
    23571 maleimide, n-O=C1C=CC(=O 95 63446 http://www.s PHYSPROP
    23572 1h-imidazole, Cc1cnc(CC)n1 50.5 63447 http://www.s PHYSPROP
    23573 6-azathymine O=C1NC(=O)C 211 63453 http://www.s PHYSPROP
    23574 cyclopentaneaCC(=O)OC1CC 13.5 63457 http://www.s PHYSPROP
    23575 7-methylindolCc1cccc2ccnc 85 63459 http://www.s PHYSPROP
    23576 2-pyridinecar Oc1cccnc1C(= 195 63461 http://www.s PHYSPROP
    23577 3-furan-2-yl-pOC(=O)CCc1cc 58 63470 http://www.s PHYSPROP
    23578 8-methoxyquiCOc1cccc2ccc 49.5 63493 http://www.s PHYSPROP
    23579 1-propanone, O=C(CC)c1cc( 2 63494 http://www.s PHYSPROP
    23580 propiophenone
    O=C(CC)c1cc( 96.5 63495 http://www.s PHYSPROP
    23581 (2-naphthyl) BrCc1ccc2ccc 56 63503 http://www.s PHYSPROP
    23582 (4-chlorophenO=C(CCC)c1ccc 19.5 63504 http://www.s PHYSPROP
    23583 p-methylpheno
    O=C(O)COc1cc 141 63512 http://www.s PHYSPROP
    23584 5,6-dichloro- Clc1cc2C(=O) 188 63515 http://www.s PHYSPROP
    23585 5-methyl-2-phCC1=CC(=O)N( 128 63516 http://www.s PHYSPROP
    23586 1-hexanone, 1O=C(CCCCC)c1 27 63518 http://www.s PHYSPROP
    23587 phenoxyisobutCC(C)(Oc1ccc 98.5 63524 http://www.s PHYSPROP
    23588 benzyl phenylC(Oc1ccccc1)c 40 63533 http://www.s PHYSPROP
    23589 [1,1'-biphenylOC(=O)c2cccc 114.3 63538 http://www.s PHYSPROP
    23590 porphazinamiO=C(NCN1CCO 118.5 63555 http://www.s PHYSPROP
    23591 furan, 2,5-dip c1ccc(cc1)c2c 91 63567 http://www.s PHYSPROP
    23592 opromazine CN(C)CCCN2c1 115 63592 http://www.s PHYSPROP
    23593 silane, methylC[SiH3] -156.5 63613 http://www.s PHYSPROP
    23594 silane, trimethC[SiH](C)C -135.9 63614 http://www.s PHYSPROP
    23595 silanamine, n,C[Si](C)(C)N=C -23 63651 http://www.s PHYSPROP
    23596 2(1h)-pyridin CC1=CC=CNC1 141.5 63658 http://www.s PHYSPROP
    23597 2,4-dimethylsCC1CC(C)CS1( -3 63660 http://www.s PHYSPROP
    23598 1h-pyrrole, 2, Cc1nc(C)c(C)c 111 63661 http://www.s PHYSPROP
    23599 cyclohexanoneO=C1CCCCC1C 72.5 63664 http://www.s PHYSPROP
    23600 morpholine, 4CCCCN1CCOC -57.1 63672 http://www.s PHYSPROP
    23601 2-quinolineet OCCc1ccc2ccc 103 63703 http://www.s PHYSPROP
    23602 3-bromophenyO=C(c1cc(Br)c 81 63718 http://www.s PHYSPROP
    23603 1-hexyl-3,7-d O=C2c1n(C)cn 82.5 63738 http://www.s PHYSPROP
    23604 pentafluorophFc2c(Sc1c(F)c( 87 63755 http://www.s PHYSPROP
    23605 3-(2-pyridyl)- c1cc(ccc1)c2n 192 63757 http://www.s PHYSPROP
    23606 butanedioic a OC(=O)CCC(= 8 63778 http://www.s PHYSPROP
    23607 hexyl silane CCCCCC[SiH3] -98 63785 http://www.s PHYSPROP
    23608 hexanedial O=CCCCCC=O -8 63788 http://www.s PHYSPROP
    23609 1-butyne, 3-c C#CC(C)(C)Cl -61 63845 http://www.s PHYSPROP
    23610 2,4-dimethyl- CC(C)/C(=NO) 34 63851 http://www.s PHYSPROP
    23611 triisobutyl bo CC(C)CB(CC(C) -88 63857 http://www.s PHYSPROP
    23612 pentanoic acidO=C(CCCC)OC -63.1 63860 http://www.s PHYSPROP
    23613 butanoic acid,O=C(C)CC(=O -85 63867 http://www.s PHYSPROP
    23614 hept-6-enoic C=CCCCCC(=O -6.5 63871 http://www.s PHYSPROP
    23615 nonanamide NC(=O)CCCCC 99.5 63875 http://www.s PHYSPROP
    23616 3-amino-1,2,4-Nc1nccnn1 175.5 63880 http://www.s PHYSPROP
    23617 n-methylsucciO=C1CCC(=O) 71 63882 http://www.s PHYSPROP
    23618 o-mercaptophOc1ccccc1S 5.5 63883 http://www.s PHYSPROP
    23619 glutarimide O=C1CCCC(=O 156 63891 http://www.s PHYSPROP
    23620 benzaldehydeO=Cc1ccc(Br)c 67 63906 http://www.s PHYSPROP
    23621 1-methylcycloOC(=O)C1(C)C 37.5 63909 http://www.s PHYSPROP
    23622 2,4-dichloro- Cc1cc(O)c(Cl)c 73 63922 http://www.s PHYSPROP
    23623 5-isoquinolin Nc2cccc1cncc 128 63931 http://www.s PHYSPROP
    23624 3-methyl-1-phCc1ccn(n1)c2c 37 63948 http://www.s PHYSPROP
    23625 1h-pyrazol-5- Nc2cc(C)nn2c 116 63966 http://www.s PHYSPROP
    23626 5,6,7,8-tetrahO=C(O)c1ccc2 155.5 63969 http://www.s PHYSPROP
    23627 mops O=S(=O)(O)C 284 63972 http://www.s PHYSPROP
    23628 caps O=S(=O)(O)C 302.5 63979 http://www.s PHYSPROP
    23629 1-butyl theob O=C2c1n(C)cn 108 63999 http://www.s PHYSPROP
    23630 methanone, (4O=[N+]([O-])c 138 64003 http://www.s PHYSPROP
    23631 5-furfuryl-5-i CC(C)C2(Cc1c 169 64008 http://www.s PHYSPROP
    23632 1h-indene-1,3(Clc1ccc(cc1) 145.5 64010 http://www.s PHYSPROP
    23633 2,2':6',2''-ter c1nc(ccc1)c2c 90 64012 http://www.s PHYSPROP
    23634 etidin CC=1NC(C)=C( 180.5 64013 http://www.s PHYSPROP
    23635 3,5,4'-tricl sal Oc1c(cc(Cl)cc 142.5 64017 http://www.s PHYSPROP
    23636 disulfide, bis( [O-][N+](=O)c 196.5 64024 http://www.s PHYSPROP
    23637 moxaverine COc1cc3c(cc1 78.5 64045 http://www.s PHYSPROP
    23638 9-dicyanometh[O-][N+](=O)c 267 64057 http://www.s PHYSPROP
    23639 tetraphenoxysO(c1ccccc1)[S 49 64059 http://www.s PHYSPROP
    23640 sulfuryl chlor ClS(=O)(=O)N -44 64080 http://www.s PHYSPROP
    23641 octadecanoic aCCCCCCCCCCC 57 64086 http://www.s PHYSPROP
    23642 cyclopropane,CCC1CC1 -149.2 64095 http://www.s PHYSPROP
    23643 4-pyrimidinol,Clc1cc(O)nc(N 261.5 64110 http://www.s PHYSPROP
    23644 1h-indole, 2,5Cc1cc2cc(C)nc 115.3 64126 http://www.s PHYSPROP
    23645 p-cyano-n,n-dCN(C)c1ccc(C 74 64128 http://www.s PHYSPROP
    23646 5-bromo-8-hyd
    Oc1ccc(Br)c2c 124 64135 http://www.s PHYSPROP
    23647 2-amino-4-terNc1cc(ccc1O)C 161 64143 http://www.s PHYSPROP
    23648 (4-bromobutoBrCCCCOc1ccc 41 64147 http://www.s PHYSPROP
    23649 3-indolylacet CC(=O)Cc2cnc 116 64150 http://www.s PHYSPROP
    23650 dl-alanine, n- O=C(NC(C)C(= 165.5 64163 http://www.s PHYSPROP
    23651 1,4-benzenedio
    O=C(C)Oc1ccc 123.5 64166 http://www.s PHYSPROP
    23652 acridine, 9-ch Clc1c3ccccc3n 121 64173 http://www.s PHYSPROP
    23653 4-bis(2-chlor ClCCN(CCCl)c1 86.5 64178 http://www.s PHYSPROP
    23654 adrenoglomerCC2NCCc1c3cc 150.5 64188 http://www.s PHYSPROP
    23655 n-o-tolyl-ben O=C(Nc1ccccc 145.5 64254 http://www.s PHYSPROP
    23656 2-[(6-chloro-3CCN(CC)C(=O) 97 64258 http://www.s PHYSPROP
    23657 valpromide CCCC(CCC)C(N 125 64264 http://www.s PHYSPROP
    23658 clobenfurol Clc1ccc(cc1)C 48.5 64279 http://www.s PHYSPROP
    23659 fencibutirol OC1(CCC(CC1) 157 64310 http://www.s PHYSPROP
    23660 enrofloxacin CCN1CCN(CC1) 220 64326 http://www.s PHYSPROP
    23661 2-propanol, 1 CC(C)NCC(O)C 82.5 64348 http://www.s PHYSPROP
    23662 etofenprox CCOc1ccc(cc1) 37 64377 http://www.s PHYSPROP
    23663 alpiropride C=CCN2CCCC2C 168.75 64384 http://www.s PHYSPROP
    23664 azamethiphosO=P(OC)(OC)S 89 64559 http://www.s PHYSPROP
    23665 2-phenylquinoc1cccc2ccc(nc 86 64618 http://www.s PHYSPROP
    23666 heptadecanal CCCCCCCCCCC 36 64625 http://www.s PHYSPROP
    23667 p-fluorobenz O=C(N)c1ccc(F 155.5 64644 http://www.s PHYSPROP
    23668 methestrol Cc1cc(ccc1O)C 145 64688 http://www.s PHYSPROP
    23669 chloral forma ClC(Cl)(Cl)C( 120 64699 http://www.s PHYSPROP
    23670 3,5-dihydroxyOc1cc(O)cc(O 80.3 64709 http://www.s PHYSPROP
    23671 3-ccl3 hydrochNS(=O)(=O)c2c 301.5 64716 http://www.s PHYSPROP
    23672 benmoxine CC(NNC(=O)c1 93.5 64728 http://www.s PHYSPROP
    23673 fenozolone CCNC1=NC(=O) 148 64736 http://www.s PHYSPROP
    23674 fomocaine C(CCN1CCOCC1 52.5 64745 http://www.s PHYSPROP
    23675 clobuzarit Clc1ccc(cc1)c 154.5 64749 http://www.s PHYSPROP
    23676 2-propanol, 1 CC(C)NCC(O)C 96 64750 http://www.s PHYSPROP
    23677 tetrantoin O=C3NC(=O)N 267.5 64772 http://www.s PHYSPROP
    23678 lufenuron Clc2cc(NC(=O) 166 64813 http://www.s PHYSPROP
    23679 paraflutizide NS(=O)(=O)c3c 239 64829 http://www.s PHYSPROP
    23680 amphotalide Nc1ccc(cc1)O 113.5 64830 http://www.s PHYSPROP
    23681 pentaerythritoOCC(CCl)(CCl) 83 64837 http://www.s PHYSPROP
    23682 fluoresone Fc1ccc(cc1)S( 41 64838 http://www.s PHYSPROP
    23683 1h-imidazole-1Cc1ncc([N+]([ 76 64839 http://www.s PHYSPROP
    23684 benfurodil he O=C(O)CCC(=O 144 64841 http://www.s PHYSPROP
    23685 chlorphenoxaClC(Cl)C(=O)N 136 64843 http://www.s PHYSPROP
    23686 chlormidazoleClc1ccc(cc1)C 227.5 64845 http://www.s PHYSPROP x salt - AL
    23687 nicoclonate Clc1ccc(cc1)C 61 64871 http://www.s PHYSPROP
    23688 nitrefazole [O-][N+](=O)c 186 64912 http://www.s PHYSPROP
    23689 indenolol CC(C)NCC(O)C 88.5 64962 http://www.s PHYSPROP
    23690 epanolol Oc1ccc(cc1)C 119 65013 http://www.s PHYSPROP
    23691 pheneturide CCC(C(=O)NC( 162 65046 http://www.s PHYSPROP
    23692 cyclobutyrol OC1(CCCCC1)C 81.5 65051 http://www.s PHYSPROP
    23693 4-piperidinamCN1CCC(CC1)N 115 65061 http://www.s PHYSPROP
    23694 cyclarbamate O=C(OCC1(CCC 151.5 65062 http://www.s PHYSPROP
    23695 etisazol CCNc2nsc1ccc 78 65065 http://www.s PHYSPROP
    23696 .alpha.-l-xylo O=C(O)C23OC1 74 65070 http://www.s PHYSPROP
    23697 bufeniode Ic1cc(cc(I)c1 212 65072 http://www.s PHYSPROP
    23698 suclofenide NS(=O)(=O)c1c 206 65079 http://www.s PHYSPROP
    23699 parsalmide CCCCNC(=O)c1 84 65080 http://www.s PHYSPROP
    23700 fenoverine O=C(CN3CCN(C 141.5 65083 http://www.s PHYSPROP
    23701 vinylbital O=C1NC(=O)NC 91 65109 http://www.s PHYSPROP
    23702 2-(2-cl-4-me- Cc2cc(Cl)c(N 149 65112 http://www.s PHYSPROP
    23703 tioxolone Oc1cc2OC(=O) 160 65113 http://www.s PHYSPROP
    23704 p-aminosalicylO=C(NN)c1ccc 195 65402 http://www.s PHYSPROP
    23705 thujic acid CC1(C)C=CC=C 88.5 65494 http://www.s PHYSPROP
    23706 chimyl alcoholOC(CO)COCCC 64 65572 http://www.s PHYSPROP
    23707 dibenz c,e oxeO=C1OC(=O)c3 217 65630 http://www.s PHYSPROP
    23708 2-phenyl-4,5- O=C2C(Cl)=C( 162 65649 http://www.s PHYSPROP
    23709 chaulmoogric O=C(O)CCCCC 68.5 65685 http://www.s PHYSPROP
    23710 phenol, 4-bro Oc1ccc(Br)c(C 63.5 65689 http://www.s PHYSPROP
    23711 xanthydrol OC1c3ccccc3O 127.5 65693 http://www.s PHYSPROP
    23712 2-(2-chlorophClc1ccccc1OC 113 65694 http://www.s PHYSPROP
    23713 propanoic aci Clc1ccccc1OC 114 65694 http://www.s PHYSPROP
    23714 bis-(4-bromo O=C(c1ccc(Br) 177 65700 http://www.s PHYSPROP
    23715 1-(4-iodo-pheO=C(C)c1ccc(I 86 65701 http://www.s PHYSPROP
    23716 benzenebutano
    O=C(CCC(=O)O 118 65703 http://www.s PHYSPROP
    23717 1-piperidinec NC(=O)N1CCC 105 65719 http://www.s PHYSPROP
    23718 morpholine, 4,C(CN1CCOCC1 75 65720 http://www.s PHYSPROP
    23719 3-nitrodibenz [O-][N+](=O)c 181.5 65729 http://www.s PHYSPROP
    23720 1h-pyrrole, 2-c1ccc(cc1)c2c 129 65730 http://www.s PHYSPROP
    23721 indole-2-carboO=C(O)c1cc2c 206.5 65731 http://www.s PHYSPROP
    23722 benzonitrile, N#Cc1ccccc1N 51 65745 http://www.s PHYSPROP
    23723 2-pyridineproOCCCc1ccccn 34 65754 http://www.s PHYSPROP
    23724 4-pyridineproOCCCc1ccncc 37 65755 http://www.s PHYSPROP
    23725 p-butoxybenzoO=C(O)c1ccc( 148.5 65785 http://www.s PHYSPROP
    23726 1h-indole-2-caO=C(OCC)c1cc 123.5 65903 http://www.s PHYSPROP
    23727 benzaldehyde,CC(C)(C)c1cc( 186 65974 http://www.s PHYSPROP
    23728 nicosulfuron O=S(=O)(NC(= 142 66024 http://www.s PHYSPROP
    23729 triasulfuron Cc2nc(NC(=O) 186 66025 http://www.s PHYSPROP
    23730 butanedioic acO=C(O)CC(Br) 161 66239 http://www.s PHYSPROP
    23731 bromosuccinicO=C(O)CC(Br) 161 66239 http://www.s PHYSPROP
    23732 prochloraz O=C(N(CCOc1c( 48 66316 http://www.s PHYSPROP
    23733 flurprimidol OC(C(C)C)(c1c 95 66319 http://www.s PHYSPROP
    23734 oxirane, 2-(3, ClC(Cl)(Cl)CC1 42.8 66320 http://www.s PHYSPROP
    23735 clofentezine Clc3ccccc3c1n 182 66321 http://www.s PHYSPROP
    23736 isoxaben CCC(C)(CC)c2 177.5 66323 http://www.s PHYSPROP
    23737 harmony O=S(=O)(NC(= 176 66325 http://www.s PHYSPROP
    23738 flusilazole C[Si](Cn1cncn1 54 66326 http://www.s PHYSPROP
    23739 silane, ethoxyCCO[Si](c1ccc 65 66340 http://www.s PHYSPROP
    23740 9,10-anthraceCc3ccc(C)c2c 140.5 66343 http://www.s PHYSPROP
    23741 benzenamine,C=Cc1ccc(N)c 23.5 66344 http://www.s PHYSPROP
    23742 benzamide, 3,COc1cc(ccc1O 164 66348 http://www.s PHYSPROP
    23743 propane, 1,3-dICC(CI)(CI)CI 225 66350 http://www.s PHYSPROP
    23744 silane, trimet C[Si](C)(C)Oc1 -55 66363 http://www.s PHYSPROP
    23745 1,1-diphenylpCCC(c1ccccc1) 13.3 66369 http://www.s PHYSPROP
    23746 1-isoquinolin Nc2nccc1cccc 104 66384 http://www.s PHYSPROP
    23747 1-isoquinolin Nc2nccc1cccc 123 66384 http://www.s PHYSPROP
    23748 4-bromoisoquiBrc2cncc1ccc 41.5 66385 http://www.s PHYSPROP
    23749 3-tridecanoneCCC(=O)CCCC 31 66392 http://www.s PHYSPROP
    23750 2,3,4,5,6-pen Fc1c(c(F)c(F)c 37 66396 http://www.s PHYSPROP
    23751 4-thiazolidinoO=C2CSC(=S)N 194.5 66456 http://www.s PHYSPROP
    23752 oxanilic acid,eO=C(Nc1ccccc 65.5 66460 http://www.s PHYSPROP
    23753 1-hydroxy-1-mCC1(O)CCCC1 36 66464 http://www.s PHYSPROP
    23754 phenol, 4,4'-( Oc1ccc(cc1)C(c 162 66498 http://www.s PHYSPROP
    23755 9-butyl-9h-ca CCCCn3c1cccc 58 66506 http://www.s PHYSPROP
    23756 2-vinylfuran C=Cc1ccco1 -94 66515 http://www.s PHYSPROP
    23757 o-fluoronitro Fc1ccccc1[N+] -6 66528 http://www.s PHYSPROP
    23758 butanoic acid,O=C(CCCC(=O) 127.25 66547 http://www.s PHYSPROP
    23759 cyclodecanonO=C1CCCCCCC 28 66551 http://www.s PHYSPROP
    23760 2-(acetyloxy) Brc1cc(c(OC(C 60 66554 http://www.s PHYSPROP
    23761 cyclohexene, 1CCC=1CCCCC= -109.9 66568 http://www.s PHYSPROP
    23762 p-formylacetaO=C(C)Nc1ccc 157 66572 http://www.s PHYSPROP
    23763 carbonic dihy NNC(=O)NN 154 66578 http://www.s PHYSPROP
    23764 4-piperidinee OCCC1CCNCC 132.5 66582 http://www.s PHYSPROP
    23765 2-cyanoquinolN#Cc1ccc2ccc 95 66650 http://www.s PHYSPROP
    23766 3-aminorhodaS=C1SCC(=O) 101.5 66652 http://www.s PHYSPROP
    23767 morpholine, 4-O=C(CCl)N1C 37 66659 http://www.s PHYSPROP
    23768 2-hydroxy-benO=C(Cl)c1ccc 19 66660 http://www.s PHYSPROP
    23769 p-cyanoaceto O=C(C)c1ccc( 57.5 66663 http://www.s PHYSPROP
    23770 3,4-dimethyl- CC(C)(C)c1cc( 46 66667 http://www.s PHYSPROP
    23771 disilane, hexa C[Si](C)(C)[Si] 13.5 66675 http://www.s PHYSPROP
    23772 benzene, 1,1'-Cc1ccc(cc1)Oc 51 66712 http://www.s PHYSPROP
    23773 2,4-difluorobeOC(=O)c1ccc(F 189 66716 http://www.s PHYSPROP
    23774 1,2,3-propanetOC(CC(=O)OC) 79.3 66725 http://www.s PHYSPROP
    23775 2-naphthalen OCc1ccc2cccc 81.3 66741 http://www.s PHYSPROP
    23776 1-docosene C=CCCCCCCCC 38 66749 http://www.s PHYSPROP
    23777 2-thiazolaminCc1csc(N)n1 45.5 66754 http://www.s PHYSPROP
    23778 benzene, 1,4- CC(=C)c1ccc(c 63.5 66759 http://www.s PHYSPROP
    23779 1-(2-hydroxyeOCCn1ccnc1 39 66778 http://www.s PHYSPROP
    23780 2,7-octanedioCC(=O)CCCCC( 44 66805 http://www.s PHYSPROP
    23781 cyclopropane,CC1(C)CC1 -109 66810 http://www.s PHYSPROP
    23782 pyridazine, 3- Cc1cccnn1 184 66816 http://www.s PHYSPROP
    23783 3,4-pyridinediN#Cc1cnccc1 80 66819 http://www.s PHYSPROP
    23784 5-chloro-2-nitO=[N+]([O-])c 127.8 66825 http://www.s PHYSPROP
    23785 1,3,2-benzodiClP1Oc2ccccc 30 66839 http://www.s PHYSPROP
    23786 decanoic acid,CCCCCCCCCC( 9.7 66854 http://www.s PHYSPROP
    23787 1,10-phenanthr
    Cc3cnc2c(ccc1 278.5 66871 http://www.s PHYSPROP
    23788 1-heptanone, O=C(CCCCCC)c 16.4 66887 http://www.s PHYSPROP
    23789 4-methylpheny
    Cc1ccc(cc1)C -2 66889 http://www.s PHYSPROP
    23790 1-octanone, 1O=C(CCCCCCC) 22.8 66895 http://www.s PHYSPROP
    23791 1-dodecanone,O=C(CCCCCCCC 47 66896 http://www.s PHYSPROP
    23792 benzeneboroniOB(O)c1ccc(Cl 286.5 66902 http://www.s PHYSPROP
    23793 9h-fluoren-9-oOC3c1ccccc1c 153.5 66916 http://www.s PHYSPROP
    23794 di(difluorometFC(F)OC(F)F -123.15 66918 http://www.s PHYSPROP
    23795 1,4-benzendioOc2ccc(O)cc2 105.8 66949 http://www.s PHYSPROP
    23796 benzoyl chloriCc1cccc(c1)C( -23 66968 http://www.s PHYSPROP
    23797 benzoyl chloriO=C(Cl)c1cc(F -30 66969 http://www.s PHYSPROP
    23798 3-chloro-6-meClc1ccc(OC)nn 84.5 66995 http://www.s PHYSPROP
    23799 pyrimidine, 2-Clc1ncccn1 67 66996 http://www.s PHYSPROP
    23800 dodecanedioicO=C(CCCCCCC 31.9 67007 http://www.s PHYSPROP
    23801 heptanedioic aO=C(CCCCCC( -21 67008 http://www.s PHYSPROP
    23802 1,2,3,6,7,8-h C1CCc2ccc3CC 133 67009 http://www.s PHYSPROP
    23803 phosphine oxiO=P(CC)(c1ccc 122.5 67015 http://www.s PHYSPROP
    23804 2-methyl-4-is Cc1cc(ccc1O)C 8.6 67037 http://www.s PHYSPROP
    23805 phenol, 4,4'-i Oc2ccc(Nc1ccc 174.5 67049 http://www.s PHYSPROP
    23806 benzenebutano
    O=C(CC(C)C(= 141 67074 http://www.s PHYSPROP
    23807 pyrimidine, 2,Cc1cnc(Cl)nc1 26 67089 http://www.s PHYSPROP
    23808 1h-benzimidaz[O-][N+](=O)c 224 67105 http://www.s PHYSPROP
    23809 thiophene, 3-eCCc1ccsc1 -89.1 67111 http://www.s PHYSPROP
    23810 diallyl urea C=CCNC(=O)N 91.5 67117 http://www.s PHYSPROP
    23811 benzene, (octyCCCCCCCCOc1 8 67137 http://www.s PHYSPROP
    23812 2-oxo-pentanoCCCC(=O)C(=O 6.5 67142 http://www.s PHYSPROP
    23813 benzenamine,c1ccccc1NC2 16 67145 http://www.s PHYSPROP
    23814 tetrafluorophtFc1c(C#N)c(C# 83 67177 http://www.s PHYSPROP
    23815 2-nonynoic acO=C(O)C#CCC -8 67186 http://www.s PHYSPROP
    23816 tetramethoxyCOC(OC)(OC) -5 67188 http://www.s PHYSPROP
    23817 2(1h)-pyrimidO=C1NCCCN1 265 67190 http://www.s PHYSPROP
    23818 diphenyl-acetyO=C(Cl)C(c1cc 56.5 67212 http://www.s PHYSPROP
    23819 m-bromophenyl
    Brc1cc(CC(=O) 101 67228 http://www.s PHYSPROP
    23820 p-bromophenyl
    Brc1ccc(CC(=O 116 67229 http://www.s PHYSPROP
    23821 p-acetylphenoCC(=O)c1ccc( 176 67230 http://www.s PHYSPROP
    23822 2,2-diphenyl OCC(c1ccccc1) 64.5 67237 http://www.s PHYSPROP
    23823 p-trifluorome FC(F)(F)c1ccc 185 67257 http://www.s PHYSPROP
    23824 3-phenanthry Nc2ccc3ccc1c 143 67264 http://www.s PHYSPROP
    23825 2,6-difluorobeN#Cc1c(F)cccc 31 67268 http://www.s PHYSPROP
    23826 2-furancarboxy
    O=C(O)c1ccc( 109.5 67283 http://www.s PHYSPROP
    23827 piperidine, 1, C(CN1CCCCC1 -0.5 67305 http://www.s PHYSPROP
    23828 benzenamine,Nc1ccc(cc1)S(
    4 170 67334 http://www.s PHYSPROP
    23829 hetolin O=C(CC(c1ccc( 214 67336 http://www.s PHYSPROP
    23830 1h-indole, 1,2Cc2c1ccccc1n 18 67358 http://www.s PHYSPROP
    23831 decanenitrile CCCCCCCCCC# -17.9 67360 http://www.s PHYSPROP
    23832 pentyl sulfoxi CCCCCS(=O)C 58 67373 http://www.s PHYSPROP
    23833 3-methyl-4-amNc1ccncc1C 108.5 67378 http://www.s PHYSPROP
    23834 piperidine, 1- ClCCN1CCCCC 234.5 67393 http://www.s PHYSPROP x salt - AL
    23835 benzaldehyde,CCOc1cc(ccc1 22 67412 http://www.s PHYSPROP
    23836 6-cyanopurineN#CC=1NC=N 187.5 67423 http://www.s PHYSPROP
    23837 pyrimidine, 5 Cc1cncnc1 30.5 67424 http://www.s PHYSPROP
    23838 4-methylpyrimCc1cncnc1 32 67424 http://www.s PHYSPROP
    23839 1-hexanol, 3,3FC(F)(C(F)(F)C -58 67446 http://www.s PHYSPROP
    23840 1,3-diethoxybCCOc1cccc(c1 12.4 67462 http://www.s PHYSPROP
    23841 benzene, 1,2- CCOc1ccccc1 44 67466 http://www.s PHYSPROP
    23842 m-benzidine Nc1cc(ccc1)c2 93.5 67473 http://www.s PHYSPROP
    23843 oxalic acid bi CC(C)CCOC(=O -9 67475 http://www.s PHYSPROP
    23844 hexanoic acid O=C(CCCCC)O -41 67479 http://www.s PHYSPROP
    23845 1h-pyrrole, 1-c2cc(Cn1cccc1 15 67483 http://www.s PHYSPROP
    23846 1-isopropyl-4 CC(C)c1ccc(C= -44.7 67489 http://www.s PHYSPROP
    23847 pentanoic aci CCCCC(=O)OC -56.1 67515 http://www.s PHYSPROP
    23848 decanoic anhyO=C(CCCCCCC 24.7 67516 http://www.s PHYSPROP
    23849 benzene, 1-azBrc1ccc(N=N# 20 67560 http://www.s PHYSPROP
    23850 1,2,4-trifluor Fc1cc(F)c(F)cc -11 67565 http://www.s PHYSPROP
    23851 pyridine, 2-(2 C(Cc1ccccn1)c -3 67581 http://www.s PHYSPROP
    23852 methanone, (1O=C(c1ccccc1) 100 67593 http://www.s PHYSPROP
    23853 phosphine oxiCP(=O)(c1cccc 113 67594 http://www.s PHYSPROP
    23854 4-nitrophenyl S=C=Nc1ccc(cc 111 67597 http://www.s PHYSPROP
    23855 1-chloro-3-(t ClC(Cl)(Cl)c1c 0.6 67604 http://www.s PHYSPROP
    23856 2-benzyl-isoinO=C3c1ccccc1 116 67611 http://www.s PHYSPROP
    23857 benzaldehyde,Oc1ccc(C=O)c 160 67616 http://www.s PHYSPROP
    23858 cyclopentane,CC=C1CCCC1 -129.5 67620 http://www.s PHYSPROP
    23859 2-amino-6-chlOC(=O)c1c(N)c 159 67623 http://www.s PHYSPROP
    23860 2,5-cyclohexaO=C2C=C/C(=N 133.5 67630 http://www.s PHYSPROP
    23861 decane, 1,10-dClCCCCCCCCCC 15.6 67652 http://www.s PHYSPROP
    23862 1,3-propanediCC(CO)CO -91 67654 http://www.s PHYSPROP
    23863 2,5-furandionO=C1OC(=O)C 69 67661 http://www.s PHYSPROP
    23864 silanediol, di C[Si](C)(OC(= -12.5 67680 http://www.s PHYSPROP
    23865 dicetylphosphO=P(O)(OCCC 74.5 67691 http://www.s PHYSPROP
    23866 benzenamine,CCN(CC)c1ccc( 77.5 67731 http://www.s PHYSPROP
    23867 3-undecanoneCCC(=O)CCCC 12 67735 http://www.s PHYSPROP
    23868 1-acenaphtheO=C1Cc3cccc2 121 67774 http://www.s PHYSPROP
    23869 hexadecanoic O=C(CCCCCCC 20.4 67777 http://www.s PHYSPROP
    23870 pentamethylbe
    Cc1c(C)c(C)c( 210.5 67781 http://www.s PHYSPROP
    23871 o-phenoxybenz
    O=C(O)c2cccc 113 67782 http://www.s PHYSPROP
    23872 4-phenoxy-butN#CCCCOc1cc 45.5 67783 http://www.s PHYSPROP
    23873 1-naphthylhydNNc2cccc1ccc 117 67785 http://www.s PHYSPROP
    23874 3-nitrophenyl O=[N+]([O-])c 95 67787 http://www.s PHYSPROP
    23875 1-naphthalen NC(=O)c2cccc 205.8 67788 http://www.s PHYSPROP
    23876 2-naphthaleneClC(=O)c1ccc2 51 67790 http://www.s PHYSPROP
    23877 2,4,6-trimethyCc1ccc2nc(C)c 68 67791 http://www.s PHYSPROP
    23878 1-undecyne C#CCCCCCCCC -25 67793 http://www.s PHYSPROP
    23879 piperazine, 1- Fc1ccc(cc1)N 31.5 67803 http://www.s PHYSPROP
    23880 2(3h)-benzothCN1c2ccccc2S 90 67807 http://www.s PHYSPROP
    23881 benzene, 1,3-dFc1cc(F)cc(c1) 17 67815 http://www.s PHYSPROP
    23882 benzylidene-pCc2ccc(/N=C/c 35 67818 http://www.s PHYSPROP
    23883 benzene, 1-is COc1ccc(/N=C 18 67835 http://www.s PHYSPROP
    23884 benzoic acid, O=C(O)c1ccc( 95 67867 http://www.s PHYSPROP
    23885 benzenemethaOc1ccc(Br)cc 113 67879 http://www.s PHYSPROP
    23886 decanoic acid NC(=O)CCCCC 108 67884 http://www.s PHYSPROP
    23887 4-(trifluormetFC(F)(F)c1ccc 48 67895 http://www.s PHYSPROP
    23888 dodecyl methyCC(=O)CCCCC 33.5 67900 http://www.s PHYSPROP
    23889 acetic acid, (t O=C(O)C[Si](C 41 67902 http://www.s PHYSPROP
    23890 cyclotetrasilo C[SiH]1O[SiH] -69 67937 http://www.s PHYSPROP
    23891 4-hydroxyindoOc2cccc1nccc 100 67953 http://www.s PHYSPROP
    23892 2-chloro-5-meNc1cc(OC)ccc1 27 67990 http://www.s PHYSPROP
    23893 disiloxane, 1, C[Si](C)(Cl)O[S -37.5 67991 http://www.s PHYSPROP
    23894 butanedioic acO=C(CC(=C)C( 58.5 68010 http://www.s PHYSPROP
    23895 [1,1'-biphenyl]Cc1cc(cc(C)c1 221.8 68019 http://www.s PHYSPROP
    23896 eicosanedioic O=C(O)CCCCC 125.5 68030 http://www.s PHYSPROP
    23897 2-(dimethyla CN(C)c1ccc2cc 52.5 68053 http://www.s PHYSPROP
    23898 2,2'-dinitro-b O=[N+]([O-])c 126 68055 http://www.s PHYSPROP
    23899 2-(ethylaminoCCNc1ccc2ccc 236 68056 http://www.s PHYSPROP
    23900 benzene, 1,3,5CCOc1cc(cc(c 43.5 68061 http://www.s PHYSPROP
    23901 1-octadecanam
    CCCCCCCCCCC 44 68064 http://www.s PHYSPROP
    23902 2-hydroxyfluoOc1ccc2c3ccc 168 68072 http://www.s PHYSPROP
    23903 picolinic acid, COC(=O)c1ccc 18.7 68094 http://www.s PHYSPROP
    23904 1-heptanamine
    CCCCCCCNCCC 31.5 68105 http://www.s PHYSPROP
    23905 ethanone, 1-(2O=C(C)c1cc(Cl 12 68111 http://www.s PHYSPROP
    23906 2,4-dinitrophe[O-][N+](=O)c 71 68121 http://www.s PHYSPROP
    23907 4-amino-m-tolCc1cc(ccc1N) 169.5 68122 http://www.s PHYSPROP
    23908 2-(chloroethy ClCc1ccc2cccc 48.5 68154 http://www.s PHYSPROP
    23909 5-aminopentaNCCCCCO 38.5 68156 http://www.s PHYSPROP
    23910 benzoic acid, Oc1cc(O)cc(C 132 68173 http://www.s PHYSPROP
    23911 methanesulfony
    ClC(Cl)(Cl)S(C 140.5 68202 http://www.s PHYSPROP
    23912 methanone, ( COc2ccccc2C( 41 68220 http://www.s PHYSPROP
    23913 cyclotetrasilo C[Si]1(O[Si](C -43.5 68224 http://www.s PHYSPROP
    23914 3,4-dimethylpCc1ccc(cc1C)C 47.5 68247 http://www.s PHYSPROP
    23915 2-allyl-maloniOC(=O)C(CC=C 105 68265 http://www.s PHYSPROP
    23916 3-heptyne CCCC#CCC -130.5 68268 http://www.s PHYSPROP
    23917 1-hydroxybenzOn2nnc1ccccc 157.5 68282 http://www.s PHYSPROP
    23918 glycin-amide,nCC(=O)NC(=O 141.5 68309 http://www.s PHYSPROP
    23919 n-benzyl ethy O=C(NCc1cccc 49 68310 http://www.s PHYSPROP
    23920 disiloxane, 1, C[Si](C)(O[Si] -99.7 68328 http://www.s PHYSPROP
    23921 1,4-dihydrox Oc1c(Br)c(Br) 244 68349 http://www.s PHYSPROP
    23922 ethanone, 1-(3Clc1ccc(cc1Cl 76 68350 http://www.s PHYSPROP
    23923 o-phenoxyanilNc2ccccc2Oc1 45.8 68404 http://www.s PHYSPROP
    23924 benzoic acid, O=[N+]([O-])c 108 68421 http://www.s PHYSPROP
    23925 1,2,4-trimeth Cc1cc(C)c(C)c 55.5 68437 http://www.s PHYSPROP
    23926 isopropoxybe CC(C)Oc1cccc -33 68467 http://www.s PHYSPROP
    23927 furan-2-yl-aceO=C(O)Cc1ccc 68.5 68475 http://www.s PHYSPROP
    23928 hexadecane, 1COC(CCCCCCC 10 68532 http://www.s PHYSPROP
    23929 4-aminobenzaO=C(N)c1ccc( 182 68568 http://www.s PHYSPROP
    23930 phenol, 4-amiNc1ccc(O)c(C) 176.5 68570 http://www.s PHYSPROP
    23931 3-amino-4-chlNc1cc(ccc1Cl) 214 68579 http://www.s PHYSPROP
    23932 2-bromo-5-chClc1ccc(Br)s1 -20 68617 http://www.s PHYSPROP
    23933 2-hydroxyphen
    O=C(CCC)c1cc 10 68641 http://www.s PHYSPROP
    23934 acetic acid, ( O=C(O)COc2cc 196 68790 http://www.s PHYSPROP
    23935 3-butyn-2-amiC#CC(C)(C)N 18 68796 http://www.s PHYSPROP
    23936 2,5-difluorobeOC(=O)c1cc(F) 133 68816 http://www.s PHYSPROP
    23937 naphthalene-2-
    O=C(OCC)c1cc 32 68840 http://www.s PHYSPROP
    23938 1,2-cyclohept O=C1CCCCCC -40 68842 http://www.s PHYSPROP
    23939 benzoyl chloriClc1ccc(cc1Cl) 25 68878 http://www.s PHYSPROP
    23940 1,2,6-trimeth Cc1cc2ccc(C)c 14 68891 http://www.s PHYSPROP
    23941 2-(trifluoromeFC(F)(F)c1ccc 33 68907 http://www.s PHYSPROP
    23942 acetic acid,o- O=C(C)Oc1cccc 101 68908 http://www.s PHYSPROP
    23943 brompyrazon O=C2C(Br)=C( 223.5 68913 http://www.s PHYSPROP
    23944 n-octadecyltr CO[Si](CCCCC 15 68956 http://www.s PHYSPROP
    23945 benzyl phenylO=S(=O)(Cc1cc 146 69027 http://www.s PHYSPROP
    23946 thiophene, 2, Brc1ccsc1Br -17.5 69055 http://www.s PHYSPROP
    23947 thiophene, 2, Brc1cc(Br)c(Br 29 69057 http://www.s PHYSPROP
    23948 3,3-dimethyl- CC(=O)C(C)(C) 19 69060 http://www.s PHYSPROP
    23949 2,4-dihydroxyO=C(CCCCC)c1 57 69061 http://www.s PHYSPROP
    23950 benzenebutano
    COc1ccc(cc1) 149 69077 http://www.s PHYSPROP
    23951 1,3-benzenedio
    O=[N+]([O-])c 122 69087 http://www.s PHYSPROP
    23952 1-propanone, CCC(=O)c1ccc
    1 28 69124 http://www.s PHYSPROP
    23953 (tetrachloromClCC(CCl)(CCl) 97 69160 http://www.s PHYSPROP
    23954 propane, 1,3- BrCC(CBr)(CBr 163 69161 http://www.s PHYSPROP
    23955 phenol, 2,3,4,Cc1cc(C)c(O)c 80.5 69177 http://www.s PHYSPROP
    23956 2,5-furandicarOC(=O)c1ccc( 342 69178 http://www.s PHYSPROP
    23957 dimethyl-phosCP(C)(=O)O 92 69233 http://www.s PHYSPROP
    23958 1-azido-4-chl Clc1ccc(N=N# 20 69259 http://www.s PHYSPROP
    23959 benzene, 1-chClc1ccccc1N= 30.5 69288 http://www.s PHYSPROP
    23960 benzene, 1-is O=C=Nc1ccccc 41 69289 http://www.s PHYSPROP
    23961 benzene, 1-is O=C=Nc1cccc(c 51 69290 http://www.s PHYSPROP
    23962 cyclohexane, 1C(CC1CCCCC1 11.5 69292 http://www.s PHYSPROP
    23963 cyclononanonO=C1CCCCCCC 34 69328 http://www.s PHYSPROP
    23964 bis(4-bromophBrc2ccc(Sc1cc 115 69380 http://www.s PHYSPROP
    23965 4-methyl-4'-ni[O-][N+](=O)c 69 69393 http://www.s PHYSPROP
    23966 l-tyrosine, meOc1ccc(CC(N) 137 69406 http://www.s PHYSPROP
    23967 benzene, 1-b BrCc1ccccc1Br 31 69414 http://www.s PHYSPROP
    23968 dimethyldipheC[Si](C)(Oc1c -23 69421 http://www.s PHYSPROP
    23969 2-pyrrolidinonO=C1CCCN1C 20 69427 http://www.s PHYSPROP
    23970 (4-amino-pheny
    Nc1ccc(CC#N) 46 69446 http://www.s PHYSPROP
    23971 1,4-dibromo-2O=[N+]([O-])c 85.5 69450 http://www.s PHYSPROP
    23972 4-iodopyrazolIc1cnnc1 109 69468 http://www.s PHYSPROP
    23973 quinoxaline, 1c1ccc2NCCNc 99 69474 http://www.s PHYSPROP
    23974 cyclopropyl p O=C(c1ccccc1 -7.9 69475 http://www.s PHYSPROP
    23975 2,6-dimethyl- Cc1cc(N)cc(C) 192.5 69493 http://www.s PHYSPROP
    23976 cyclopentane,C=CCC1CCCC1 -110.7 69505 http://www.s PHYSPROP
    23977 butryic acid h CCCC(=O)NN 45.5 69525 http://www.s PHYSPROP
    23978 n-(hydroxymetO=C(NCO)c1cc 141.5 69554 http://www.s PHYSPROP
    23979 trisiloxane, 1 C[Si](C)(Cl)O[S -53 69569 http://www.s PHYSPROP
    23980 9,10-dibenzyl C(c3c1ccccc1c 246.5 69597 http://www.s PHYSPROP
    23981 benzoylhydrazCc1ccc(cc1)C 117 69607 http://www.s PHYSPROP
    23982 octadecanoic aO=C(CCCCCCC 28.9 69620 http://www.s PHYSPROP
    23983 nitroethene [O-][N+](=O)C -55.5 69627 http://www.s PHYSPROP
    23984 undecanoic acO=C(O)CCCCC 65.5 69664 http://www.s PHYSPROP
    23985 pyridine, 2-chCc1ccnc(Cl)c1 115 69673 http://www.s PHYSPROP
    23986 4'-cl-5-br sali Oc2ccc(Br)cc2 240.5 69679 http://www.s PHYSPROP
    23987 1,3,5-triazine,c1nc(ccc1)c2n 210 69682 http://www.s PHYSPROP
    23988 buzepide NC(=O)C(CCN1 142.5 69696 http://www.s PHYSPROP
    23989 benzenemethan
    SC(c1ccccc1)( 105 69703 http://www.s PHYSPROP
    23990 4-pyridineme NCc1ccncc1 -7.6 69736 http://www.s PHYSPROP
    23991 fenclorim Clc1cc(Cl)nc( 96.9 69755 http://www.s PHYSPROP
    23992 1,3,2-dioxathiO=S1OCCO1 -11 69759 http://www.s PHYSPROP
    23993 pyrimidine, 2,Clc1cc(Cl)nc(C 22.5 69792 http://www.s PHYSPROP
    23994 silanetriamineCN(C)[Si](C)(N -11 69797 http://www.s PHYSPROP
    23995 sulfurous diamCN(C)S(=O)N( 31 69799 http://www.s PHYSPROP
    23996 cyclopentane,CC(C)CC1CCC -115.2 69826 http://www.s PHYSPROP
    23997 2-cyclopentenO=C1C=C(CC1) -23 69834 http://www.s PHYSPROP
    23998 propane, 1,1,1ClC(Cl)(Cl)C(Cl 11 69866 http://www.s PHYSPROP
    23999 butanedioic a O=C(O)CCC(= 58 69896 http://www.s PHYSPROP
    24000 1,1'-biphenyl, Fc2c(c1c(F)c(F 85 69901 http://www.s PHYSPROP
    24001 thiophene, te Brc1sc(Br)c(Br 117.5 69970 http://www.s PHYSPROP
    24002 benzene, 1-(bO=[N+]([O-])c 59.3 69973 http://www.s PHYSPROP
    24003 4-bromo-benzNCc1ccc(Br)cc 20 69976 http://www.s PHYSPROP
    24004 benzene, 1-meCc2ccccc2Oc1 21.7 70015 http://www.s PHYSPROP
    24005 2-bromobenz O=C(N)c1cccc 160.5 70021 http://www.s PHYSPROP
    24006 2,3,6-trichlor Clc1c(OCC(=O) 148 70030 http://www.s PHYSPROP
    24007 p-methylsulfoO=S(C)(=O)c1c 269.5 70071 http://www.s PHYSPROP
    24008 benzoic acid, Oc1ccc(Cl)cc 50 70085 http://www.s PHYSPROP
    24009 ethanone, 2-mO=C(COC)c1cc 8 70099 http://www.s PHYSPROP
    24010 dihexadecyl e CCCCCCCCCCC 55 70156 http://www.s PHYSPROP
    24011 1,2-hydrazinedO=C(NNC(=O) 135 70157 http://www.s PHYSPROP
    24012 1,10-undecadC#CCCCCCCCC -17 70162 http://www.s PHYSPROP
    24013 sulfluramid FC(F)(C(F)(F)C 96 70194 http://www.s PHYSPROP
    24014 1-p-tolyl-but Cc1ccc(cc1)C 12 70207 http://www.s PHYSPROP
    24015 2-pyridinamine
    O=[N+]([O-])c 187 70280 http://www.s PHYSPROP
    24016 lauric acid, phO=C(Oc1cccc 24.5 70294 http://www.s PHYSPROP
    24017 1h-imidazole, c2cc(Cn1ccnc1 69 70309 http://www.s PHYSPROP
    24018 triacetoxy-metO=C(C)O[Si](C 40.5 70319 http://www.s PHYSPROP
    24019 isopropyl disuCC(C)SSC(C)C -69 70322 http://www.s PHYSPROP
    24020 carbamic chloCN(C(Cl)=O)c1 88.5 70358 http://www.s PHYSPROP
    24021 4-chloro-2-meClc1cc(C)nc2c 42.5 70361 http://www.s PHYSPROP
    24022 4-aminopyrazNc1cnnc1 81 70416 http://www.s PHYSPROP
    24023 benzeneaceticOC(C(=O)OC)c 58 70444 http://www.s PHYSPROP
    24024 quinoline-4-c O=Cc1ccnc2cc 51 70450 http://www.s PHYSPROP
    24025 2-hydroxymetOc1c(cccc1OC 61.5 70466 http://www.s PHYSPROP
    24026 3-hydroxy-4-mOc1cc(ccc1OC 136 70467 http://www.s PHYSPROP
    24027 benzonitrile, Oc1ccc(cc1OC 86 70511 http://www.s PHYSPROP
    24028 1,3,5-benzenetO=C(Cl)c1cc(c 36.3 70514 http://www.s PHYSPROP
    24029 phenol, 4-metCC(C)c1cc(C)c 36.5 70529 http://www.s PHYSPROP
    24030 ethanol, 2,2'- OCCNCCNCCO 97.5 70555 http://www.s PHYSPROP
    24031 benzene, octaCCCCCCCCCCC 29 70563 http://www.s PHYSPROP
    24032 1-octanamine,CN(CCCCCCCC -30.1 70578 http://www.s PHYSPROP
    24033 truxillic acid OC(=O)C2C(C( 228 70589 http://www.s PHYSPROP
    24034 4-hydroxy-3-mOc1ccc(cc1OC 56.5 70596 http://www.s PHYSPROP
    24035 benzoic acid, Nc1cc(ccc1)C 39 70646 http://www.s PHYSPROP
    24036 p-methoxy-g-pCOc1ccc(CCCC 57.5 70652 http://www.s PHYSPROP
    24037 8-chloro-naphO=C(O)c1cccc2 171.5 70667 http://www.s PHYSPROP
    24038 heptane, 1,7- BrCCCCCCCBr 41.7 70681 http://www.s PHYSPROP
    24039 octane, 1,8-d BrCCCCCCCCB 15.5 70682 http://www.s PHYSPROP
    24040 1-octene, 2-mC=C(C)CCCCCC -77.8 70705 http://www.s PHYSPROP
    24041 5-bromopyrimBrc1cncnc1 72 70714 http://www.s PHYSPROP
    24042 ethanol, 2- (1 CC(C)(C)NCCO 44 70731 http://www.s PHYSPROP
    24043 chloro-triethoCCO[Si](Cl)(O -51 70767 http://www.s PHYSPROP
    24044 2-hydroxy-4-mOc1cc(C)ccc1 27.5 70769 http://www.s PHYSPROP
    24045 propanoic aci O=C(O)C(C)(C) 47 70790 http://www.s PHYSPROP
    24046 thiepane C1CCCCCS1 0.5 70858 http://www.s PHYSPROP
    24047 propanoic aci O=C(O)C(C)(C 190 70865 http://www.s PHYSPROP
    24048 2-chloro-6-ch Clc1cncc(Cl)n 56.5 70868 http://www.s PHYSPROP
    24049 1-meo-2-me-3Cc1c(cccc1OC) 55 70915 http://www.s PHYSPROP
    24050 1-hexyl-2-pyr O=C1CCCN1C 4 70916 http://www.s PHYSPROP
    24051 cyclohexanoneO=C1CCC(CC1) 79.5 70962 http://www.s PHYSPROP
    24052 p-ethoxyphenyCCOc1ccc(cc1 88.5 70988 http://www.s PHYSPROP
    24053 2,4-dimethoxyCOc1cc(ccc1[N 76.5 70990 http://www.s PHYSPROP
    24054 2(1h)-pyridin NNc1ccccn1 46.6 71000 http://www.s PHYSPROP
    24055 pyrimidine, 2 Cc1ncccn1 -4 71089 http://www.s PHYSPROP
    24056 pyridine, 2-buCCCCc1ccccn1 97 71090 http://www.s PHYSPROP
    24057 7-morpholinom
    O=C2c1n(cnc 177 71112 http://www.s PHYSPROP
    24058 butanedioic a O=C(CCC(=O) 8.6 71164 http://www.s PHYSPROP
    24059 2h-thiopyran, CC1CCSCC1 -28 71172 http://www.s PHYSPROP
    24060 5-aminoindol Nc1cc2ccnc2c 132 71202 http://www.s PHYSPROP
    24061 2-amino-5-ch Nc1ccc(Cl)cc 67 71213 http://www.s PHYSPROP
    24062 1,1',1''-ethyl CC(c1ccccc1)( 95 71260 http://www.s PHYSPROP
    24063 propanesulfonCCCS(=O)(=O) 7.5 71271 http://www.s PHYSPROP
    24064 2,4,8,10-tetr C2OCC1(COCO 48.3 71284 http://www.s PHYSPROP
    24065 tetracosafluo FC2(F)C3(F)C(F -20 71305 http://www.s PHYSPROP
    24066 perfluorodimeFC1(F)C(F)(C(F -70 71308 http://www.s PHYSPROP
    24067 butane, 2,2,3-FC(Cl)(C(Cl)(Cl 4 71310 http://www.s PHYSPROP
    24068 butane, 2,3-diFC(Cl)(C(Cl)(F) -68 71315 http://www.s PHYSPROP
    24069 perfluoro-tri- FC(F)(N(C(F)(F) -110 71319 http://www.s PHYSPROP
    24070 cyclohexane, fFC1CCCCC1 13 71321 http://www.s PHYSPROP
    24071 1,4-diiodo oc FC(F)(C(F)(F)C( -9 71326 http://www.s PHYSPROP
    24072 ethane, 1,2-diClCC(Cl)F -60 71337 http://www.s PHYSPROP
    24073 hfc-236ea (cf3FC(F)C(F)C(F)( -156.1 71342 http://www.s PHYSPROP
    24074 diosphenol CC=1CCC(C(C) 83 71356 http://www.s PHYSPROP
    24075 exo-norborneoOC2CC1CCC2C 124 71360 http://www.s PHYSPROP
    24076 2-norbornanoOC2CC1CCC2C 125 71360 http://www.s PHYSPROP
    24077 endo-norbornOC2CC1CCC2C 149 71360 http://www.s PHYSPROP
    24078 levoglucosan OC2C(O)C(O) 183 71361 http://www.s PHYSPROP
    24079 tricyclene CC3(C)C1CC2C 67.5 71367 http://www.s PHYSPROP
    24080 8-azabicyclo[3CN2C1CC(=O) 43 71370 http://www.s PHYSPROP
    24081 hexadecan-3-oCCC(O)CCCCC 50 71384 http://www.s PHYSPROP
    24082 methane, brom
    BrC(Cl)F -115 71390 http://www.s PHYSPROP
    24083 2,3-dibromo- BrC(C)(C)C(Br) 7 71392 http://www.s PHYSPROP
    24084 .alpha.-d-glu O=C(C)OC1OC( 113.3 71396 http://www.s PHYSPROP
    24085 beta-d-glucopO=C(C)OC1OC( 134 71396 http://www.s PHYSPROP
    24086 pentane, 1,4- BrC(C)CCCBr -34.4 71414 http://www.s PHYSPROP
    24087 2-propanone, C/C(C)=NN=C( -12.5 71417 http://www.s PHYSPROP
    24088 2,3-bis-ethoxyO=C(OCC)C(C( 77 71422 http://www.s PHYSPROP
    24089 ethane, 1,2-d BrC(Cl)C(Br)Cl -26 71424 http://www.s PHYSPROP
    24090 hexanoyl chlorCCCCC(CC)C(C 67.5 71434 http://www.s PHYSPROP
    24091 cyclopropanem
    CC(O)C1CC1 -32.1 71435 http://www.s PHYSPROP
    24092 cyclohexanol, CC1(C)CC(O)C 11.5 71436 http://www.s PHYSPROP
    24093 3-methyl sulf CC1CCS(=O)(= 1 71450 http://www.s PHYSPROP
    24094 1,4-butanedithSCCCCS -53.9 71479 http://www.s PHYSPROP
    24095 1,4-methanona
    O=C3C=CC(=O 77.5 71481 http://www.s PHYSPROP
    24096 1,1'-biphenyl -OS(=O)(=O)c1c 72.5 71527 http://www.s PHYSPROP
    24097 phenanthrene,c2cc1CCCCc1 16.7 71546 http://www.s PHYSPROP
    24098 benzene, 1-meCOc1cc(cc(c1) 105.3 71556 http://www.s PHYSPROP
    24099 6-bromoquinoBrc1ccc2nccc 24 71568 http://www.s PHYSPROP
    24100 3-ethyl-3-metOC(=O)CC(C)( 87 71614 http://www.s PHYSPROP
    24101 4,5-dichloro- Nc1cc(Cl)c(Cl 160.5 71619 http://www.s PHYSPROP
    24102 methanone, diNN=C(/c1cccc 96.5 71626 http://www.s PHYSPROP
    24103 4-chloro-2-meO=[N+]([O-])c 25.5 71649 http://www.s PHYSPROP
    24104 1-(5-bromo-thCC(=O)c1ccc(B 94.5 71655 http://www.s PHYSPROP
    24105 3,6-dithiaoct CCSCCSCC 180 71694 http://www.s PHYSPROP
    24106 heptadecaneniCCCCCCCCCCC 34 71707 http://www.s PHYSPROP
    24107 propane-2-sulfCC(C)S(=O)(= -37 71711 http://www.s PHYSPROP
    24108 benzyl-o-toly Cc2ccccc2NCc 60 71721 http://www.s PHYSPROP
    24109 benzyl-p-toly Cc2ccc(NCc1cc 19.5 71722 http://www.s PHYSPROP
    24110 3-(4-methoxy-COc1ccc(CCCO 26 71725 http://www.s PHYSPROP
    24111 pyrimidine, 2,Clc1cc(C)nc(Cl 46.5 71784 http://www.s PHYSPROP
    24112 2-methoxy-5-nCOc1ccc(cn1)[ 108.5 71835 http://www.s PHYSPROP
    24113 6-chloroquinoClc1cc2nccnc 64 71844 http://www.s PHYSPROP
    24114 pentanoic acidCCCCCCCOC(= -46.4 71852 http://www.s PHYSPROP
    24115 pentanoic acidCCCCCCCCOC( -42.3 71853 http://www.s PHYSPROP
    24116 1-cyclohexyl- [O-][N+](=O)c 58.5 71872 http://www.s PHYSPROP
    24117 1,2,4,5-tetra Cc1c(C)c(c(C) 211.5 71900 http://www.s PHYSPROP
    24118 1-(4-chloro-p Clc1ccc(CC(C) 34 71916 http://www.s PHYSPROP
    24119 1,4-piperazineO=C(OCC)N1C 47 71922 http://www.s PHYSPROP
    24120 2-quinolineca O=Cc1ccc2ccc 71 71926 http://www.s PHYSPROP
    24121 a,a-diphenylprCC(C(=O)O)(c1 176 71976 http://www.s PHYSPROP
    24122 6-phenylcaproO=C(O)CCCCCc 23 71995 http://www.s PHYSPROP
    24123 disulfide, di- c3cccc4ccc(SS 139.5 71997 http://www.s PHYSPROP
    24124 1h-azonine, o C1CCCCCCCN1 -19 72041 http://www.s PHYSPROP
    24125 3-ethyl-1,1'-b CCc1cccc(c1)c -27.5 72051 http://www.s PHYSPROP
    24126 1,3-dimethox Cc1c(cccc1OC 40 72054 http://www.s PHYSPROP
    24127 1,12-dodecaneOCCCCCCCCC 81.3 72056 http://www.s PHYSPROP
    24128 tricine OCC(NCC(O)= 187 72078 http://www.s PHYSPROP
    24129 benzoylhydra COc1cc(ccc1) 94 72141 http://www.s PHYSPROP
    24130 1-(2,4-dihydr O=C(CC)c1ccc 99 72148 http://www.s PHYSPROP
    24131 5-bromoanthra
    Nc1ccc(Br)cc 219.5 72150 http://www.s PHYSPROP
    24132 benzoylhydrazO=C(NN)c1ccc 119 72174 http://www.s PHYSPROP
    24133 3-acetaminopyO=C(C)Nc1ccc 133 72235 http://www.s PHYSPROP
    24134 2-bromo-1,1-dBrC=C(Cl)Cl -88.5 72238 http://www.s PHYSPROP
    24135 chloromethyl-ClCC1CC1 -90.9 72268 http://www.s PHYSPROP
    24136 benzonitrile, Nc1ccc(Cl)cc 97 72274 http://www.s PHYSPROP
    24137 phenol, 4-amiClc1cc(N)cc(C 168 72291 http://www.s PHYSPROP
    24138 di-tert-butyl t CC(C)(C)SSSSC 2.3 72299 http://www.s PHYSPROP
    24139 6-dodecanoneCCCCCCC(=O) 10 72411 http://www.s PHYSPROP
    24140 b-nitroethyl [O-][N+](=O)C -23 72452 http://www.s PHYSPROP
    24141 m-cyanoacet O=C(C)c1cccc 99 72466 http://www.s PHYSPROP
    24142 phosphonic aciOP(O)(=O)CCP 218 72489 http://www.s PHYSPROP
    24143 1,1'-biphenyl,COc1cc(ccc1)c 36 72507 http://www.s PHYSPROP
    24144 tetraconazoleFC(F)C(F)(F)O 6 72518 http://www.s PHYSPROP
    24145 1-nonadecanoCCCCCCCCCCC 63.3 72522 http://www.s PHYSPROP
    24146 2-cyclopentyl Oc1ccccc1C2 34.5 72526 http://www.s PHYSPROP
    24147 ethene tetracaO=C(OCC)C(C( 58 72550 http://www.s PHYSPROP
    24148 nonane-2,4-d CCCCCC(=O)CC -18 72551 http://www.s PHYSPROP
    24149 hexane, 2,5-diCC(Cl)(C)CCC(C 67.5 72589 http://www.s PHYSPROP
    24150 pentanamide,CN(C)C(=O)CC -51 72594 http://www.s PHYSPROP
    24151 4-chlor-benzylSCc1ccc(Cl)cc 19.5 72625 http://www.s PHYSPROP
    24152 2-ethoxycarbon
    O=C(OCC)C(C( 29 72680 http://www.s PHYSPROP
    24153 2-nitro-4-chloOC(=O)c1ccc(C 144 72684 http://www.s PHYSPROP
    24154 hydrazinecarbo
    NNC(=O)OC 73 72718 http://www.s PHYSPROP
    24155 5-methyl-[1,3,CN1CSCSC1 65 72742 http://www.s PHYSPROP
    24156 octanoic acid NNC(=O)CCCC 88 72749 http://www.s PHYSPROP
    24157 1-(5-chloro-t CC(=O)c1ccc(C 52 72763 http://www.s PHYSPROP
    24158 ethyl 2-napht CCC(=O)c1ccc 60 72778 http://www.s PHYSPROP
    24159 2-formylaminoO=CNC(C(=O) 48.5 72806 http://www.s PHYSPROP
    24160 benzenamine,Nc1ccc(cc1)C 54.5 72918 http://www.s PHYSPROP
    24161 octadecanoic aO=C(CCCCCCC 30 72953 http://www.s PHYSPROP
    24162 2-amino-3-chlNc1c(cccc1Cl) 190 72961 http://www.s PHYSPROP
    24163 1,4-diam-2,3- O=C2c1ccccc1 195 72986 http://www.s PHYSPROP
    24164 9,10-anthraceCc2cc3C(=O)c 210.8 73095 http://www.s PHYSPROP
    24165 eglinazine ethClc1nc(NCC)n 228 73159 http://www.s PHYSPROP
    24166 4-bromoresorcOc1ccc(Br)c(O 103 73172 http://www.s PHYSPROP
    24167 2,6-dipropyl- Oc1c(cccc1CC 27 73174 http://www.s PHYSPROP
    24168 2-methyl-quinNc1cc(C)nc2c 169 73183 http://www.s PHYSPROP
    24169 6-methoxy-pyrNc1cnc(OC)cc 30 73188 http://www.s PHYSPROP
    24170 1,4-naphthoquO=C3C=C(Nc1c 193 73191 http://www.s PHYSPROP
    24171 benzene, (1,1 CC(C)(C)Oc1cc -24 73242 http://www.s PHYSPROP
    24172 hexadecanop O=C(CCCCCCC 59 73254 http://www.s PHYSPROP
    24173 1,5-heptadienC=C(C)CCC=C( -70 73261 http://www.s PHYSPROP
    24174 2-butyl-4-metOc1ccc(C)cc1 19 73369 http://www.s PHYSPROP
    24175 chloro-acetic O=C(CCl)OCCO 45.5 73413 http://www.s PHYSPROP
    24176 3-hydroxy-4-mO=[N+]([O-])c 186 73422 http://www.s PHYSPROP
    24177 2-hydroxy-9-f Oc2ccc3c1ccc 205 73434 http://www.s PHYSPROP
    24178 naphthalen-1-NC(=O)Nc2ccc 219.5 73435 http://www.s PHYSPROP
    24179 1,3-benzodioxo
    O=C(OCC)c1c 18.5 73439 http://www.s PHYSPROP
    24180 hexanoic acid CCCCCCCOC(= -34.4 73507 http://www.s PHYSPROP
    24181 (2-methoxy-phCOc1ccccc1C 69.8 73531 http://www.s PHYSPROP
    24182 benzene, 1-chCOc1cc(cc(Cl) 35 73537 http://www.s PHYSPROP
    24183 ethyl 2-cyanoaN#CC(=C)C(=O -22.5 73564 http://www.s PHYSPROP
    24184 4-bromo-2-met
    O=[N+]([O-])c 78 73607 http://www.s PHYSPROP
    24185 1-phenyl-1h-i c1ccc(cc1)n2c 13 73625 http://www.s PHYSPROP
    24186 3-phenoxy-proO=C(O)CCOc1c 97.5 73626 http://www.s PHYSPROP
    24187 chloromethyl O=S(=O)(CCl)c 54 73654 http://www.s PHYSPROP
    24188 1,4-piperazin NCCCN1CCN(C 15 73658 http://www.s PHYSPROP
    24189 n-undecylami CCCCCCCCCC 17 73758 http://www.s PHYSPROP
    24190 3,5-dimethox COc1cc(cc(OC 46.3 73763 http://www.s PHYSPROP
    24191 acetonitrile, 2,N#CCN(CC#N) 126 73778 http://www.s PHYSPROP
    24192 1,4-bis-dichl ClC(Cl)c1ccc(c 9.5 73892 http://www.s PHYSPROP
    24193 phosphonic aciCP(=O)(Oc1cc 35 74030 http://www.s PHYSPROP
    24194 bexarotene O=C(O)c1ccc(c 230.5 74139 http://www.s PHYSPROP
    24195 3-bromo-4-met
    Nc1cc(Br)c(C) 26 74169 http://www.s PHYSPROP
    24196 3-bromo-4-meCc1ccc(cc1Br) 78 74171 http://www.s PHYSPROP
    24197 1-naphthalenoCc1ccc(O)c2cc 85.8 74440 http://www.s PHYSPROP
    24198 cycloocta-1,5 C1=CCCC=CCC -56.4 74815 http://www.s PHYSPROP
    24199 p-hydroxybenO=C(c1cc(O)cc 133.5 74922 http://www.s PHYSPROP
    24200 2-methyl-6-niO=[N+]([O-])c 70 74972 http://www.s PHYSPROP
    24201 naphthalen-2-NC(=O)Nc1ccc 219 75020 http://www.s PHYSPROP
    24202 di-tert-butoxyCC(C)(C)O[Si] -4 75065 http://www.s PHYSPROP
    24203 p-methiobenzo
    CSc1ccc(cc1)C 194.5 75095 http://www.s PHYSPROP
    24204 benzene, 1-chCc1cc(ccc1Cl) 42.5 75176 http://www.s PHYSPROP
    24205 2,2-dimethyl- CC(C)(CO)Cc1c 34.5 75226 http://www.s PHYSPROP
    24206 etofylline nic O=C2c1n(cnc1 151.5 75285 http://www.s PHYSPROP
    24207 2,6-dichloro- Clc1c(C)ccc(Cl 28 75355 http://www.s PHYSPROP
    24208 propanoic acidCC(C)(CCl)C(= 41.5 75374 http://www.s PHYSPROP
    24209 1-monochloroCC(C)(C)C(=O) -13 75402 http://www.s PHYSPROP
    24210 1-(5-methyl-t CC(=O)c1ccc(C 27.5 75479 http://www.s PHYSPROP
    24211 morpholine, 4S=C(SN1CCOC 139 75523 http://www.s PHYSPROP
    24212 2,5-dichloro-t OC(=O)c1cc(Cl 306 75561 http://www.s PHYSPROP
    24213 4-bromo-3-met
    Brc1cnnc1C 76.5 75563 http://www.s PHYSPROP
    24214 acetoxyacetic CC(=O)OCC(= 67.5 75587 http://www.s PHYSPROP
    24215 phthalthrin CC(C)=C/C3C( 69 75773 http://www.s PHYSPROP
    24216 isoxaflutole O=C(c2cnoc2C1 140 75869 http://www.s PHYSPROP
    24217 propanamide,Cc1nc(NC(=O)
    n 159 75873 http://www.s PHYSPROP
    24218 2-allyl-4-chlo Oc1ccc(Cl)cc 48 75911 http://www.s PHYSPROP
    24219 benzamide, n,Cc1ccc(cc1)C( 41 75941 http://www.s PHYSPROP
    24220 benzo-15-cro O1CCOCCOCCO 79 75956 http://www.s PHYSPROP
    24221 [4,4]db24c6-dO1CCOCCOCCO 104 75995 http://www.s PHYSPROP
    24222 1-phenyl-5-chClc2nnnn2c1c 123 76019 http://www.s PHYSPROP
    24223 benzo[b]thiopCc1cc2ccsc2c 20.5 76088 http://www.s PHYSPROP
    24224 undecan-4-onCCCCCCCC(=O 4.5 76196 http://www.s PHYSPROP
    24225 silane, 1,2-et C[Si](C)(C)C#C 26 76286 http://www.s PHYSPROP
    24226 benzene, heptCCCCCCCCCCC 32 76342 http://www.s PHYSPROP
    24227 pentafluorophO=C(O)COc1c(F 109 76390 http://www.s PHYSPROP
    24228 3-octyne CCC#CCCCC -103.9 76541 http://www.s PHYSPROP
    24229 4-methoxy-naO=Cc1ccc(OC) 34.8 76852 http://www.s PHYSPROP
    24230 4-methylindolCc1cccc2nccc 5 76913 http://www.s PHYSPROP
    24231 3-amino-4-nitrNc1cc(OC)ccc1 131 76929 http://www.s PHYSPROP
    24232 propanoic acidO=C(O)CCOc2c 146.5 77103 http://www.s PHYSPROP
    24233 2-thiophenesuClS(=O)(=O)c1 28 77127 http://www.s PHYSPROP
    24234 1,11-dibromoBrCCCCCCCCC 166 77156 http://www.s PHYSPROP
    24235 silane, dimet C[SiH](OC)OC -136 77223 http://www.s PHYSPROP
    24236 piperidine, 4, C(CCC1CCNCC 67.1 77230 http://www.s PHYSPROP
    24237 2,6-dimethoxyCOc1cccc(OC) 119 77244 http://www.s PHYSPROP
    24238 1,3-isobenzof O=C1OC(=O)C 32 77282 http://www.s PHYSPROP
    24239 cis-exo-2,3-n OC2C1CCC(C1 139 77326 http://www.s PHYSPROP
    24240 exo-2-endo-3-OC2C1CCC(C1 141 77326 http://www.s PHYSPROP
    24241 2-hexadecanoCC(O)CCCCCC 44 77368 http://www.s PHYSPROP
    24242 2-phenyl-cycl O=C2CCCCCC2 22.2 77381 http://www.s PHYSPROP
    24243 2,5-dimethox COc1cc(C)c(c 60.75 77462 http://www.s PHYSPROP
    24244 cyclohexanol, NCC1(C)CC(C) 45.5 77476 http://www.s PHYSPROP
    24245 fenpentadiol OC(C)(CC(C)(C 76.5 77482 http://www.s PHYSPROP
    24246 2(3h)-naphthaC/C(C)=C1/CC 51.5 77489 http://www.s PHYSPROP
    24247 chloralose OCC(O)C1OC2O 183 77572 http://www.s PHYSPROP
    24248 cyclopentene,CC1=CCCC1C -118 77595 http://www.s PHYSPROP
    24249 2-furancarboxy
    O=C(O)C1CCC 21 77659 http://www.s PHYSPROP
    24250 tebuconazole OC(Cn1cncn1)( 102.4 77680 http://www.s PHYSPROP
    24251 propaquizafo C/C(C)=NOCCO 66.3 77697 http://www.s PHYSPROP
    24252 cyproconazoleOC(Cn1cncn1)( 106.65 77706 http://www.s PHYSPROP
    24253 cyclanilide O=C(O)C2CC2C 195.5 77707 http://www.s PHYSPROP
    24254 fenoxaprop-p O=C(O)C(C)Oc1 158 77708 http://www.s PHYSPROP
    24255 imazamox CC1(N=C(NC1= 166 77711 http://www.s PHYSPROP
    24256 fenbuconazol Clc3ccc(CCC(C 125 77712 http://www.s PHYSPROP
    24257 difenoconazolClc1ccc(cc1)O 76 77730 http://www.s PHYSPROP
    24258 quizalofop-p-tO=C(OCC1CCCO 64 77732 http://www.s PHYSPROP
    24259 furilazole O=C(N1CC(OC1( 97 77743 http://www.s PHYSPROP
    24260 cyhalofop-butO=C(OCCCC)C( 49.5 77744 http://www.s PHYSPROP
    24261 metconazole Clc1ccc(cc1)C 111.5 77764 http://www.s PHYSPROP
    24262 ipconazole Clc1ccc(cc1) 89 77765 http://www.s PHYSPROP
    24263 carfentrazoneO=C(OCC)C(Cl) -22.1 77773 http://www.s PHYSPROP
    24264 1-propanone, CC(C)(O)C(=O 89 77809 http://www.s PHYSPROP
    24265 flusulfamide Clc2cc(ccc2NS( 170 77811 http://www.s PHYSPROP
    24266 mepanipyrim Cc2cc(nc(Nc1 132.8 77839 http://www.s PHYSPROP
    24267 triazamate CC(C)(C)c1nc( 53 77849 http://www.s PHYSPROP
    24268 1,2-dibenzoyl-O=C(NN(C(=O)c 178.5 77850 http://www.s PHYSPROP
    24269 transfluthrin ClC(Cl)=C/C2C 32 77870 http://www.s PHYSPROP
    24270 flupoxam FC(F)(F)C(F)( 146 77871 http://www.s PHYSPROP
    24271 tebufenpyrad Clc2c(C(=O)NC 61.5 77872 http://www.s PHYSPROP
    24272 azimsulfuron Cn1nc(nn1)c2 170 77873 http://www.s PHYSPROP
    24273 fenazaquin CC(C)(C)c1ccc 78.5 77874 http://www.s PHYSPROP
    24274 cga 219417 (cyCc2cc(nc(Nc1 75.9 77885 http://www.s PHYSPROP
    24275 sulfentrazoneCS(=O)(=O)Nc1 122 77887 http://www.s PHYSPROP
    24276 thifluzamide FC(F)(F)c2nc( 178 77907 http://www.s PHYSPROP
    24277 fludioxonil N#Cc3cncc3c1 199.8 77916 http://www.s PHYSPROP
    24278 cga 245704 O=C(SC)c1ccc 132.9 77928 http://www.s PHYSPROP
    24279 triflusulfuron O=C(O)c1cccc( 161.5 77932 http://www.s PHYSPROP
    24280 fluquinconazoClc4ccc(N1C(= 192 77933 http://www.s PHYSPROP
    24281 imidacloprid [O-][N+](=O) 144 77934 http://www.s PHYSPROP
    24282 metosulam Clc3c(C)ccc(C 211 77938 http://www.s PHYSPROP
    24283 fluthiamide O=C(COc1nnc(s 76 77944 http://www.s PHYSPROP
    24284 methyl (1-(4- O=S(=O)(c1cc 97.2 77959 http://www.s PHYSPROP
    24285 ethyl (1-(4-meCCOC(=O)C1(C 75.5 77960 http://www.s PHYSPROP
    24286 isopropyl (1-( CC(C)OC(=O)C1 65.5 77961 http://www.s PHYSPROP
    24287 methyl (1-(4- O=S(=O)(c1ccc 115.5 77962 http://www.s PHYSPROP
    24288 isopropyl (1-( CC(C)OC(=O)C1 89.8 77963 http://www.s PHYSPROP
    24289 tert-butyl (1- CC(C)(C)OC(=O 110.5 77964 http://www.s PHYSPROP
    24290 methyl (1-(4- O=S(=O)(c1ccc 123.5 77965 http://www.s PHYSPROP
    24291 methyl (1-(4-nO=S(=O)(c1ccc 127 77966 http://www.s PHYSPROP
    24292 isopropyl (1-( CC(C)OC(=O)C1 122.7 77967 http://www.s PHYSPROP
    24293 cloransulam O=C(OC)c3ccc 217 77968 http://www.s PHYSPROP
    24294 isopropyl (1-( O=S(=O)(c1ccc 65.5 77976 http://www.s PHYSPROP
    24295 isopropyl (1-( O=S(=O)(c1ccc 110.5 77977 http://www.s PHYSPROP
    24296 isopropyl (1-( O=S(=O)(c1ccc 83.5 77978 http://www.s PHYSPROP
    24297 me (1-(4-bromCOC(=O)C1(CC 95 77979 http://www.s PHYSPROP
    24298 me (1-(4-bromO=S(=O)(c1cc 111.5 77980 http://www.s PHYSPROP
    24299 me (1-(4-chlorCOC(=O)C1(CCC 76.2 77981 http://www.s PHYSPROP
    24300 isopropyl (1-( O=S(=O)(c1ccc 92.5 77982 http://www.s PHYSPROP
    24301 methyl (1-pheO=S(=O)(c1cc 56.5 77983 http://www.s PHYSPROP
    24302 mannitol hexaO=[N+]([O-])O 107 78021 http://www.s PHYSPROP
    24303 ergost-7-en-3-CC(C)C(C)CCC 146 78023 http://www.s PHYSPROP
    24304 2-acetyl-3,4- CC(=O)C1CCc2 56 78039 http://www.s PHYSPROP
    24305 butanedinitrileN#CCC(CC)C# -41 78101 http://www.s PHYSPROP
    24306 spiro 4.5 dec C/C(C)=C1/CC 44.5 78238 http://www.s PHYSPROP
    24307 4,7,7-trimeth CC2(C)C1CCC2 127.5 78258 http://www.s PHYSPROP
    24308 3-heptanol, 5 CC(CC)CC(O)C -91.2 78280 http://www.s PHYSPROP
    24309 stigmast-5-en-CC(C)C(CC)CC 140 78319 http://www.s PHYSPROP
    24310 gamma-sitosteCC(C)C(CC)CC 147 78319 http://www.s PHYSPROP
    24311 3,5-dimethyl- Cc1cc(cc(C)c1 22.5 78418 http://www.s PHYSPROP
    24312 cyclopentanol,C#CC1(O)CCC 27 78543 http://www.s PHYSPROP
    24313 6-chloroindol Clc1ccc2ccnc2 90 78578 http://www.s PHYSPROP
    24314 bensultap O=S(=O)(SCC(C 83.5 78640 http://www.s PHYSPROP
    24315 ethyltriacetoxO=C(C)O[Si]( 8 78701 http://www.s PHYSPROP
    24316 phenol, 4-(1,1Cc1cc(c(C)cc1 71.2 78706 http://www.s PHYSPROP
    24317 phenol, 2,4-diClc1ccc(O)c(Cl 58 78755 http://www.s PHYSPROP
    24318 2,6-difluorob O=C(N)c1c(F)c 146.5 78873 http://www.s PHYSPROP
    24319 silane, chloro ClC(Cl)[Si](C)( -48 78926 http://www.s PHYSPROP
    24320 3-octadecanoCCC(=O)CCCC 51 78964 http://www.s PHYSPROP
    24321 octadecylsilanCCCCCCCCCCC 29 79148 http://www.s PHYSPROP
    24322 3-hexadecanoCCC(=O)CCCC 43 79201 http://www.s PHYSPROP
    24323 2-(tert-butyl) CC(C)(C)c1ccc 147 79211 http://www.s PHYSPROP
    24324 4-propyl-benzOc1cc(O)ccc1 82.5 79278 http://www.s PHYSPROP
    24325 lawesson's re S=P1(SP(=S)(S 229 79346 http://www.s PHYSPROP
    24326 monobromoneo
    OCC(CO)(CBr) 76 79351 http://www.s PHYSPROP
    24327 1h-indazol-5- Nc1cc2cnnc2c 176.5 79400 http://www.s PHYSPROP
    24328 methyl m-hydOc1cc(ccc1)C 73 79453 http://www.s PHYSPROP
    24329 2-ethoxy-naphO=Cc1c2ccccc 115 79481 http://www.s PHYSPROP
    24330 1,14-tetradec OCCCCCCCCC 85.8 79622 http://www.s PHYSPROP
    24331 benzeneethano
    OCCc1ccccc1C 2 79628 http://www.s PHYSPROP
    24332 1,2,3-trichlor Clc1cc(cc(Cl)c 72.5 79719 http://www.s PHYSPROP
    24333 propanoic acidO=C(CC)OCCC -57.5 79806 http://www.s PHYSPROP
    24334 1,1'-biphenyl,Ic1cc(ccc1)c2 26.5 79889 http://www.s PHYSPROP
    24335 4-butylbenzoicO=C(O)c1ccc( 106.5 79969 http://www.s PHYSPROP
    24336 1,3-benzodioxClCc1ccc2OCO 20.5 80048 http://www.s PHYSPROP
    24337 4-amino-2-chlN#Cc1ccc(N)c 118 80062 http://www.s PHYSPROP
    24338 9,10-dihydroxyOC(CCCCCCCC 90 80658 http://www.s PHYSPROP
    24339 sec-butyl eth CC(CC)NCC -104.3 80695 http://www.s PHYSPROP
    24340 codamine COc1ccc(cc1O 127 80700 http://www.s PHYSPROP
    24341 tonalid CC(=O)c1cc2c( 54.5 80719 http://www.s PHYSPROP
    24342 4-heptanol, 2 CC(C)CC(O)CC -81 80791 http://www.s PHYSPROP
    24343 (3-phenyl-oxi OCC2OC2c1cc 26.5 80823 http://www.s PHYSPROP
    24344 methyl 3-aminCOC(=O)c1scc 65 80916 http://www.s PHYSPROP
    24345 nonadecylcyl CCCCCCCCCCC 45 80933 http://www.s PHYSPROP
    24346 acetic acid 3, O=C(C)Oc1cc(C 22 81030 http://www.s PHYSPROP
    24347 benzoic acid, Oc1ccc(C)cc1 -1 81056 http://www.s PHYSPROP
    24348 m-bromobenzO=C(N)c1cc(Br 155.3 81061 http://www.s PHYSPROP
    24349 methanesulfon
    ClC(Cl)(F)C(Cl 69 81063 http://www.s PHYSPROP
    24350 pentanesulfonCCCCCS(=O)(= 15.9 81081 http://www.s PHYSPROP
    24351 1-(ch2co2me)-COC(=O)Cn1cc 96 81104 http://www.s PHYSPROP
    24352 1-butene, 2-b BrC(=C)CC -133.4 81237 http://www.s PHYSPROP
    24353 1-tert-butyl-3 O=[N+]([O-])c 2 81251 http://www.s PHYSPROP
    24354 di(trimethylo OCC(COCC(CO) 109.5 81280 http://www.s PHYSPROP
    24355 5-pyrimidinecaOc1nc(O)ncc1 283 81524 http://www.s PHYSPROP
    24356 9h-fluorene-9OCC3c1ccccc1 106 81679 http://www.s PHYSPROP
    24357 indan-5-ylamiNc1ccc2CCCc2 37.5 81705 http://www.s PHYSPROP
    24358 2,3-dihydroxyOc1c(C=O)ccc 108 81781 http://www.s PHYSPROP
    24359 fenfuram Cc2occc2C(=O 109.5 81792 http://www.s PHYSPROP
    24360 abietic acid CC(C)C=3CCC1 173.5 82077 http://www.s PHYSPROP
    24361 6-gingerol Oc1cc(ccc1OC 31 82123 http://www.s PHYSPROP
    24362 alfadolone ac CC(=O)OCC(= 176 82239 http://www.s PHYSPROP
    24363 sobrerol OC(C)(C)C1CC 130 82589 http://www.s PHYSPROP
    24364 trans-p-menthOC(C)(C)C1CC 131 82589 http://www.s PHYSPROP
    24365 galaxolide CC2(C)c1cc3C -5 82618 http://www.s PHYSPROP
    24366 cyclohexane, 1CC1CC(C)C(C) -83.5 82638 http://www.s PHYSPROP
    24367 2-methoxy-3,4COC1CCC=CO 16 82655 http://www.s PHYSPROP
    24368 glycidamide NC(=O)C1CO1 33 82664 http://www.s PHYSPROP
    24369 probenazole C=CCOC2=NS(= 138.5 82698 http://www.s PHYSPROP
    24370 ethidimuron CN(c1nnc(s1) 156 82706 http://www.s PHYSPROP
    24371 fluotrimazole FC(F)(F)c1cc( 132 82710 http://www.s PHYSPROP
    24372 lyral O=CC1CC=C(CC -30 82714 http://www.s PHYSPROP
    24373 gliquidone O=C(NC1CCCCC 181 82719 http://www.s PHYSPROP
    24374 dimefuron O=C2OC(=NN2c 193 82721 http://www.s PHYSPROP
    24375 pyrimethanil Cc2cc(C)nc(Nc 96.3 82753 http://www.s PHYSPROP
    24376 1,2,3,5-tetra Clc1c2cccc(Cl) 141 82754 http://www.s PHYSPROP
    24377 1,3,5,7-tetra Clc2cc(Cl)cc1c 180 82755 http://www.s PHYSPROP
    24378 tetrachloronaClc2cc(Cl)cc1c 156 82755 http://www.s PHYSPROP
    24379 bitertanol CC(C)(C)C(O)C 127 82759 http://www.s PHYSPROP
    24380 bitertanol ste CC(C)(C)C(O)C 138.6 82759 http://www.s PHYSPROP
    24381 2,2',4,6,6'-pe Clc2cc(Cl)cc(C 85 82765 http://www.s PHYSPROP
    24382 tolclofos-methClc1cc(C)cc(C 79 82767 http://www.s PHYSPROP
    24383 pyroquilon O=C1CCc2ccc 112 82768 http://www.s PHYSPROP
    24384 1-[[2-(2,4-dic Clc1ccc(c(Cl) 84 82776 http://www.s PHYSPROP
    24385 flurochlorido FC(F)(F)c1ccc 67.65 82780 http://www.s PHYSPROP
    24386 dimepiperate CC(C)(SC(=O) 39 82782 http://www.s PHYSPROP
    24387 5-pyrimidineme
    OC(c1ccccc1Cl 126 82786 http://www.s PHYSPROP
    24388 anilofos Clc1ccc(cc1)N 51 82790 http://www.s PHYSPROP
    24389 ethiozin O=C1C(=NN=C( 95 82792 http://www.s PHYSPROP
    24390 pencycuron Clc1ccc(cc1) 130 82795 http://www.s PHYSPROP
    24391 penconazole Clc2ccc(C(CCC 58.5 82796 http://www.s PHYSPROP
    24392 triflumizole FC(F)(F)c2cc( 63.5 82801 http://www.s PHYSPROP
    24393 flurazole FC(F)(F)c2nc( 52 82815 http://www.s PHYSPROP
    24394 mefenacet CN(c1ccccc1) 134.8 82816 http://www.s PHYSPROP
    24395 fenpiclonil Clc1cccc(c1Cl 147 82824 http://www.s PHYSPROP
    24396 flutriafol (pp4OC(Cn1cncn1)( 130 82827 http://www.s PHYSPROP
    24397 fluazinam [O-][N+](=O)c2 116 82831 http://www.s PHYSPROP
    24398 teflubenzuronClc2cc(NC(=O) 222.5 82833 http://www.s PHYSPROP
    24399 diflufenican Fc3ccc(NC(=O) 160 82834 http://www.s PHYSPROP
    24400 quinclorac O=C(O)c1c(Cl) 274 82837 http://www.s PHYSPROP
    24401 hexaflumuronClc1cc(cc(Cl) 203.5 82839 http://www.s PHYSPROP
    24402 carbamic acid,CCOc1cc(ccc1 100.3 82840 http://www.s PHYSPROP
    24403 haloxyfop-etoO=C(OCCOCC)C( 60 82841 http://www.s PHYSPROP
    24404 quinmerac O=C(O)c1c(Cl) 244 82847 http://www.s PHYSPROP
    24405 pyrazosulfuroCn1ncc(C(=O) 181.5 82848 http://www.s PHYSPROP
    24406 pyriproxyfen CC(COc2ccc(O 46 82851 http://www.s PHYSPROP
    24407 pyridaben CC(C)(C)N2N=C 111.5 82852 http://www.s PHYSPROP
    24408 ethametsulfu CCOc2nc(nc(N 194 82854 http://www.s PHYSPROP
    24409 dithiopyr FC(F)(F)c1nc( 65 82855 http://www.s PHYSPROP
    24410 icia0051 (sulc O=C2CCCC(=O) 139 82858 http://www.s PHYSPROP
    24411 tebufenozide CCc1ccc(cc1)C 191 82870 http://www.s PHYSPROP
    24412 thiazopyr CC(C)Cc1c(c(n 78 82873 http://www.s PHYSPROP
    24413 amidosulfuro O=C(Nc1nc(cc 161.5 82874 http://www.s PHYSPROP
    24414 chlorfenpyr CCOCn1c(c(C#N 100.5 82875 http://www.s PHYSPROP
    24415 rimsulfuron O=S(=O)(NC(= 177 82876 http://www.s PHYSPROP
    24416 pyrithiobac O=C(O)c2c(Sc1 149.5 82878 http://www.s PHYSPROP
    24417 laidlomycin OCC1(O)OC(C( 152 82886 http://www.s PHYSPROP
    24418 1-heptanol, 7-ClCCCCCCCO 11 83028 http://www.s PHYSPROP
    24419 benzenemethan
    CC(O)(C#C)c1c 52.3 83147 http://www.s PHYSPROP
    24420 bicyclo[2.2.1] CC2(C)C1CCC2 158.5 83155 http://www.s PHYSPROP
    24421 glyceryl iodid ICC(O)CO 48.5 83173 http://www.s PHYSPROP
    24422 decane, 3-metCCCCCCCC(C) -92.9 83276 http://www.s PHYSPROP
    24423 4-decylanilineNc1ccc(CCCCC 25 83338 http://www.s PHYSPROP
    24424 1h-isoindole-1[O-][N+](=O)c 96 83348 http://www.s PHYSPROP
    24425 methyldymro CN(C(=O)NC(C) 72 83352 http://www.s PHYSPROP
    24426 2-chloro-5-tri FC(F)(F)c1cnc( 33 83365 http://www.s PHYSPROP
    24427 pyrazoxyfen O=C(c2c(OCC(= 111.5 83405 http://www.s PHYSPROP
    24428 aclonifen Clc2c(N)c(ccc 81.5 83411 http://www.s PHYSPROP
    24429 inabenfide O=C(Nc2ccc(Cl 211 83423 http://www.s PHYSPROP
    24430 cinosulfuron COc2nc(NC(=O 130 83438 http://www.s PHYSPROP
    24431 trinexapac-ethO=C(OCC)C1CC 36 83439 http://www.s PHYSPROP
    24432 flumioxazin O=C4C=1CCCC 202.5 83443 http://www.s PHYSPROP
    24433 1(2h)-pyrimidO=C2NC(=O)C( 223 83469 http://www.s PHYSPROP
    24434 1(2h)-pyrimidO=C1NC(=O)C 226.5 83470 http://www.s PHYSPROP
    24435 1,3,5-trichlor Clc1c(O)c(Cl)c 136 83584 http://www.s PHYSPROP
    24436 propylene gly CC(C)(C)OCC( -56 83620 http://www.s PHYSPROP
    24437 2,2,3,3-tetra CC(C)(C)C(C)( -9.8 83703 http://www.s PHYSPROP
    24438 laudanine COc1ccc(cc1O 167 83710 http://www.s PHYSPROP
    24439 laudanidine COc1ccc(cc1O 184.5 83710 http://www.s PHYSPROP
    24440 4,4'-bis(dime CN(C)c1ccc(cc 101 83720 http://www.s PHYSPROP
    24441 triptycene c1ccc3c(c1)C4 253.5 83742 http://www.s PHYSPROP
    24442 5(35-di-s-bu-cCCC(C)C1C=C( 196 83749 http://www.s PHYSPROP
    24443 6,6a-dihydro- c3ccc1c(CC2O 24.5 83807 http://www.s PHYSPROP
    24444 phenglutarimiO=C1NC(=O)CC 126 83835 http://www.s PHYSPROP
    24445 4-methyl-4-phCC1(CCOCO1)c 37.5 83839 http://www.s PHYSPROP
    24446 topanol ca CC(C)(C)c1cc( 186.5 83868 http://www.s PHYSPROP
    24447 quinoline, decC1CCC2NCCCC -40 83872 http://www.s PHYSPROP
    24448 phenopyrazonO=C2NN(c1ccc 233.5 83912 http://www.s PHYSPROP
    24449 quebrachaminCC[C@@]23CC 146 83943 http://www.s PHYSPROP
    24450 pentane-1,2-dCCCC(O)CO 104 83953 http://www.s PHYSPROP
    24451 di-tert-butylp CC(C)(C)OOC1( -30 83991 http://www.s PHYSPROP
    24452 butanenitrile, CC(CC)(/N=N/ 50 84029 http://www.s PHYSPROP
    24453 salicylamide oNC(=O)c1cccc 221 84035 http://www.s PHYSPROP
    24454 quinupramineC1CN2CCC1C(C 150 84098 http://www.s PHYSPROP
    24455 bucloxic acid O=C(O)CCC(=O 163 84103 http://www.s PHYSPROP
    24456 3-cyanoquinolN#Cc1cc2cccc 109 84121 http://www.s PHYSPROP
    24457 sparticide Fc1ccc(cc1)N2 241 84168 http://www.s PHYSPROP
    24458 ac 94,377 NC(=O)C1(CCC 194 84201 http://www.s PHYSPROP
    24459 cyclopropane,CC1(CC)CC1 -130.2 84221 http://www.s PHYSPROP
    24460 diclomezine Clc1cc(cc(Cl 251.5 84266 http://www.s PHYSPROP
    24461 methasulfoca O=C(Sc1ccc(c 137 84287 http://www.s PHYSPROP
    24462 forchlorfenur Clc2cc(NC(=O) 167 84301 http://www.s PHYSPROP
    24463 1,6-hexanediam
    CC2(C)CC(NCC 64 84324 http://www.s PHYSPROP
    24464 triazoxide Clc1ccc2nc(n[ 182 84327 http://www.s PHYSPROP
    24465 clomeprop Clc2c(C)c(Cl) 146.5 84386 http://www.s PHYSPROP
    24466 imibenconazoClc3ccc(/N=C( 90 84387 http://www.s PHYSPROP
    24467 pyributicarb COc1cccc(n1)N 86 84390 http://www.s PHYSPROP
    24468 methyl (1-pheO=S(=O)(c1cc 74.5 84420 http://www.s PHYSPROP
    24469 cloquintocet- CC(CCCCC)OC( 69.4 84430 http://www.s PHYSPROP
    24470 flazasulfuron O=S(=O)(NC(= 180 84440 http://www.s PHYSPROP
    24471 novaluron Clc1cc(ccc1OC 177.5 84442 http://www.s PHYSPROP
    24472 fluthiacet-metO=C(OC)CSc3c 106 84443 http://www.s PHYSPROP
    24473 me (1-(4-bromO=S(=O)(c1cc 103.5 84448 http://www.s PHYSPROP
    24474 ethyl (1-(4-meO=S(=O)(c1cc 53.5 84449 http://www.s PHYSPROP
    24475 2-hydroxycarbOc1ccc2c3ccc 271.5 84451 http://www.s PHYSPROP
    24476 2,6-naphthaleOc1ccc2cc(O) 220 84452 http://www.s PHYSPROP
    24477 methyl (1-pheCOC(=O)C1(CC 107.5 84478 http://www.s PHYSPROP
    24478 methyl (1-pheO=S(=O)(c1cc 114.5 84479 http://www.s PHYSPROP
    24479 2h-1-benzopyrc1ccc2OC(CCc 46.3 84973 http://www.s PHYSPROP
    24480 mycobacidin O=C1NC(CCCC 139.5 84986 http://www.s PHYSPROP
    24481 benzeneethano
    OC(Cc1ccccc1) 67 84992 http://www.s PHYSPROP
    24482 2-hydroxy-octCCCCCCC(O)C 70 84994 http://www.s PHYSPROP
    24483 hydroxypropylC=CC(=O)OC( -30 85055 http://www.s PHYSPROP
    24484 piperidin-2-y OCC1CCCCN1 69 85070 http://www.s PHYSPROP
    24485 hyenanchin C=C(C)C5(O)C 225 85072 http://www.s PHYSPROP
    24486 cyclohexane, 1CC1CCC(C)C(C -75 85082 http://www.s PHYSPROP
    24487 quinonamid ClC(Cl)C(=O) 212.5 85176 http://www.s PHYSPROP
    24488 phenol, 2,6-diFc1cccc(F)c1O 39.5 85185 http://www.s PHYSPROP
    24489 benzene, nonaCCCCCCCCCCC 40 85192 http://www.s PHYSPROP
    24490 benzene, 2,4- Brc1cc(Br)c(C) -9.7 85210 http://www.s PHYSPROP
    24491 carbonic acid ClC(Cl)(Cl)OC( 79 85216 http://www.s PHYSPROP
    24492 oxadiargyl O=C2OC(=NN2c 131 85276 http://www.s PHYSPROP
    24493 1-chloro-3,5- Oc1cc(Cl)cc(O 118 85326 http://www.s PHYSPROP
    24494 phenisopham O=C(Oc1cccc( 109.5 85345 http://www.s PHYSPROP
    24495 (1,1'-biphenylO=C(C)Oc2ccc 68 85350 http://www.s PHYSPROP
    24496 benzenamine,Nc1ccc(cc1)Oc
    4 161 85409 http://www.s PHYSPROP
    24497 imazamethabeCC1(N=C(NC1= 133 85411 http://www.s PHYSPROP
    24498 benzofenap O=C(c2c(OCC(= 133.3 85434 http://www.s PHYSPROP
    24499 dl-isovaline CC(N)(CC)C(= 316.5 85483 http://www.s PHYSPROP
    24500 diethylmalonaO=C(OCC)C(=C 32 85490 http://www.s PHYSPROP
    24501 1,2-ethanediolOC(c1ccccc1)( 182 85502 http://www.s PHYSPROP
    24502 1,8,8-trime-3-O=C1OC(=O)C2 221 85566 http://www.s PHYSPROP
    24503 methanimidami
    N(=C/Nc1cccc 142 85615 http://www.s PHYSPROP
    24504 10h-phenothiaCN(C)c1ccc2N( 195 85696 http://www.s PHYSPROP
    24505 ethanone, 1-(6O=C(C)c1cnc(C 17.6 85989 http://www.s PHYSPROP
    24506 tryptazan O=C(O)C(N)Cc 240 86015 http://www.s PHYSPROP
    24507 2,3-dibromosuBrC(C(O)=O)C 167 86021 http://www.s PHYSPROP
    24508 ethanone, 2-cClC(C(=O)c1cc 68.5 86040 http://www.s PHYSPROP
    24509 2,3-dibromo- BrC(C)C(Br)CC -56 86063 http://www.s PHYSPROP
    24510 phneyl-p-tolylCc1ccc(cc1)C( 52 86074 http://www.s PHYSPROP
    24511 2,3-dibromo-bBrC(C)C(Br)C( 87 86082 http://www.s PHYSPROP
    24512 2-(2,2-dimethCC(C)(C)CC1( -64 86106 http://www.s PHYSPROP
    24513 2-hydroxy-2-mO=C(O)C(C)(O 74 86129 http://www.s PHYSPROP
    24514 1,2-ethanediol,
    OC(C(O)c1cccc 122.5 86143 http://www.s PHYSPROP
    24515 meso-hydrobeOC(C(O)c1cccc 138 86143 http://www.s PHYSPROP
    24516 hydrobenzoinOC(C(O)c1cccc 139 86143 http://www.s PHYSPROP
    24517 iridomyrmeci CC1CCC2C(C) 60.5 86149 http://www.s PHYSPROP
    24518 enallylpropymO=C1NC(=O)N( 56.5 86329 http://www.s PHYSPROP
    24519 2-mercaptoben
    OC(=O)c1ccc(S 168.5 86425 http://www.s PHYSPROP
    24520 3-chloro-1h-i Clc2nnc1cccc 149 86569 http://www.s PHYSPROP
    24521 5-norbornen-2OC2CC1C=CC2 105 86714 http://www.s PHYSPROP
    24522 2,6-diamino-2'Nc2ccc(/N=N/ 129 86854 http://www.s PHYSPROP
    24523 benzeneaceticOC(C(=O)OCC)( 34 86894 http://www.s PHYSPROP
    24524 3-phenyl-dihyO=C2OC(=O)C 95 86923 http://www.s PHYSPROP
    24525 4-isopropylid C/C(C)=C1OC( -18 87054 http://www.s PHYSPROP
    24526 6-methyl-2-heCC(C)CCCC(C) -105 87095 http://www.s PHYSPROP
    24527 2-chloro-6-hy Oc1ccc2cc(Cl) 116.5 87113 http://www.s PHYSPROP
    24528 lunacrine CC(C)C1CC3=C 119 87128 http://www.s PHYSPROP
    24529 2-pentadecyl CC(O)CCCCCC 35 87293 http://www.s PHYSPROP
    24530 sebacil O=C1CCCCCC 40.5 87436 http://www.s PHYSPROP
    24531 benzenepropan
    O=C(CC#N)c1c 158.7 87512 http://www.s PHYSPROP
    24532 1,3,4-thiadiaz Cc1nnc(C)s1 65 87514 http://www.s PHYSPROP
    24533 17-oxosparteiO=C3N1CCCCC 111 87994 http://www.s PHYSPROP
    24534 n-acetylaspar O=C(C)NC(CC( 138.5 88007 http://www.s PHYSPROP
    24535 2-nitrophenyl [O-][N+](=O)c 39.5 88037 http://www.s PHYSPROP
    24536 4-(4-hydroxybCOc1ccc(CCCC 3.5 88146 http://www.s PHYSPROP
    24537 acetic acid ac O=[N+]([O-])c 72 88161 http://www.s PHYSPROP
    24538 acetic acid ch ClC(=O)C(OC(C 36 88177 http://www.s PHYSPROP
    24539 octadecanoic O=C(OCC1CCC 22 88247 http://www.s PHYSPROP
    24540 (2-isopropyl-5CC(C)C1CCC(C 54 88289 http://www.s PHYSPROP
    24541 isobutyl stear CC(CC)OC(=O 28.9 88378 http://www.s PHYSPROP
    24542 p-bromomande
    OC(c1ccc(Br)c 117.5 88403 http://www.s PHYSPROP
    24543 pentanoic acidO=C(O)C(O)CC 34 88482 http://www.s PHYSPROP
    24544 p-lactophenetCCOc1ccc(cc1 118 88519 http://www.s PHYSPROP
    24545 ethanone, 2-mCOC(C(=O)c1c 49.5 88569 http://www.s PHYSPROP
    24546 butanoic acid,BrC(C(C)Br)C 58.5 88628 http://www.s PHYSPROP
    24547 decanoic acid O=C(O)C(Br)C 4 88773 http://www.s PHYSPROP
    24548 chrysene, oct C1CC3C4CCCC 115 88915 http://www.s PHYSPROP
    24549 m-methoxybeCOc1cc(ccc1) 134 88942 http://www.s PHYSPROP
    24550 benzyl-4-ami Nc1ccc(cc1)C 111 88943 http://www.s PHYSPROP
    24551 1,7-phenanthrc2cc1nccnc1c 78 88949 http://www.s PHYSPROP
    24552 octahydro-na O=C1CCCC2CC 33 88956 http://www.s PHYSPROP
    24553 allocryptopin O=C2Cc4ccc(O 160.5 89017 http://www.s PHYSPROP
    24554 undecan-5-ol CCCCCCC(O)C -3.5 89117 http://www.s PHYSPROP
    24555 undecan-5-onCCCCCCC(=O) 2 89118 http://www.s PHYSPROP
    24556 benzenamine,N(=C=Nc1cccc 169 89134 http://www.s PHYSPROP
    24557 3,4-fifluorobeFc1ccc(cc1F)C 123 89588 http://www.s PHYSPROP
    24558 2-methyl-5-etNc1cc(OC)ccc 47 89893 http://www.s PHYSPROP
    24559 1',3',3'-trime [O-][N+](=O)c 179.5 90137 http://www.s PHYSPROP
    24560 hexanoic acid,O=C(O)C(O)C 61 90191 http://www.s PHYSPROP
    24561 isosorbide OC2COC1C(O) 62.5 90294 http://www.s PHYSPROP
    24562 hexahydro-furo
    OC2COC1C(O) 88 90294 http://www.s PHYSPROP
    24563 clofop isobutyClc2ccc(Oc1cc 39.5 90395 http://www.s PHYSPROP
    24564 carbobenzoxyO=C(O)C(Cc1c 88.5 90437 http://www.s PHYSPROP
    24565 1,3-cyclopentaOC1CCC(O)C1 31 90519 http://www.s PHYSPROP
    24566 1,3-cyclopentaOC1CCC(O)C1 40 90519 http://www.s PHYSPROP
    24567 1-(3-chlorophClc1cccc(c1) 245 91009 http://www.s PHYSPROP
    24568 cyclohexanoneO=C2CCCCC2C -78 91413 http://www.s PHYSPROP
    24569 3,5-difluorobeFc1cc(cc(F)c1 122 91500 http://www.s PHYSPROP
    24570 pyridine, 4-(1 CCC(CC)c1ccn 125.5 91519 http://www.s PHYSPROP
    24571 1,2,3,4-tetrahO=C(O)C1Cc2c 97.7 91600 http://www.s PHYSPROP
    24572 2-amino-4,6-dNc1cc(O)c(Cl) 95.5 91690 http://www.s PHYSPROP
    24573 primisulfuron O=C(Nc1nc(cc 196 91738 http://www.s PHYSPROP
    24574 tetrabarbital O=C1NC(=O)NC 122 91745 http://www.s PHYSPROP
    24575 3-furancarboxy
    OC(=O)C1CC(= 174.5 91750 http://www.s PHYSPROP
    24576 d-threose O=CC(O)C(O) 129 91769 http://www.s PHYSPROP
    24577 1-[(2-aminoetCC(O)CNCCN -50 91794 http://www.s PHYSPROP
    24578 decafluoro-5,6FC1(F)C(F)(F)C -56 91835 http://www.s PHYSPROP
    24579 propane, 1,2-dCC(Cl)(F)CCl -91.7 91860 http://www.s PHYSPROP
    24580 lycopodine O=C1CCC24CC 114.5 91874 http://www.s PHYSPROP
    24581 neopine COc1ccc2CC5 127.5 91875 http://www.s PHYSPROP
    24582 berbine C1c4ccccc4CN 85 91895 http://www.s PHYSPROP
    24583 hydrocinchon OC(C2CC1CCN2 268.5 91899 http://www.s PHYSPROP
    24584 glucoheptonicOC(C(O)C(O)C 146.5 91901 http://www.s PHYSPROP
    24585 d-quercitol OC1CC(O)C(O) 236 91903 http://www.s PHYSPROP
    24586 ledol CC3(C)C2CCC( 105 91904 http://www.s PHYSPROP
    24587 chloralammonClC(Cl)(Cl)C(N 73 91908 http://www.s PHYSPROP
    24588 3-chloro-d-c CC2(C)C1CCC2 106 91910 http://www.s PHYSPROP
    24589 2,4,6(1h,3h,5hO=C1NC(=O)N 215 91912 http://www.s PHYSPROP
    24590 norcholanic acO=C(O)CC(C) 177 91914 http://www.s PHYSPROP
    24591 3,3,3-trichloroClC(Cl)(Cl)C( 61 91916 http://www.s PHYSPROP
    24592 7-dehydrositoCC(C)C(CC)CC 144.5 91926 http://www.s PHYSPROP
    24593 (+)-perseitol OC(C(O)C(O)C 188 91934 http://www.s PHYSPROP
    24594 2,4,5-triphenyc1ccc(cc1)C2 134.5 91959 http://www.s PHYSPROP
    24595 ethanone, 2-eO=C(C(OCC)c1 62 91960 http://www.s PHYSPROP
    24596 diazene, bis(4CCOc1ccc(cc1 162 91964 http://www.s PHYSPROP
    24597 norbornane-2-N#CC2CC1CCC 44 92361 http://www.s PHYSPROP
    24598 1-propene, 2-cF/C(F)=C(/Cl)C -130 92438 http://www.s PHYSPROP
    24599 epiquinidine OC(C2CC1CC(O 113 92515 http://www.s PHYSPROP
    24600 pentane, 2,3-dCC(Cl)C(Cl)CC -77.3 92523 http://www.s PHYSPROP
    24601 butanedioic acOC(C(O)C(=O) 90 92524 http://www.s PHYSPROP
    24602 butane, 1,2,3 BrC(C)C(Br)CB -19 92530 http://www.s PHYSPROP
    24603 propane, 1-chlFC(F)C(F)(F)C( 85 92540 http://www.s PHYSPROP
    24604 benzeneaceticCCC(C(=O)OC) 77.5 92840 http://www.s PHYSPROP
    24605 2,3-butanediolClCC(O)C(O)CC 126.5 92868 http://www.s PHYSPROP
    24606 cyclopropane,CC1CC1C -149.6 92890 http://www.s PHYSPROP
    24607 cyclopropane,CC1CC1C -140.9 92890 http://www.s PHYSPROP
    24608 2-bromo-undec
    O=C(O)C(Br)C 10 92917 http://www.s PHYSPROP
    24609 cyclopentaneac
    COC(=O)CC1C -10 92919 http://www.s PHYSPROP
    24610 dodecanoic acO=C(O)C(C)C 22 92948 http://www.s PHYSPROP
    24611 d-manno-heptOC(C(O)C(=O) 151 92980 http://www.s PHYSPROP
    24612 carpaine O=C1CCCCCCC 121 93071 http://www.s PHYSPROP
    24613 5(35-di-s-buc CCC(C)C1C=C( 183 93658 http://www.s PHYSPROP
    24614 4(3h)-pyrimidO=C1CC=NC= 164 93916 http://www.s PHYSPROP
    24615 1-bromo-3-meO=[N+]([O-])c 83 94081 http://www.s PHYSPROP
    24616 deuterium oxi[3H]O[3H] 3.81 94563 http://www.s PHYSPROP
    24617 cyfluthrin ClC(Cl)=C/C3C 60 94690 http://www.s PHYSPROP
    24618 rh-2485 Cc1c(cccc1OC) 204.5 94755 http://www.s PHYSPROP
    24619 fenitropan [O-][N+](=O)C 70 96000 http://www.s PHYSPROP
    24620 1,3-propanedio
    [O-][N+](=O)C 71 96000 http://www.s PHYSPROP
    24621 butanoic acid O=C(O)C(O)CC 147.5 96024 http://www.s PHYSPROP
    24622 benzenepropan
    OCC(Cc1ccccc 51 96391 http://www.s PHYSPROP
    24623 aminopropyloCN(C)C(C)C(= 181 96421 http://www.s PHYSPROP
    24624 3-methyl-pipeO=C1NCCCC1 55.3 96440 http://www.s PHYSPROP
    24625 3-phenyl-pipec1cc(ccc1)C2 14.5 96476 http://www.s PHYSPROP
    24626 octahydro-indC1CCCC2NCCC 143 96541 http://www.s PHYSPROP
    24627 piperidine, 1- CC1CCCN(C1)C -13.6 96569 http://www.s PHYSPROP
    24628 piperidin-3-y OCC1CCCNC1 61 96573 http://www.s PHYSPROP
    24629 cyclopentanonO=C1CC(C)(C) -25.6 96588 http://www.s PHYSPROP
    24630 cyclopentadecOC1CCCCCCCC 80.5 96591 http://www.s PHYSPROP
    24631 1,1'-bicyclopen
    OC2CCCC2C1C 20 96611 http://www.s PHYSPROP
    24632 3-(2-chloro-p Clc1ccccc1OC 71.5 96633 http://www.s PHYSPROP
    24633 2,2,4-trimeth CC(C)C(O)C(C) -13 96641 http://www.s PHYSPROP
    24634 2-jod-benzyla OCc1ccccc1I 92 96816 http://www.s PHYSPROP
    24635 indobufen O=C(O)C(CC)c 183 96823 http://www.s PHYSPROP
    24636 hexachlorona Clc1c2cc(Cl)c( 118.3 96864 http://www.s PHYSPROP
    24637 1-methyl-4-meCOC(=O)C1CC( 15 97460 http://www.s PHYSPROP
    24638 p-ethoxybenz CCOc1ccc(cc1 209 97815 http://www.s PHYSPROP
    24639 p 32 O=C1NCCN(CC 108 97850 http://www.s PHYSPROP
    24640 pentanenitrileCC(C)(C)C(=O 71 97904 http://www.s PHYSPROP
    24641 nonanoic acid,O=C(CCCCCCC -27 98103 http://www.s PHYSPROP
    24642 azo dye ra CC(=O)OCCN(C 167 98482 http://www.s PHYSPROP
    24643 8-quinolinamiNc1cc(C)cc2c 73 98980 http://www.s PHYSPROP
    24644 5-norbornene-2
    O=C(OC)C2CC 38 99370 http://www.s PHYSPROP
    24645 physovenine CNC(=O)Oc1cc 124.5 99416 http://www.s PHYSPROP
    24646 morpholine, 2CC1CNCC(C)O -88 99508 http://www.s PHYSPROP
    24647 2,2,3-trimethyOC(=O)C1CC=C 40.5 99564 http://www.s PHYSPROP
    24648 benzylidene-mCc2cc(/N=C/c1 31 99731 http://www.s PHYSPROP
    24649 1-lauryl-4-car O=C(O)C1CC( 39 100413 http://www.s PHYSPROP
    24650 oxypinocamp CC2(O)C(=O)C 38.5 100420 http://www.s PHYSPROP
    24651 propizepine CN(C)C(C)CN 122 100443 http://www.s PHYSPROP
    24652 pyridine, 4-(3 C1CC(CC=C1)c 22.1 100591 http://www.s PHYSPROP
    24653 butane, 2,2,3 BrC(C)C(Br)(Br 1.8 100802 http://www.s PHYSPROP
    24654 2-n-nonylnap CCCCCCCCCc1c 12 101076 http://www.s PHYSPROP
    24655 benzoxazole, Cc1nc2cc(ccc2 63 101088 http://www.s PHYSPROP
    24656 3-amino-2,6-dClc1ccc(N)c(Cl 119 101140 http://www.s PHYSPROP
    24657 1-(2-methoxy-COc1ccccc1C( -85.1 102590 http://www.s PHYSPROP
    24658 isopilosine Cn3cncc3CC1C 179 102604 http://www.s PHYSPROP
    24659 2-propenoic aC=CC(=O)Oc1c( 100.5 102825 http://www.s PHYSPROP
    24660 thiacloprid Clc2ncc(CN1C 136 103099 http://www.s PHYSPROP
    24661 1,2-propanediOCC(O)COc1c 70 103390 http://www.s PHYSPROP
    24662 cyclexedrine CC(CNC)C1CC 139 103439 http://www.s PHYSPROP x salt - AL
    24663 1(2h)-pyrimidO=C1NC(=O)C 136 104189 http://www.s PHYSPROP
    24664 piperidine, 4, CN2CCC(CCCC 13.7 104209 http://www.s PHYSPROP
    24665 benzenamine,CCc2ccccc2Nc 29 104276 http://www.s PHYSPROP
    24666 tetrahydro-2,2CC1(C)OC(=O) 90 104849 http://www.s PHYSPROP
    24667 6-bromo-hexan
    O=C(CCCCCBr 33 105044 http://www.s PHYSPROP
    24668 1-n-nonylnap CCCCCCCCCc2c 8 105267 http://www.s PHYSPROP
    24669 2-benzyl-piperc1ccccc1CC2 32 105447 http://www.s PHYSPROP
    24670 p-trifluorome FC(F)(F)c1ccc 84 105768 http://www.s PHYSPROP
    24671 heptanedioic O=C(CCCCCC( 10 105806 http://www.s PHYSPROP
    24672 2,6-diphenylpc1cc(ccc1)c2n 82 105893 http://www.s PHYSPROP
    24673 2,6-dichloro- Clc1c(C)cc(C)c 87.5 106059 http://www.s PHYSPROP
    24674 1-isobutyl-2- CC(C)Cc1cccc -73.3 106287 http://www.s PHYSPROP
    24675 5,6,7,8-tetrahc1cncc2CCCCc 146.5 106340 http://www.s PHYSPROP
    24676 cyclopentanonO=C1CC(C)CC1 -40.6 106813 http://www.s PHYSPROP
    24677 ethychlozate O=C(OCC)Cc2n 77 106832 http://www.s PHYSPROP
    24678 oxazidione O=C3c4ccccc4 88 106845 http://www.s PHYSPROP
    24679 uridine, 5-broBrC1=CN(C(= 180.5 107123 http://www.s PHYSPROP
    24680 2,5-furandioneO=C1OC(=O)C 67.15 107169 http://www.s PHYSPROP
    24681 1-naphthalenec
    O=C(OC)c2ccc 59.5 107179 http://www.s PHYSPROP
    24682 4-methyl-7-diCCNc1ccc2c(c 73.5 107184 http://www.s PHYSPROP
    24683 n-iodosuccini O=C1CCC(=O) 204 107372 http://www.s PHYSPROP
    24684 7-bromo-hepta
    O=C(O)CCCCC 31 108607 http://www.s PHYSPROP
    24685 2-propanol, 1 OC(C)COC(C) 7.08 108631 http://www.s PHYSPROP
    24686 allin C=CCS(=O)CC( 165 108767 http://www.s PHYSPROP
    24687 zoxamide Clc1cc(cc(Cl) 160.25 108892 http://www.s PHYSPROP
    24688 1h-benzotriazoCc1cccc2nnnc 81.5 109219 http://www.s PHYSPROP
    24689 1-methyl-4-caO=C1CC(CN1C 152 109441 http://www.s PHYSPROP
    24690 2,3,4-trifluor Fc1c(F)ccc(O) 32 109789 http://www.s PHYSPROP
    24691 androstane CC34CCC2C(C 50.25 110009 http://www.s PHYSPROP
    24692 etiocholane CC34CCC2C(C 79 110009 http://www.s PHYSPROP
    24693 3-chloro-4-ni O=[N+]([O-])c 24 110074 http://www.s PHYSPROP
    24694 cyclopentane,CC1(C)CCC(C)( -88.4 110117 http://www.s PHYSPROP
    24695 1-decanol, 10-ClCCCCCCCCC 12.5 110121 http://www.s PHYSPROP
    24696 lactaroviolin C=C(C)c2cc1c( 58 110188 http://www.s PHYSPROP
    24697 clofencet O=C(O)C1=C(C 269 110214 http://www.s PHYSPROP
    24698 lofentanil O=C(OC)C2(CC 177 110226 http://www.s PHYSPROP
    24699 rubiadin O=C3c1ccccc1 290 110563 http://www.s PHYSPROP
    24700 2-methyl-2-but
    CC=C(/C)C(=O 45.5 111629 http://www.s PHYSPROP
    24701 tiglic acid CC=C(/C)C(=O 63.25 111629 http://www.s PHYSPROP
    24702 azidamfenicolO=[N+]([O-]) 107 118118 http://www.s PHYSPROP
    24703 butanoic acid,O=C(CCC)OCC -80 119744 http://www.s PHYSPROP
    24704 1,5-naphthyri c1ccnc2cccnc 75 119847 http://www.s PHYSPROP
    24705 bicyclo[3.3.1 C1CCC2CCCC1 145.5 119878 http://www.s PHYSPROP
    24706 ethane, 1,1,2,FC(F)([N+]([O- -41.5 119958 http://www.s PHYSPROP
    24707 2-bromo-1,1-dBrCC(F)F -75 119962 http://www.s PHYSPROP
    24708 2,2-difluoroetFC(F)CO -28.2 119963 http://www.s PHYSPROP
    24709 borane, diflu FB(F)c1ccccc1 -36.2 119977 http://www.s PHYSPROP
    24710 sulfur, pentaf FC(F)(F)S(F)(F) -87 119988 http://www.s PHYSPROP
    24711 boranediamine,
    CN(C)B(F)N(C) -44.3 120004 http://www.s PHYSPROP
    24712 benzene, 1-etCCOc1ccccc1F -16.7 120065 http://www.s PHYSPROP
    24713 phenetole, m-CCOc1cccc(F) -27.5 120075 http://www.s PHYSPROP
    24714 acenaphthylenC1Cc2cccc3CC 12.8 120091 http://www.s PHYSPROP
    24715 2h-1-benzopyrc1ccc2OCCCc2 215 120093 http://www.s PHYSPROP
    24716 1,2-propadienO=C=C=C=O -107 120106 http://www.s PHYSPROP
    24717 1,2-dithiane C1CCCSS1 32.5 120109 http://www.s PHYSPROP
    24718 tricyclo[2.2.1 CC3(C)C1CC2C 151.3 120114 http://www.s PHYSPROP
    24719 1,4-benzenedio
    Cc1c(O)c(C)c( 233 120120 http://www.s PHYSPROP
    24720 2,5-bis-trichl O=C1OC(OC1C(C 116 120129 http://www.s PHYSPROP
    24721 3-pentanone, CC(C)(C)C(=O) -45 120136 http://www.s PHYSPROP
    24722 2,3-pentadienCC=C=CC -125.6 120150 http://www.s PHYSPROP
    24723 2,2-dinitropr [O-][N+](=O)C 54 120157 http://www.s PHYSPROP
    24724 5-nonanol, 5-bCCCCC(O)(CCC 20 120164 http://www.s PHYSPROP
    24725 4-heptanol, 4 CC(O)(CCC)CC -82 120166 http://www.s PHYSPROP
    24726 n-benzoylben O=C(NC(=O)c1 152 120185 http://www.s PHYSPROP
    24727 9-heptadecanCCCCCCCCC(O 61 120206 http://www.s PHYSPROP
    24728 1-chloro-2-io ClCCI -15.6 120209 http://www.s PHYSPROP
    24729 sulfur cyanideN#CSC#N 63.5 120218 http://www.s PHYSPROP
    24730 butanedioic acCC(C)(C(=O)O) 200 120224 http://www.s PHYSPROP
    24731 2,3,5,6-tetraf Cc1c(F)c(F)c(C 36 120317 http://www.s PHYSPROP
    24732 n-heptyl hydr CCCCCCCOO 35.5 120354 http://www.s PHYSPROP
    24733 1,2,4-oxadiazoc1ccc(cc1)c2n 109 120458 http://www.s PHYSPROP
    24734 cyclopentane,CC1CCCC1CC -106 120488 http://www.s PHYSPROP
    24735 1-methyl-2-etCC1CCCC1CC -105.9 120488 http://www.s PHYSPROP
    24736 n,n,1,1-tetra CB(C)N(C)C -92 120613 http://www.s PHYSPROP
    24737 propanedioic aO=C(CC(=O)O -83 120670 http://www.s PHYSPROP
    24738 cyclohexanoneO=C1CCCCC1( -20.5 120674 http://www.s PHYSPROP
    24739 acetamide, n-O=C(C)N(C(C) 37.5 120792 http://www.s PHYSPROP
    24740 methane, tricyC1CCCCC1C(C 48 120815 http://www.s PHYSPROP
    24741 3-tetradecanoCCC(O)CCCCC 31.5 120840 http://www.s PHYSPROP
    24742 benzenemethan
    CN(C)c1ccc(CO 69 120868 http://www.s PHYSPROP
    24743 diphenylaceticO=C(OC(=O)C(c 98 120898 http://www.s PHYSPROP
    24744 cyclopentane,CCCCCCCCCCC -22 120911 http://www.s PHYSPROP
    24745 trichloroethoxCl[Si](Cl)(Cl)O -135 120926 http://www.s PHYSPROP
    24746 cyclopentene,CCC1=CCCC1 -118.5 121113 http://www.s PHYSPROP
    24747 1-hexyne, 5-mCC(C)CCC#C -125 121154 http://www.s PHYSPROP
    24748 5-undecyne CCCCC#CCCCC -74.1 121192 http://www.s PHYSPROP
    24749 3-hydroxy-4-aNc1ccc(cc1O) 213 121227 http://www.s PHYSPROP
    24750 4-propylbenzoCCCc1ccc(cc1 143 121262 http://www.s PHYSPROP
    24751 2-naphthalenec
    O=C(OC)c1ccc 77 121266 http://www.s PHYSPROP
    24752 2,4-hexadiyneCC#CC#CC 67.8 121383 http://www.s PHYSPROP
    24753 ethyl silane CC[SiH3] -180 121386 http://www.s PHYSPROP
    24754 cyclohexane, 1CC(CC1CCCCC 0.6 121411 http://www.s PHYSPROP
    24755 cyclohexane, 1C(CCC1CCCCC -17 121503 http://www.s PHYSPROP
    24756 3,5-dichlorobeClc1cc(CCl)cc( 36 121529 http://www.s PHYSPROP
    24757 2,5-dimethyl- CC(C)(C#CC(C 108 121607 http://www.s PHYSPROP
    24758 isopropylcycl CC(C)C1CC1 -112.9 121640 http://www.s PHYSPROP
    24759 cyclopropane,CC1CC1(C)C -138.2 121766 http://www.s PHYSPROP
    24760 silanamine,tri C[Si](C)(C)N(c 16.5 121775 http://www.s PHYSPROP
    24761 trichloro(1-meCC(C)[Si](Cl)(C -87.7 121781 http://www.s PHYSPROP
    24762 cyclopentene,CCCCCC1=CCC -83 121817 http://www.s PHYSPROP
    24763 hexylcyclopenCCCCCCC1CCC -73 121891 http://www.s PHYSPROP
    24764 dimethoxyborCOBOC -130.6 121921 http://www.s PHYSPROP
    24765 ethanone, 2-i O=C(CI)c1cccc 34.4 121940 http://www.s PHYSPROP
    24766 silane, dichlo Cl[Si](Cl)(OC -130 121944 http://www.s PHYSPROP
    24767 furazan, dimetCc1nonc1C -7 122020 http://www.s PHYSPROP
    24768 diethylchloro CCB(Cl)CC -84.6 122068 http://www.s PHYSPROP
    24769 4-propoxybenzO=C(O)c1ccc( 145 122118 http://www.s PHYSPROP
    24770 2-nitrobenzenO=S(N)(=O)c1c 191 122128 http://www.s PHYSPROP
    24771 benzoic acid, O=C(O)c1ccc( 113.5 122145 http://www.s PHYSPROP
    24772 2h-inden-2-one
    O=C1CC2CCCC -12 122183 http://www.s PHYSPROP
    24773 2h-inden-2-one
    O=C1CC2CCCC 10 122183 http://www.s PHYSPROP
    24774 2-t-butylpyridCC(C)(C)c1ccc -33 122245 http://www.s PHYSPROP
    24775 cyclopentane,CCCCCCCCCCC -10 122432 http://www.s PHYSPROP
    24776 1-pentyne, 4- CC(C)CC#C -104.6 122546 http://www.s PHYSPROP
    24777 3-dodecanol CCC(O)CCCCC 25 122696 http://www.s PHYSPROP
    24778 3-butenoic aciC=CC(C)(C)C( -6 122708 http://www.s PHYSPROP
    24779 propane, 1,1'-CC(C)CS(=O)(= 17 122752 http://www.s PHYSPROP
    24780 pyrimidine, 2,Cc1ccnc(C)n1 -4 123238 http://www.s PHYSPROP
    24781 4-hydroxy-3- Cc1cc(C=O)cc 119 123379 http://www.s PHYSPROP
    24782 borinic acid, CB(C)SC -84 123903 http://www.s PHYSPROP
    24783 1-pentene, 3- C=C(C)C(CC)C -112.9 123998 http://www.s PHYSPROP
    24784 2-octyn-1-ol CCCCCC#CCO -18 124143 http://www.s PHYSPROP
    24785 3-hydroxycamCC2(C)C1CCC2 205.5 124222 http://www.s PHYSPROP
    24786 1,1,1-tris(hy CCC(OC)(OC)O 58 124504 http://www.s PHYSPROP
    24787 [1,1'-biphenylN#Cc2ccccc2c 41 124512 http://www.s PHYSPROP
    24788 benzonitrile, CCOc1ccc(cc1 61.5 124526 http://www.s PHYSPROP
    24789 pentane, 2,2-dCC(Cl)(Cl)CCC 128.5 125208 http://www.s PHYSPROP
    24790 cyclohexane, 1CC(CC1CCCCC -22 125756 http://www.s PHYSPROP
    24791 2-hexyne, 5-mCC(C)CC#CC -92.9 126201 http://www.s PHYSPROP
    24792 cyclohexane, 1C(CCC1CCCCC -13.6 126341 http://www.s PHYSPROP
    24793 cyclohexane, 1CCCC(C1CCCC -10.5 126346 http://www.s PHYSPROP
    24794 cyclohexane, 1CC(C)(C1CCCC 15.6 126357 http://www.s PHYSPROP
    24795 cyclohexane, 1CCC(C1CCCCC -23.5 126358 http://www.s PHYSPROP
    24796 2-undecyne CCCCCCCCC#C -30.1 126767 http://www.s PHYSPROP
    24797 4-undecyne CCCCCCC#CCC -74.7 126769 http://www.s PHYSPROP
    24798 glucuronic aciOC(C(O)C(O)C 165 134737 http://www.s PHYSPROP
    24799 d-galacturonicOC(C(O)C(O)C 166 134737 http://www.s PHYSPROP
    24800 ktu 3616 (br O=C(NC(C)c1cc 147 135588 http://www.s PHYSPROP
    24801 tribenuron-meCc1nc(nc(OC) 141 135649 http://www.s PHYSPROP
    24802 etoxazole CC(C)(C)c1cc( 101.5 135707 http://www.s PHYSPROP
    24803 szi-121 Clc3ccccc3c1n 188 135715 http://www.s PHYSPROP
    24804 1,1'-biphenyl Brc2c(c1c(Br)c 225 136011 http://www.s PHYSPROP
    24805 quinamine C=CC5CN1CCC 185.5 138259 http://www.s PHYSPROP
    24806 phenytoin,3-cO=C(OCN1C(=O 170.6 139761 http://www.s PHYSPROP
    24807 phenytoin,3- O=C(OCN1C(=O 91 139762 http://www.s PHYSPROP
    24808 1-pentanone, O=C(CCCC)c1c 74.5 142246 http://www.s PHYSPROP
    24809 m-nitrobenzam
    O=[N+]([O-])c 200 144762 http://www.s PHYSPROP x salt - AL
    24810 1,1-dinitrocy O=[N+]([O-])C 36 144801 http://www.s PHYSPROP
    24811 ethylcelluloseCC(=O)OCCN(C 151 145595 http://www.s PHYSPROP
    24812 propisochlor ClCC(=O)N(COC 21.6 146492 http://www.s PHYSPROP
    24813 phenytoin,3-cO=C(C)OCN1C( 158.1 147574 http://www.s PHYSPROP
    24814 vinylphosphonC=CP(=O)(O)O 43 147591 http://www.s PHYSPROP
    24815 oxazole, 2,4-dc1ccc(cc1)c2n 103 147614 http://www.s PHYSPROP
    24816 n-hexylnaphthCCCCCCc2cccc -18 148477 http://www.s PHYSPROP
    24817 tetradecane, BrCCCCCCCCC 50.4 148624 http://www.s PHYSPROP
    24818 2-amino-4-chlN#Cc1ccc(Cl) 161 148708 http://www.s PHYSPROP
    24819 benzoic acid, O=[N+]([O-])c 48.5 149513 http://www.s PHYSPROP
    24820 trans-4-methyCC=CC(C)C -140.8 150420 http://www.s PHYSPROP
    24821 4-methyl-2-peCC=CC(C)C -134.8 150420 http://www.s PHYSPROP
    24822 4-methyl-2-p CC=CC(C)C -120 150420 http://www.s PHYSPROP
    24823 2-butene-1,4-dOCC=CCO 25 153208 http://www.s PHYSPROP
    24824 mesotrione O=C2CCCC(=O) 165 153301 http://www.s PHYSPROP
    24825 d2341 (bifenaCOc1ccc(cc1N 122 154052 http://www.s PHYSPROP
    24826 1-(2,5-dichlor O=C(c1cc(Cl)c 213.5 154937 http://www.s PHYSPROP
    24827 1-(4-mephso2)O=S(=O)(c1cc 72.5 154994 http://www.s PHYSPROP
    24828 pyribenzoxim COc1nc(nc(OC 129 155056 http://www.s PHYSPROP
    24829 1-(2,4-dichlor O=C(c1ccc(Cl) 134.5 157806 http://www.s PHYSPROP
    24830 1-(4-mephso2O=S(=O)(c1cc 145.5 157820 http://www.s PHYSPROP
    24831 1,1,1,2,2,3-h ClCC(Cl)(Cl)C(C 26 158350 http://www.s PHYSPROP
    24832 prenalterol CC(C)NCC(O)C 127.5 158586 http://www.s PHYSPROP
    24833 pyraflufen-ethCn2nc(c1cc(OC 126.5 159109 http://www.s PHYSPROP
    24834 pyraflufen-ethCn2nc(c1cc(OC 126.5 159109 http://www.s PHYSPROP
    24835 1-(2-iodo),2-dO=C(c1ccccc1I 188.5 159489 http://www.s PHYSPROP
    24836 1-(3,5-dimethyCc1cc(C)cc(c1 206.5 159519 http://www.s PHYSPROP
    24837 3,4,5,6-tetrac Clc1c(c(c(Cl) 94.5 160167 http://www.s PHYSPROP
    24838 gentisyl alcoh OCc1cc(O)ccc 100 163654 http://www.s PHYSPROP
    24839 erythrocentauO=Cc1cccc2C( 140.5 165975 http://www.s PHYSPROP
    24840 cafenstrole O=S(=O)(c1ncn 115 169454 http://www.s PHYSPROP
    24841 dinotefuran [O-][N+](=O) 107.5 171124 http://www.s PHYSPROP
    24842 hydrastine CN2CCc1cc5O 132 171234 http://www.s PHYSPROP
    24843 1-phenoxysilaO1CCN2CCO[Si 217.5 172109 http://www.s PHYSPROP
    24844 anhalonidine Oc2c(OC)c(cc 160.5 172437 http://www.s PHYSPROP
    24845 p-diisopropyl OOC(C)(C)c1cc 141 174073 http://www.s PHYSPROP
    24846 1-(4-methylphCc1ccc(cc1)O 188.5 175795 http://www.s PHYSPROP
    24847 1-(4-chlorophClc1ccc(cc1) 166.5 175797 http://www.s PHYSPROP
    24848 1-propylphospCCCP(=O)(O)O 73.8 177128 http://www.s PHYSPROP
    24849 zolone CCOP(=S)(OCC 43 180033 http://www.s PHYSPROP
    24850 boscalid O=C(Nc2ccccc2 143.3 184713 http://www.s PHYSPROP
    24851 acetamiprid Clc1ccc(CN(C 98.9 184719 http://www.s PHYSPROP
    24852 clothianidin Clc1ncc(CNC(= 176.8 184723 http://www.s PHYSPROP
    24853 fenhexamid O=C(Nc1ccc(O) 153 184726 http://www.s PHYSPROP
    24854 famoxadone CC2(OC(=O)N( 141 184727 http://www.s PHYSPROP
    24855 d-glucuronic OC1C(=O)OC( 177.5 190202 http://www.s PHYSPROP
    24856 4-methyl-pen CC(C)CCCN -94.4 190378 http://www.s PHYSPROP
    24857 d-fructose, 3- OCC(O)C(O)C( 168 190428 http://www.s PHYSPROP
    24858 smilagenin CC6C2C(CC3C 185 190588 http://www.s PHYSPROP
    24859 spirostan-3-ol,CC6C2C(CC3C 200.5 190588 http://www.s PHYSPROP
    24860 tigogenin CC6C2C(CC3C 205.5 190588 http://www.s PHYSPROP
    24861 sucrose octaaCC(=O)OC1C(O 86.5 190652 http://www.s PHYSPROP
    24862 melibiose O=CC(O)C(O)C 84 190740 http://www.s PHYSPROP
    24863 rhamnose OC(C)C(O)C(O 122 190747 http://www.s PHYSPROP
    24864 l-fucose OC(C)C(O)C(O 140 190747 http://www.s PHYSPROP
    24865 d-fucose OC(C)C(O)C(O 144 190747 http://www.s PHYSPROP
    24866 melezitose OC3C(O)C(O) 153 190749 http://www.s PHYSPROP
    24867 butanedioic acOC(C(=O)OCC 22 190760 http://www.s PHYSPROP
    24868 octadecanedioi
    O=C(CCCCCCC 54.5 190851 http://www.s PHYSPROP
    24869 podocarpic acO=C(O)C3(C)C 193.5 191091 http://www.s PHYSPROP
    24870 preg-4-ene-3,2CC(=O)C3CCC4 222 191234 http://www.s PHYSPROP
    24871 nandrolone O=C2CCC3C4C 118 191235 http://www.s PHYSPROP
    24872 brucine COc1cc2c(cc 178 191250 http://www.s PHYSPROP
    24873 4-iodophenet CCOc1ccc(I)cc 29 191427 http://www.s PHYSPROP
    24874 dibenzyl phth O=C(OCc1cccc 44 191496 http://www.s PHYSPROP
    24875 urs-12-en-28-oO=C(O)C45CCC 284 191497 http://www.s PHYSPROP
    24876 2-bromoanthrBrc2ccc3C(=O 205.8 191725 http://www.s PHYSPROP
    24877 lup-20(29)-eneC=C(C)C4CCC5 250 191735 http://www.s PHYSPROP
    24878 levopimaric acCC(C)C3=CCC1 150 191773 http://www.s PHYSPROP
    24879 amicetin CC(N)(CO)C(= 167 191888 http://www.s PHYSPROP
    24880 n-methyl butyCNC(=O)OCCC 59 191945 http://www.s PHYSPROP
    24881 benzoic acid, O=C(OCC)c2cc 59.5 192449 http://www.s PHYSPROP
    24882 butanamide, nO=C(Nc1ccc(C 90 193132 http://www.s PHYSPROP
    24883 deoxycorticosOCC(=O)C2CC 141.5 194204 http://www.s PHYSPROP
    24884 1(3h)-isobenzo[O-][N+](=O) 145 194210 http://www.s PHYSPROP
    24885 furan, tetraphc1ccc(cc1)c2o 175 194476 http://www.s PHYSPROP
    24886 fluoxymester O=C2CC3CCC1C 270 194749 http://www.s PHYSPROP
    24887 di-naphthalenc3cccc4cccc(N 115 195058 http://www.s PHYSPROP
    24888 benzeneaceticO=C(O)C(OC(C
    a 97 195769 http://www.s PHYSPROP
    24889 d-arabino-hexOC(CC=O)C(O) 146.5 196147 http://www.s PHYSPROP
    24890 alpha-amyrin CC4CCC5(C)CC 186 196214 http://www.s PHYSPROP
    24891 beta-amyrin CC4(C)CCC5(C 197 196215 http://www.s PHYSPROP
    24892 phenol, 4,4'-bOc1ccc(cc1)C( 137 197421 http://www.s PHYSPROP
    24893 allocholesteroCC(C)CCCC(C) 132 197494 http://www.s PHYSPROP
    24894 i-nicotinic aci COC(=O)c1ccn 16.1 197537 http://www.s PHYSPROP
    24895 cortexolone OCC(=O)C2(O 215 197564 http://www.s PHYSPROP
    24896 phthalimide,nCc1cccc2C(=O 134 198474 http://www.s PHYSPROP
    24897 2-propanone, CC(=O)Cc1ccc
    1 29 198955 http://www.s PHYSPROP
    24898 heptanoic acidO=C(CCCCCC) -63.5 199694 http://www.s PHYSPROP
    24899 morpholine, 4O=C(c1ccccc 175 199784 http://www.s PHYSPROP
    24900 veratramine OC5CC(C)CNC5 206 200149 http://www.s PHYSPROP
    24901 3-cyanoindoleN#Cc2cnc1ccc 180.5 200562 http://www.s PHYSPROP
    24902 2-buten-1-oneO=C(/C=C/C)c 20.5 202113 http://www.s PHYSPROP
    24903 benzoic acid, COc1ccc(cc1) 146 202142 http://www.s PHYSPROP
    24904 1,2-pyrrolidin O=C(O)C2CCC 77 202544 http://www.s PHYSPROP
    24905 5-ethyl-5-metO=C1NC(=O)O 46 202740 http://www.s PHYSPROP
    24906 benzoic acid, O=[N+]([O-])c 203.5 203115 http://www.s PHYSPROP
    24907 asperuloside CC(=O)OCC4= 131.5 203427 http://www.s PHYSPROP
    24908 6-azauridine O=C2NC(=O)C 158 203593 http://www.s PHYSPROP
    24909 diosgenin CC6C2C(CC3C 205.5 204155 http://www.s PHYSPROP
    24910 caulophylline O=C3C=CC=C2 137 204591 http://www.s PHYSPROP
    24911 acetoxolone O=C(O)C4(C)C 323 204788 http://www.s PHYSPROP
    24912 limonin CC35CCC1C67C 298 205258 http://www.s PHYSPROP
    24913 exaltolide O=C1CCCCCC 32 205386 http://www.s PHYSPROP
    24914 naphthalene, 1c3cccc4cccc(O 110 205575 http://www.s PHYSPROP
    24915 ?-d-glucofuranO=C(OCC(OC(= 199 206065 http://www.s PHYSPROP
    24916 5-bromodeoxyBrC1=CN(C(=O 192.5 206128 http://www.s PHYSPROP
    24917 benzene, 1,1' BrC(c1ccccc1) 45 206530 http://www.s PHYSPROP
    24918 psicofuranine Nc3ncnc1c3nc 212 207145 http://www.s PHYSPROP
    24919 1(3h)-isobenz O=C1OC(c2cccc 120 207183 http://www.s PHYSPROP
    24920 2-furaldehydeO=Cc1ccc(CO) 31.5 207215 http://www.s PHYSPROP
    24921 9h-purine, 6-(CSc3ncnc2c3 164 207239 http://www.s PHYSPROP
    24922 6-aminoquinoxNc1cc2nccnc2 159 207707 http://www.s PHYSPROP
    24923 quinoxaline, 6Cc1cc2nccnc2 218.5 212051 http://www.s PHYSPROP
    24924 friedelin O=C5CCC4C(C) 263 213633 http://www.s PHYSPROP
    24925 3,11-dihydroxO=C3CCC4C2C 235 214241 http://www.s PHYSPROP
    24926 benzeneethanol
    OC(Cc1ccccc1) 89.5 214300 http://www.s PHYSPROP
    24927 actiphenol O=C2CC(CC(=O 201 215178 http://www.s PHYSPROP
    24928 fustin Oc1ccc(cc1O) 227 215542 http://www.s PHYSPROP
    24929 2-chloro-3,4- Cc1ccc(O)c(Cl 27 216507 http://www.s PHYSPROP
    24930 cordycepin Nc3ncnc2c3n 225.5 217130 http://www.s PHYSPROP
    24931 nebularine OCC3OC(n2cn 181 217498 http://www.s PHYSPROP
    24932 p-methylpheny
    OC(=O)Cc1ccc 93 217532 http://www.s PHYSPROP
    24933 boldine COc4cc2c(CC1 163 217564 http://www.s PHYSPROP
    24934 o-phenoxyanisCOc2ccccc2Oc 79 217791 http://www.s PHYSPROP
    24935 tris(3,4-xylen Cc1cc(ccc1C)O 72 217911 http://www.s PHYSPROP
    24936 oxandrolone O=C2CC3CCC1C 236.5 218095 http://www.s PHYSPROP
    24937 6-azauridinetrCC(=O)OCC2O 100 218176 http://www.s PHYSPROP
    24938 2-chlorobipheClc2ccccc2c1c 34 218253 http://www.s PHYSPROP
    24939 4-benzylmorpc1ccccc1CN2 194 218513 http://www.s PHYSPROP
    24940 5-(a-phenylet NNC(=O)C(=O) 157 218819 http://www.s PHYSPROP
    24941 9-(2-chloro-b Clc4ccccc4C=C 69.5 219644 http://www.s PHYSPROP
    24942 propanenitrileCC(=O)OC(C)C -75 220333 http://www.s PHYSPROP
    24943 ecgonine CN2C1CCC2C(C 205 220719 http://www.s PHYSPROP
    24944 2,7-dichloro-9Clc1ccc2c3ccc 128 220793 http://www.s PHYSPROP
    24945 cyclobutane, eCCC1CCC1 -142.9 221079 http://www.s PHYSPROP
    24946 trans-1-phenyCC=Cc1ccccc1 -29.3 221082 http://www.s PHYSPROP
    24947 beta-methylstCC=Cc1ccccc1 -27.1 221082 http://www.s PHYSPROP
    24948 phenol, 2-chloOc1ccc(cc1Cl 40.5 221402 http://www.s PHYSPROP
    24949 trifluridine FC(F)(F)C1=C 187.5 221798 http://www.s PHYSPROP
    24950 lunacridine CC(C)C(O)CC2 86.5 222484 http://www.s PHYSPROP
    24951 perfluorohexyFC(F)(OC(F)(F)C -90 222993 http://www.s PHYSPROP
    24952 3-nitro-1,1,1- ClC(Cl)(Cl)C(O 45.5 224304 http://www.s PHYSPROP
    24953 benzarone Oc1ccc(cc1)C 124.3 224468 http://www.s PHYSPROP
    24954 3'-adenylic ac O=P(O)(O)OC3 197 224592 http://www.s PHYSPROP
    24955 ambrosin O=C3C=CC2C( 146 225683 http://www.s PHYSPROP
    24956 parthenin O=C2C=CC3(O) 164.5 225686 http://www.s PHYSPROP
    24957 p-meo-b-pheny
    COc1ccc(cc1) 99 225971 http://www.s PHYSPROP
    24958 n,n'-(4-methyCc2ccc(NNc1cc 135 226296 http://www.s PHYSPROP
    24959 3-methyl-2-phCc1c3ccccc3n 91.5 226885 http://www.s PHYSPROP
    24960 beta-d-glucop[O-][N+](=O) 166.5 227670 http://www.s PHYSPROP
    24961 ?-d-glucopyra[O-][N+](=O) 211 227670 http://www.s PHYSPROP
    24962 sebacoin O=C1CCCCCC 42 227993 http://www.s PHYSPROP
    24963 resibufogeninO=C1C=CC(=C 155 228186 http://www.s PHYSPROP
    24964 1h-indole, 1-eCCn2ccc1cccc 105 229257 http://www.s PHYSPROP
    24965 sulfonyldiacetOC(=O)CS(=O) 182 229605 http://www.s PHYSPROP
    24966 pregnan-20-one
    CC(=O)C1CCC 149.5 230963 http://www.s PHYSPROP
    24967 allopregnan-3CC(=O)C1CCC 177 230963 http://www.s PHYSPROP
    24968 allopregnan-3CC(=O)C1CCC 194.5 230963 http://www.s PHYSPROP
    24969 ouabagenin OC4CC5(O)CCC 236.5 230970 http://www.s PHYSPROP
    24970 adenosine, 2',Nc3ncnc2c3n 185 231922 http://www.s PHYSPROP
    24971 norgestrienonO=C1C=C2CCC 169 233076 http://www.s PHYSPROP
    24972 isopimaric aci O=C(O)C1(C)C 160 234940 http://www.s PHYSPROP
    24973 4-cyanoquinolN#Cc1ccnc2cc 103.5 237964 http://www.s PHYSPROP
    24974 1,1,-diphenyl CCCCCCC(c1cc 14 238645 http://www.s PHYSPROP
    24975 tazettine COC1C=CC35C 210 238904 http://www.s PHYSPROP
    24976 demegestoneCC(=O)C3(C) 106 240360 http://www.s PHYSPROP
    24977 digitoxigenin OC5CCC4(C)C( 253 241192 http://www.s PHYSPROP
    24978 medrogeston CC(=O)C2(C)C 144 242783 http://www.s PHYSPROP
    24979 populin OCc3ccccc3OC 180 245248 http://www.s PHYSPROP
    24980 gelsemine O=C6Nc1cccc 178 245682 http://www.s PHYSPROP
    24981 2(1h)-pyridin CC=1C=CNC(= 130 247223 http://www.s PHYSPROP
    24982 prednimustin ClCCN(CCCl)c 163.5 247793 http://www.s PHYSPROP
    24983 coclaurine Oc1ccc(cc1)C 220 248088 http://www.s PHYSPROP
    24984 neoquassin O=C1C(OC)=CC 227 250123 http://www.s PHYSPROP
    24985 thymidine, 3'-CC1=CN(C(=O) 177 250441 http://www.s PHYSPROP
    24986 matrine O=C2CCCC1C3 76 251833 http://www.s PHYSPROP
    24987 benzamide, 2-Nc1c(cc(Cl)cc 162.5 252690 http://www.s PHYSPROP
    24988 rosoxacin O=C(O)C2=CN( 290 253208 http://www.s PHYSPROP
    24989 3,4-bis(1,3-b OC5OCC(Cc1c 131.5 253695 http://www.s PHYSPROP
    24990 4,5-dichloro-qClc1cccc2nccc 118 254498 http://www.s PHYSPROP
    24991 1(2h)-isoquin [O-][n+]1cc2c 212.5 256210 http://www.s PHYSPROP x name does not match smiles JCB
    24992 tetracosane, 1CCCCCCCCCCC 10.8 259995 http://www.s PHYSPROP
    24993 pentacosane, CCCCCCCCCCC 9.7 261488 http://www.s PHYSPROP
    24994 hexacosane, 1CCCCCCCCCCC 13.7 261489 http://www.s PHYSPROP
    24995 lupinine OCC1CCCN2C 70 262455 http://www.s PHYSPROP
    24996 2,3,5,6-tetraf Fc1c(C#N)c(F) 34 262708 http://www.s PHYSPROP
    24997 2,3,4,5-tetraf Fc1c(cc(F)c(F 86 262711 http://www.s PHYSPROP
    24998 1-chloro-3-meO=[N+]([O-])c1 61 263041 http://www.s PHYSPROP
    24999 tridecane, 7-hCCCCCCC(CCC -28.3 263781 http://www.s PHYSPROP
    25000 1,3-butanedion
    O=C(CC(C)=O) 85 265204 http://www.s PHYSPROP
    25001 2,3-pyrazinediN#Cc1nccnc1 132 265542 http://www.s PHYSPROP
    25002 2,3,4-trifluor Fc1ccc(C(=O)O 141 267773 http://www.s PHYSPROP
    25003 2,5-furandicarCOC(=O)c1ccc 112 268344 http://www.s PHYSPROP
    25004 cellobiose O=CC(O)C(O)C 240 268424 http://www.s PHYSPROP
    25005 medinoterb acO=C(C)Oc1c(cc 86.5 270129 http://www.s PHYSPROP
    25006 5-thio-d-glucoOC1C(O)C(CO) 135.5 271575 http://www.s PHYSPROP
    25007 a-ergostenol CC(C)C(C)CCC 131 276651 http://www.s PHYSPROP
    25008 campesterol CC(C)C(C)CCC 157.5 276676 http://www.s PHYSPROP
    25009 tomatidine CC6C2C(CC3C 210.5 276680 http://www.s PHYSPROP
    25010 desmosterol C/C(C)=CCCC( 121.5 276871 http://www.s PHYSPROP
    25011 2h-indol-2-oneCC1(C)c2cccc 154.3 276924 http://www.s PHYSPROP
    25012 beta-d-galact OCC2OC(Oc1cc 154 277113 http://www.s PHYSPROP
    25013 beta-d-glucopOCC2OC(Oc1cc 177 277113 http://www.s PHYSPROP
    25014 5-chloro-3-meClc1cc(C)nn1 118.5 279682 http://www.s PHYSPROP
    25015 1-cyclopentene
    OC(=O)C=1CCC 135 279792 http://www.s PHYSPROP
    25016 phenylacetic aO=C(OC(=O)Cc 73.3 279804 http://www.s PHYSPROP
    25017 glucosamine OC(C(N)C=O)C 88 281772 http://www.s PHYSPROP
    25018 canrenone O=C5CCC2(CC 150 282625 http://www.s PHYSPROP
    25019 ranimustine OC1C(O)C(O)C 111 284249 http://www.s PHYSPROP
    25020 oxindole O=C1Cc2cccc 128 284794 http://www.s PHYSPROP
    25021 hex-2-ynoic acCCCC#CC(=O) 27 287294 http://www.s PHYSPROP
    25022 benzoic acid, Nc1ccc(cc1)C 82 291315 http://www.s PHYSPROP
    25023 perezone OC1=C(C(C)CC 103.5 300841 http://www.s PHYSPROP
    25024 9,10-anthraceNc2cc3C(=O)c 281.5 305271 http://www.s PHYSPROP
    25025 taraxerol CC5(C)CC3C(C 283.5 305433 http://www.s PHYSPROP
    25026 daucol CC(C)C2CCC3( 114 306387 http://www.s PHYSPROP
    25027 acetobromgluO=C(C)OC1OC( 88.5 306631 http://www.s PHYSPROP
    25028 1,1'-biphenyl,CCOc1cc(ccc1) 35 306814 http://www.s PHYSPROP
    25029 [1,1'-biphenylO=C(C)Oc1ccc( 89 306959 http://www.s PHYSPROP
    25030 sakuranetin Oc1ccc(cc1)C 152 308963 http://www.s PHYSPROP
    25031 uzarin O=C1C=C(CO1 269 309301 http://www.s PHYSPROP
    25032 benzene, 1-nit[O-][N+](=O)c 82 309433 http://www.s PHYSPROP
    25033 boronic acid, CCCB(O)O 107 311707 http://www.s PHYSPROP
    25034 indole-3-acetoN#CCc2cnc1cc 36 312357 http://www.s PHYSPROP
    25035 gentiopicrin OC3C(O)C(O) 191 314628 http://www.s PHYSPROP
    25036 uridine, 2',3'- O=C1NC(=O)N 128 315874 http://www.s PHYSPROP
    25037 2,3-difluorobeFc1c(cccc1F)C 164 328957 http://www.s PHYSPROP
    25038 4-methoxypheCOc1ccc(cc1) 159 337197 http://www.s PHYSPROP
    25039 equol Oc1ccc(cc1)C 189.5 339332 http://www.s PHYSPROP
    25040 2h-pyran-2,5-dCC1(C)OC(C)( 208 348038 http://www.s PHYSPROP
    25041 capecitabine O=C(OCCCCC) 115.5 355054 http://www.s PHYSPROP
    25042 4-morpholine NCCN1CCOCC 25.6 361265 http://www.s PHYSPROP
    25043 hydrocortamaCCN(CC)CC(=O 162.5 361312 http://www.s PHYSPROP
    25044 2-methylpropaCC(C)(C)S(=O) 113 362633 http://www.s PHYSPROP
    25045 b-erythroidin O=C4CC3=C(C 99.5 363463 http://www.s PHYSPROP
    25046 funtumine CC(=O)C1CCC 126 363656 http://www.s PHYSPROP
    25047 sinomenine COC3=CC4C2Cc 162 368395 http://www.s PHYSPROP
    25048 hellebrin O=C1C=CC(=C 283.5 369616 http://www.s PHYSPROP
    25049 aconine OC24C5C1N(CC 132 369805 http://www.s PHYSPROP
    25050 reserpic acid O=C(O)C2C(OC 242 371595 http://www.s PHYSPROP
    25051 biocozamycin CC(O)(CO)C(O 188 376959 http://www.s PHYSPROP
    25052 cholanic acid O=C(O)CCC(C 163.5 378617 http://www.s PHYSPROP
    25053 vindesine O=C(OC)C2(CC 231 379477 http://www.s PHYSPROP
    25054 normorphine Oc1ccc2CC5N 273 380506 http://www.s PHYSPROP
    25055 rimiterol OC(c1ccc(O)c 203.5 381258 http://www.s PHYSPROP
    25056 corticosteron OCC(=O)C3CC 181 388799 http://www.s PHYSPROP
    25057 pregnane-3,20-
    CC(=O)C2CCC 123 389575 http://www.s PHYSPROP
    25058 3,20-allopreg CC(=O)C2CCC 200 389575 http://www.s PHYSPROP
    25059 azafenidin C#CCOc1cc(c( 168 391330 http://www.s PHYSPROP
    25060 thenylchlor COc2ccsc2CN(c 73 391337 http://www.s PHYSPROP
    25061 flumiclorac-peO=C(OCCCCC)C 89 391348 http://www.s PHYSPROP
    25062 2-propenoic acO=C(O)/C=C/c 133 392447 http://www.s PHYSPROP
    25063 cinnamic acid O=C(O)/C=C/c 133 392447 http://www.s PHYSPROP
    25064 retinoic acid CC=1CCCC(C)( 181 392618 http://www.s PHYSPROP
    25065 resveratrol Oc2cc(/C=C/c1 254 392875 http://www.s PHYSPROP
    25066 retinol CC=1CCCC(C)( 63.5 393012 http://www.s PHYSPROP
    25067 crotonaldehy CC=CC=O -76.5 394562 http://www.s PHYSPROP
    25068 trans-crotona CC=CC=O -76 394562 http://www.s PHYSPROP
    25069 des Oc1ccc(cc1)C( 170.5 395306 http://www.s PHYSPROP
    25070 dexamethaso OCC(=O)[C@@ 263 412425 http://www.s PHYSPROP
    25071 fluorometholoCC(=O)C4(OC( 297.5 432340 http://www.s PHYSPROP
    25072 epimestrol COc3cc4CCC2C 159 432351 http://www.s PHYSPROP
    25073 veatchine CC14CCCC3(C 119.5 432578 http://www.s PHYSPROP
    25074 cyclohexanol, O=C(C)OC1CC( 85 432658 http://www.s PHYSPROP
    25075 lithocholic aciO=C(O)CCC(C 186 437560 http://www.s PHYSPROP
    25076 clostebol ClC=2C(=O)CC 189 451875 http://www.s PHYSPROP
    25077 benzene, (hexCCCCCCOc1cc -19 451934 http://www.s PHYSPROP
    25078 2,2,6-trimeth CC(C)(C)CCCC( -105 452368 http://www.s PHYSPROP
    25079 1,1'-oxybis[2, ClC(Cl)(Cl)C(C -50 452470 http://www.s PHYSPROP
    25080 deserpidine COc1cc(cc(OC 230.5 452498 http://www.s PHYSPROP
    25081 2,4-dimethyl- CC(C)C(C(C)C) -81.7 452568 http://www.s PHYSPROP
    25082 silane, trichl Cc1ccccc1[Si](C -25.5 452615 http://www.s PHYSPROP
    25083 benzyl morphCN2CCC65C3C= 132 452673 http://www.s PHYSPROP
    25084 oxymesteroneOC=2C(=O)CCC 170 452702 http://www.s PHYSPROP
    25085 etorphine CC(O)(CCC)C1 215.5 452704 http://www.s PHYSPROP
    25086 nicofuranose OC5(COC(=O)c 141 452807 http://www.s PHYSPROP
    25087 calusterone CC3CC4=CC(=O 128 452888 http://www.s PHYSPROP
    25088 bolasterone CC3CC4=CC(=O 164 452888 http://www.s PHYSPROP
    25089 2,6-octadiene,C/C(C)=CCCC= -74.4 452966 http://www.s PHYSPROP
    25090 2,2,3,3,4-pen CC(C)(C)C(C)(C -36.4 452968 http://www.s PHYSPROP
    25091 2,2,3,4,4-pen CC(C)(C)C(C)C( -38.7 452969 http://www.s PHYSPROP
    25092 cyclohexane, 1ClC1CCC(Cl)C 18 452970 http://www.s PHYSPROP
    25093 2-hexanethiolCC(S)CCCC -147 452976 http://www.s PHYSPROP
    25094 silane, dichl Cc1ccc(cc1)[Si] 57 453170 http://www.s PHYSPROP
    25095 chlorotrinitr O=[N+]([O-])C( 4.5 453284 http://www.s PHYSPROP
    25096 heptane, 1-et CCCCCCCOCC -68.3 453298 http://www.s PHYSPROP
    25097 l-tyrosine, n- Oc1ccc(CC(NC 293 453342 http://www.s PHYSPROP
    25098 pentaphene c2cc1cc5ccccc 257 453521 http://www.s PHYSPROP
    25099 2,3,6-trifluor Fc1c(C(=O)O)c 130.5 453633 http://www.s PHYSPROP
    25100 diethyl dimet O=P(OCC)(OCC 8.3 453656 http://www.s PHYSPROP
    25101 tert-nonanethCC(C)(S)CCCC -43.15 453750 http://www.s PHYSPROP
    25102 eseridine CNC(=O)Oc1cc 129 453767 http://www.s PHYSPROP
    25103 2,4,6-trifluor OC(=O)c1c(F)c 143 453910 http://www.s PHYSPROP
    25104 naphthalene, CCCCCCc1ccc2 -3 453925 http://www.s PHYSPROP
    25105 2,5-dimethyl- CC(C)(CCC(C) 105 454000 http://www.s PHYSPROP
    25106 cyclopentaneca
    CC1(CCC(C)C1 106 454035 http://www.s PHYSPROP
    25107 3-methyl-cycl O=C1CC(C)=C -21 454064 http://www.s PHYSPROP
    25108 acetonitrile, dClC(Cl)(F)C#N -110 454210 http://www.s PHYSPROP
    25109 2-methyl-3-h CCC#CC(C)C -116.7 454272 http://www.s PHYSPROP
    25110 perfluoronon FC(F)(C(F)(F)C( -16 454320 http://www.s PHYSPROP
    25111 2-butanamine,CC(C)(C)C(C)N -20 454363 http://www.s PHYSPROP
    25112 benzoylhydra O=C(NN)c1cc( 158 454393 http://www.s PHYSPROP
    25113 2,4,2',4'-tetr Cc2cc(C)ccc2c 41 454408 http://www.s PHYSPROP
    25114 silane, tribr Br[Si](Br)(Br)C -28.4 454464 http://www.s PHYSPROP
    25115 butane, 2,2-diCC(Cl)(Cl)CC -74 454552 http://www.s PHYSPROP
    25116 boronic acid, CCB(O)O 40 454591 http://www.s PHYSPROP
    25117 2,4,5-trifluor Fc1cc(C(=O)O) 100 454604 http://www.s PHYSPROP
    25118 gamabufotali O=C1C=CC(=C 254 454630 http://www.s PHYSPROP
    25119 phenomorphaOc3ccc4CC2C5 244 454635 http://www.s PHYSPROP
    25120 cedrene CC1=CCC23CC1 262.5 454638 http://www.s PHYSPROP
    25121 cinchonamineOCCc3c4cccc 186 454663 http://www.s PHYSPROP
    25122 5-azulenemetha
    CC(C)(O)C1CC 91 454675 http://www.s PHYSPROP
    25123 7-bromoquinoBrc1cc2ncccc 34 454686 http://www.s PHYSPROP
    25124 pholcodine CN3CCC45c6c 91 454729 http://www.s PHYSPROP
    25125 heptanoic acidCCCCCCCCOC( -22.5 454746 http://www.s PHYSPROP
    25126 sclareol C=CC(C)(O)CC 97 454751 http://www.s PHYSPROP
    25127 methandriol CC2(O)CCC1C 206 454783 http://www.s PHYSPROP
    25128 cannabidiol CC(=C)C2CCC( 67 454786 http://www.s PHYSPROP
    25129 2h-thiopyran, CC1CCCSC1 -60 454803 http://www.s PHYSPROP
    25130 norethandrol O=C2CCC3C4C 140.5 454812 http://www.s PHYSPROP
    25131 3-ethyl-2,2,3 CC(C)(C)C(C)( -42.5 454840 http://www.s PHYSPROP
    25132 lupeol C=C(C)C4CCC5 216 454916 http://www.s PHYSPROP
    25133 1,6-methanona
    CC1(C)C2CC3C 56 455259 http://www.s PHYSPROP
    25134 17-alpha-hydrCC(=O)C2(O)C 222.5 455281 http://www.s PHYSPROP
    25135 quinoline, 4- COc1ccnc2ccc 41 455291 http://www.s PHYSPROP
    25136 2-methylhexanOC(=O)CCCC(C 64 455411 http://www.s PHYSPROP
    25137 1,1,1,3,3,3-h [2H]C([2H])([ -98.3 455535 http://www.s PHYSPROP
    25138 nonanoic acidCCCCCCCOC(= -15.5 455712 http://www.s PHYSPROP
    25139 methandrosteO=C3C=C4CCC2 163.5 455746 http://www.s PHYSPROP
    25140 cholesta-3,5- CC(C)CCCC(C 80 455831 http://www.s PHYSPROP
    25141 naphthalene, Cc1ccc2CC(C) 20 455847 http://www.s PHYSPROP
    25142 acetaldehyde CC(N)O 97 455852 http://www.s PHYSPROP
    25143 cedrol CC3CCC1C23CC 86 455926 http://www.s PHYSPROP
    25144 silane, methylC[Si](c1ccccc1 69.5 455964 http://www.s PHYSPROP
    25145 solanidine OC5CC6=CCC1C 218.5 455985 http://www.s PHYSPROP
    25146 2,5-dimethyl- C/C(C)=CCC(= 14 456246 http://www.s PHYSPROP
    25147 perbenzoic acOOC(=O)c1ccc 42 456283 http://www.s PHYSPROP
    25148 1-(3-methylphCc1cc(ccc1)O 166 457729 http://www.s PHYSPROP
    25149 t-2 toxin CC(C)CC(=O)O 151.5 461455 http://www.s PHYSPROP
    25150 3-nonynoic acO=C(O)CC#CC 17 465440 http://www.s PHYSPROP
    25151 6-nonynoic acO=C(O)CCCCC 14 465502 http://www.s PHYSPROP
    25152 allopregnane-CC(=O)C2(O)C 265 467703 http://www.s PHYSPROP
    25153 l-proline, 1-acOC1CC(C(=O)O 132 468812 http://www.s PHYSPROP
    25154 cymarin O=C1C=C(CO1) 148 469424 http://www.s PHYSPROP
    25155 triamcinoloneCC(=O)OCC(=O 235 469587 http://www.s PHYSPROP
    25156 picein CC(=O)c1ccc( 195.5 469882 http://www.s PHYSPROP
    25157 tiomesterone CC(=O)SC3CC1 205.5 471146 http://www.s PHYSPROP
    25158 medroxyprogeCC(=O)C2(O)C 214.5 471209 http://www.s PHYSPROP
    25159 norethindroneCC(=O)OC2(C 161.5 471291 http://www.s PHYSPROP
    25160 scillarenin O=C1C=CC(=C 235 471784 http://www.s PHYSPROP
    25161 2-propenoic acC=CC(=O)OC1C 97 473659 http://www.s PHYSPROP
    25162 androstenedioCCC(=O)OC2CC 113 475967 http://www.s PHYSPROP
    25163 thiocolchicineCC(=O)NC2CCc 193 475988 http://www.s PHYSPROP
    25164 4-cyclopentene
    OC=1C(=O)C(= 150 476003 http://www.s PHYSPROP
    25165 stevioside OC7C(O)C(O)C 198 477115 http://www.s PHYSPROP
    25166 digitoxose OC1C(C)OCC( 112 477149 http://www.s PHYSPROP
    25167 8-bromooctano
    O=C(O)CCCCC 38.5 477171 http://www.s PHYSPROP
    25168 7-azabicyclo[ C1CCCC2NC12 21 477892 http://www.s PHYSPROP
    25169 1-isopropylth CC(C)SC1OC(C 121 480698 http://www.s PHYSPROP
    25170 4h-3,1-benzoxO=C2N=C(Oc1c 123.5 482968 http://www.s PHYSPROP
    25171 methyl phenylO=S(=O)(CC(= 35 483123 http://www.s PHYSPROP
    25172 iodonium, diph
    ClI(c1ccccc1)c 234 483234 http://www.s PHYSPROP
    25173 5-nonynoic acO=C(O)CCCC# -3 483541 http://www.s PHYSPROP
    25174 (3a,5a)-androsCC34CCC1C(C 142.75 483778 http://www.s PHYSPROP
    25175 cyclohexanol, CC1(C)CCCCC 8 484756 http://www.s PHYSPROP
    25176 vamidothion CC(SCCSP(=O) 43 486975 http://www.s PHYSPROP
    25177 benzyl salicyl O=C(OCc1cccc 130.5 488924 http://www.s PHYSPROP
    25178 ibuprofen CCC(C)c1ccc(c 76 489395 http://www.s PHYSPROP
    25179 1h-benzotriazO=C(O)CC(C)n 150 489716 http://www.s PHYSPROP
    25180 2,3,5,6-tetraf Fc1c(C(=O)O)c 151 493409 http://www.s PHYSPROP
    25181 6-methyl-4-pyNc1cc(C)ncn1 197 498057 http://www.s PHYSPROP
    25182 n-maleoyl-3-aOC(=O)CCN1C 104.5 498738 http://www.s PHYSPROP
    25183 nonactin CC5CC1CCC(O1 147.5 499265 http://www.s PHYSPROP
    25184 bis(2-diisopr CC(C)N(CCOP( 77.5 499961 http://www.s PHYSPROP
    25185 1h-indene, 1, BrC1c2ccccc2 32 500588 http://www.s PHYSPROP
    25186 trichloroiodo ClC(Cl)(Cl)I -7.8 500855 http://www.s PHYSPROP
    25187 methanethione
    S=C(c1ccccc1) 53.5 502886 http://www.s PHYSPROP
    25188 betamethasonOCC(=O)C4(OC 183.5 503068 http://www.s PHYSPROP
    25189 desonide OCC(=O)C54OC 274 503087 http://www.s PHYSPROP
    25190 boldenone O=C3C=C4CCC 165 503228 http://www.s PHYSPROP
    25191 3-(ethylaminoOc1cccc(NCC) 62 503263 http://www.s PHYSPROP
    25192 aspidospermi CC(=O)N5C1CC 208 504089 http://www.s PHYSPROP
    25193 1-naphthalenec
    O=C(O)C1=CCC 125 506193 http://www.s PHYSPROP
    25194 1h-indene, 5-hCCCCCCc1ccc -34 506803 http://www.s PHYSPROP
    25195 methylprednisCC(=O)OCC(=O 206.5 508102 http://www.s PHYSPROP
    25196 sesamolin O(C2OCC1C(O 93.5 509377 http://www.s PHYSPROP
    25197 2-(trifluoromeFC(F)(F)C(=C) 51.5 510851 http://www.s PHYSPROP
    25198 1h-indole-3-caO=C(OC)c2cnc 150.5 512092 http://www.s PHYSPROP
    25199 1h-pyrazole, 4c1ccc(cc1)N2 52 512530 http://www.s PHYSPROP
    25200 1h-pyrazole, 4c1ccc(cc1)C= 45.8 512652 http://www.s PHYSPROP
    25201 diisononyl phtCC(C)CCCCCCO -48 513622 http://www.s PHYSPROP
    25202 puberulic acidOC1=C(O)C=C( 317 515376 http://www.s PHYSPROP
    25203 acetic acid, [ O=S(=O)(CC(=O 82 515853 http://www.s PHYSPROP
    25204 procerin OC1=CC=C(CC= 71.5 516880 http://www.s PHYSPROP
    25205 3,4-dichloro- ClC=2c1ccccc 184 518018 http://www.s PHYSPROP
    25206 tyrosine-amidOc1ccc(CC(NC 224 518032 http://www.s PHYSPROP
    25207 2-furancarboxO=Cc1ccc(Br) 83.5 521915 http://www.s PHYSPROP
    25208 peyonine O=C(O)c2cccn 132 523536 http://www.s PHYSPROP
    25209 2-amino-3,6-dNc1c(C(=O)O)c 155 525531 http://www.s PHYSPROP
    25210 grindelic acid O=C(O)CC1(C) 100.5 527785 http://www.s PHYSPROP
    25211 2,4-dichloroquClc1cc(Cl)nc2 67.5 528072 http://www.s PHYSPROP
    25212 digoxigenin OC45CCC(C1= 222 529067 http://www.s PHYSPROP
    25213 gitoxigenin OC5CCC4(C)C( 234 529321 http://www.s PHYSPROP
    25214 ochratoxin b O=C(O)C(Cc1c 221 529965 http://www.s PHYSPROP
    25215 thalicarpine COc6cc7CCN(C 160.5 530199 http://www.s PHYSPROP
    25216 3,4-dihydro-6 COc1cc2C(=O 175 530343 http://www.s PHYSPROP
    25217 tolfenamic aciCc2c(Nc1ccccc 207.25 530683 http://www.s PHYSPROP
    25218 1,1'-biphenyl,COc2ccccc2c1 155 531832 http://www.s PHYSPROP
    25219 oxazole, 4,5-dc1ccc(cc1)c2n 44 533281 http://www.s PHYSPROP
    25220 gigantine CC1c2cc(OC)c 151.5 533407 http://www.s PHYSPROP
    25221 phenol, 2-iod Cc1ccc(O)c(I)c 35 535697 http://www.s PHYSPROP
    25222 mesterolone O=C4CC3CCC2C 204 535912 http://www.s PHYSPROP
    25223 paclobutrazol OC(C(Cc1ccc(C 165.5 536024 http://www.s PHYSPROP
    25224 benzene, 1,2, COc1c(cc(CC= 25 536429 http://www.s PHYSPROP
    25225 tetrahydrocorOCC(=O)C3(O) 190 537175 http://www.s PHYSPROP
    25226 allotetrahydr OCC(=O)C3(O) 213 537175 http://www.s PHYSPROP
    25227 allopregnane-OCC(=O)C3(O) 240 537175 http://www.s PHYSPROP
    25228 allopregnane-OCC(=O)C4(O) 244.5 537828 http://www.s PHYSPROP
    25229 artemisin CC1C2C(O)CC3 203 540153 http://www.s PHYSPROP
    25230 lysergic acid O=C(O)C2C=C1 240 541006 http://www.s PHYSPROP
    25231 medicarpin COc2cc3OC1c4 128 541329 http://www.s PHYSPROP
    25232 cholesta-8,24-C/C(C)=CCCC( 110 541433 http://www.s PHYSPROP
    25233 nimbiol Cc2cc3C(=O)C 250 541613 http://www.s PHYSPROP
    25234 4-pregnene-17OCC(O)C3(O) 190 543422 http://www.s PHYSPROP
    25235 bromolysergi CCN(CC)C(=O) 123.5 544885 http://www.s PHYSPROP
    25236 algestone CC(=O)C2(O)C 225 545025 http://www.s PHYSPROP
    25237 11-ketoproge CC(=O)C3CCC 172 547107 http://www.s PHYSPROP
    25238 colpormon CC(=O)Oc3cc4 179.5 547129 http://www.s PHYSPROP
    25239 triamcinoloneCC(C)(C)CC(= 295 549640 http://www.s PHYSPROP
    25240 cinobufotalin O=C1C=CC(=C 260.5 549801 http://www.s PHYSPROP
    25241 vomicine Oc1cccc2c1N 282 549808 http://www.s PHYSPROP
    25242 (z)-2-butenoicCC=CC(=O)O 15 552744 http://www.s PHYSPROP x wrong isomer JCB
    25243 crotonic acid CC=CC(=O)O 72 552744 http://www.s PHYSPROP
    25244 crotonic acid CC=CC(=O)O 72 552744 http://www.s PHYSPROP
    25245 3-phenyl-2-prO=CC=Cc1cccc -7.5 553117 http://www.s PHYSPROP
    25246 trans-cinnam O=CC=Cc1cccc -7.5 553117 http://www.s PHYSPROP
    25247 oleic acid O=C(O)CCCCC 13.37 553123 http://www.s PHYSPROP
    25248 elaidic acid O=C(O)CCCCC 45 553123 http://www.s PHYSPROP
    25249 anethole COc1ccc(/C=C 21.3 553166 http://www.s PHYSPROP
    25250 methyl maleaCOC(=O)/C=C/ -19 553171 http://www.s PHYSPROP x wrong isomer JCB
    25251 2-butenedioicCOC(=O)/C=C/ 88.5 553171 http://www.s PHYSPROP x clearly out of range JCB
    25252 cinnamic acid,O=C(/C=C/c1c 7 553344 http://www.s PHYSPROP
    25253 benzalacetop O=C(/C=C/c1c 57.5 553346 http://www.s PHYSPROP
    25254 phenyl (2-phen
    O=C(/C=C/c1c 59 553346 http://www.s PHYSPROP
    25255 benzene, 1,2- COc1cc(ccc1O 18 553362 http://www.s PHYSPROP
    25256 cinnamic acid,Clc1ccc(/C=C/ 249 553383 http://www.s PHYSPROP
    25257 alpha-methylcCC(=C/c1cccc 80 553403 http://www.s PHYSPROP
    25258 cis-decene CCCCC=CCCCC -112 553406 http://www.s PHYSPROP
    25259 trans-5-decenCCCCC=CCCCC -73 553406 http://www.s PHYSPROP
    25260 1,3,5,7-cyclooC=1C=CC=CC= -4.7 553448 http://www.s PHYSPROP
    25261 2-butenenitrilCC=CC#N -51.5 553494 http://www.s PHYSPROP x missing stereochem in SMILES JCB
    25262 2-butenenitrileCC=CC#N 201 553494 http://www.s PHYSPROP x liquid cannot melt at 200C JCB
    25263 1,2-ethylene BrC=CBr -53 553502 http://www.s PHYSPROP
    25264 ethene, 1,2-diBrC=CBr -53 553502 http://www.s PHYSPROP
    25265 ethene, 1,2-diBrC=CBr -6.5 553502 http://www.s PHYSPROP
    25266 2-butenedinitriN#CC=CC#N 96.8 553503 http://www.s PHYSPROP
    25267 retinal CC=1CCCC(C)( 63 553582 http://www.s PHYSPROP
    25268 1-piperoyl-(e, O=C(/C=C/C= 131.5 553590 http://www.s PHYSPROP
    25269 3-hexene, (z)-CCC=CCC -137.8 553629 http://www.s PHYSPROP x wrong isomer JCB
    25270 trans-3-hexenCCC=CCC -115.4 553629 http://www.s PHYSPROP
    25271 3-hexene CCC=CCC -90 553629 http://www.s PHYSPROP x wrong isomer JCB
    25272 3,4-dimethyl- CC=C(/C)C(C)C -124.2 553631 http://www.s PHYSPROP
    25273 2,4-hexadieneCC=CC=CC -79 553634 http://www.s PHYSPROP
    25274 2,4-hexadieneCC=CC=CC -44.9 553634 http://www.s PHYSPROP
    25275 cyclooctene C1CC=CCCCC1 -12 553642 http://www.s PHYSPROP
    25276 1,5,9-cyclodo C1C=CCCC=CC -17 553643 http://www.s PHYSPROP
    25277 stilbene (transC(=C/c1ccccc1 123 553649 http://www.s PHYSPROP
    25278 stilbene C(=C/c1ccccc1 124 553649 http://www.s PHYSPROP
    25279 acrylic acid, 3 ClC=CC(=O)O 82 553684 http://www.s PHYSPROP
    25280 citraconic aci O=C(O)C=C(C) 93.5 553689 http://www.s PHYSPROP
    25281 2-butenoic aciCC=CC(=O)OC -42 553692 http://www.s PHYSPROP
    25282 2-butenedioicO=C(/C=C/C( 1.5 553702 http://www.s PHYSPROP
    25283 1,2-dichloroe ClC=CCl -57 553742 http://www.s PHYSPROP
    25284 1,2-dichloroetCl[C@H]=CCl -49.8 553742 http://www.s PHYSPROP
    25285 3-octene, (z)- CCC=CCCCC -126 553784 http://www.s PHYSPROP
    25286 3-octene, (e)- CCC=CCCCC -110 553784 http://www.s PHYSPROP
    25287 2'-hydroxychaO=C(/C=C/c1c 90 553827 http://www.s PHYSPROP
    25288 b-nitro-4-oh- Oc1ccc(cc1OC) 169 553960 http://www.s PHYSPROP
    25289 benzene, (3-c ClCC=Cc1cccc -19 555070 http://www.s PHYSPROP
    25290 2-hexene (tra CCCC=CC -133 555073 http://www.s PHYSPROP
    25291 hexene - mixt CCCC=CC -98 555073 http://www.s PHYSPROP
    25292 2-hexene CCCC=CC -98 555073 http://www.s PHYSPROP
    25293 4-octene (tranCCCC=CC -93.8 555073 http://www.s PHYSPROP
    25294 2-heptene (tr CC=CCCCC -109.5 555074 http://www.s PHYSPROP
    25295 benzenamine,CN(C)c2ccc(/C 150 555409 http://www.s PHYSPROP
    25296 6-methylisoquCc1ccc2cnccc 85.5 556289 http://www.s PHYSPROP
    25297 bromomaleic O=C(O)C=C(/B 141 556534 http://www.s PHYSPROP
    25298 bromofumaricO=C(O)C=C(/B 184.3 556534 http://www.s PHYSPROP
    25299 2-butene, 1,4-BrCC=CCBr 53.4 556548 http://www.s PHYSPROP
    25300 2,4-hexadien-CC=CC=CCO 30.5 556559 http://www.s PHYSPROP
    25301 2,4-hexadien-1CC=CC=CCO 30.5 556559 http://www.s PHYSPROP
    25302 benzene, 1,1' COc2ccc(/C=C/ 214.5 556587 http://www.s PHYSPROP
    25303 2-benzofuranca
    O=C(OCC)c1cc 30.5 556657 http://www.s PHYSPROP
    25304 3-methylcycloC[C@H]1C[C@ -0.5 556902 http://www.s PHYSPROP
    25305 2-propen-1-onCOc2ccc(/C=C 79 557051 http://www.s PHYSPROP
    25306 penta-2,4-dienC=CC=CC(=O) 79 557262 http://www.s PHYSPROP
    25307 2-pentenoic acCC(C)/C=C/C( 35 557267 http://www.s PHYSPROP
    25308 1,4-dichloro-2ClCC=CCCl 2 557415 http://www.s PHYSPROP
    25309 1,4-dichloro- ClCC=CCCl 3.5 557415 http://www.s PHYSPROP
    25310 2-pentene, 3-m
    CC=C(/C)CC -134.8 557853 http://www.s PHYSPROP
    25311 2-butenoic acid
    CC(Cl)=C/C(= 61 558308 http://www.s PHYSPROP
    25312 3-chlorocrotonC/C(Cl)=C/C(= 61 558309 http://www.s PHYSPROP
    25313 2-propenoic acOC(=O)/C=C/c 143 558553 http://www.s PHYSPROP
    25314 sorbic acid CC=CC=CC(=O 134.5 558605 http://www.s PHYSPROP
    25315 2-pentene, 3,4CC=C(C)C(C)C -124.2 558882 http://www.s PHYSPROP
    25316 2-pentene, 3,4CC=C(C)C(C)C -113.4 558882 http://www.s PHYSPROP
    25317 1,3-pentadiene
    C=CC=C/C -140.8 558883 http://www.s PHYSPROP
    25318 2,4-hexadieneCC=C/C=C/C -96.1 558884 http://www.s PHYSPROP
    25319 2-butene-1,4-dOCC=C/CO 4 558888 http://www.s PHYSPROP
    25320 1,2-dichloroetCl[C@H]=CCl -80 558928 http://www.s PHYSPROP
    25321 2-hexene (z) CCC/C=CC -141.1 558930 http://www.s PHYSPROP
    25322 trans-3-methyCC=C(C)CC -138.5 559027 http://www.s PHYSPROP
    25323 n2,o-diacetylaCC(=O)NC2=N 204 567612 http://www.s PHYSPROP
    25324 propylthiouracS=C1NC(CCC) 220 571424 http://www.s PHYSPROP
    25325 protionamide CCCc1cc(ccn1 136.7 579891 http://www.s PHYSPROP
    25326 chlorprothixe CN(C)CCC=C1c3 97.5 580849 http://www.s PHYSPROP
    25327 physostigmin CNC(=O)Oc1cc 105.5 580875 http://www.s PHYSPROP
    25328 thiobarbital O=C1NC(=S)NC 180 580885 http://www.s PHYSPROP
    25329 2-cyano-3-pheO=C(OCC)C(=C 51 581455 http://www.s PHYSPROP
    25330 1,2-dichloro-1ClC(=C(Cl)c1c 143.5 581495 http://www.s PHYSPROP
    25331 benzenecarbotS=C(Nc1ccccc1 102 581525 http://www.s PHYSPROP
    25332 mycophenolicO=C(O)CCC(/C 141 584320 http://www.s PHYSPROP
    25333 4-chloro-3,5- Cc1nnc(C)c1Cl 117.5 586574 http://www.s PHYSPROP
    25334 n-phenylthiouS=C(N)Nc1ccc 154 589165 http://www.s PHYSPROP
    25335 m-nitrocinnamO=[N+]([O-])c 179 598732 http://www.s PHYSPROP
    25336 1,3-di-p-tolyl S=C(Nc1ccc(C) 183 599516 http://www.s PHYSPROP
    25337 2,4-dichlorociClc1cc(Cl)ccc 234 599520 http://www.s PHYSPROP
    25338 thiourea, n,n' S=C(Nc1ccccc 158 599522 http://www.s PHYSPROP
    25339 zeatin CC(CO)=CCNc1 207.5 600017 http://www.s PHYSPROP
    25340 2-mercaptobeSc1nc2ccccc2 181 608157 http://www.s PHYSPROP
    25341 benzylidenephO=C3O/C(=C/c 100.5 610569 http://www.s PHYSPROP
    25342 alpha-(phenylOC(=O)C(=C/c1 172.5 610579 http://www.s PHYSPROP
    25343 thiocarbanilidS=C(Nc1ccccc 154.5 610932 http://www.s PHYSPROP
    25344 o-phenylenethSc1nc2ccccc2 298 616466 http://www.s PHYSPROP
    25345 pyrantel CN2CCCN=C2/ 178.5 618121 http://www.s PHYSPROP
    25346 cinnamic acid COc1cc(ccc1O 182 626174 http://www.s PHYSPROP
    25347 2(3h)-benzothCCOc1ccc2NC( 199 627838 http://www.s PHYSPROP
    25348 2-propenoic acFC(F)(F)c1ccc 136 627944 http://www.s PHYSPROP
    25349 2-(trifluoromeFC(F)(F)c1ccc 206 628106 http://www.s PHYSPROP
    25350 urea, 1-(o-meCOc1ccccc1NC 156 630947 http://www.s PHYSPROP
    25351 hydrazinecarbS=C(Nc1ccccc 139 638258 http://www.s PHYSPROP
    25352 2-propenoic acCOc1ccccc1/C 95 641429 http://www.s PHYSPROP x wrong isomer JCB
    25353 3,4,5-trimeth COc1c(cc(cc1 127 642910 http://www.s PHYSPROP
    25354 4-chloro-3-nitO=[N+]([O-])c 83 642951 http://www.s PHYSPROP
    25355 cinnamic acid,Fc1ccccc1/C= 179 642987 http://www.s PHYSPROP
    25356 cinnamic acid,O=[N+]([O-])c 244 643069 http://www.s PHYSPROP
    25357 3-buten-2-one,
    O=C(C)/C=C/c 39.5 643086 http://www.s PHYSPROP
    25358 5-pyrimidinecaO=C1NC(=S)N 252 643098 http://www.s PHYSPROP
    25359 n-1-napthylthNC(=S)Nc2ccc 198 643492 http://www.s PHYSPROP
    25360 2-propenoic acOC(=O)/C=C/c 225 643824 http://www.s PHYSPROP
    25361 1-(o-chlorophClc1ccccc1NC 146 644204 http://www.s PHYSPROP
    25362 2-propenoic aBrc1ccc(/C=C/ 263 644222 http://www.s PHYSPROP
    25363 m-bromocinnaBrc1cc(/C=C/C 178 678734 http://www.s PHYSPROP
    25364 thioacetanilidS=C(C)Nc1ccc 77.5 717112 http://www.s PHYSPROP
    25365 3,4,5-trifluor Fc1cc(cc(F)c1 98 745581 http://www.s PHYSPROP
    25366 2-fluoro-4-chlClc1cc(F)c(NC 48.5 745600 http://www.s PHYSPROP x clearly out of range JCB
    25367 methyl (4-chloO=S(=O)(CC(=O 85 758458 http://www.s PHYSPROP
    25368 5-chloro-naphO=C(O)c2cccc 245 816005 http://www.s PHYSPROP
    25369 curcumin Oc1ccc(cc1OC 183 839564 http://www.s PHYSPROP
    25370 2-mercaptoimSc1nccn1 229.5 1013196 http://www.s PHYSPROP
    25371 2(3h)-thiazoleCc1csc(S)n1 89.3 1013221 http://www.s PHYSPROP
    25372 4-thiazolidinoS=C1NC(=O)C 170 1013337 http://www.s PHYSPROP
    25373 1,1'-(1-methy C/C(=C/c1cccc 82 1030040 http://www.s PHYSPROP
    25374 2-thio-6-azat S=C1NC(=O)C 218.5 1061203 http://www.s PHYSPROP
    25375 2-propenoic acO=[N+]([O-])c 139 1064731 http://www.s PHYSPROP
    25376 penicillic acid OC(=O)C=C(/O 83 1064791 http://www.s PHYSPROP
    25377 1,4-pentadien-O=C(/C=C/c1c 60.5 1064905 http://www.s PHYSPROP
    25378 4-imidazolidinS=C1NC(=O)C 230 1069421 http://www.s PHYSPROP
    25379 1-(3-methyl),2Cc1cccc(c1)C( 211 1070837 http://www.s PHYSPROP
    25380 methimazole S=C1NC=CN1C 146 1131173 http://www.s PHYSPROP
    25381 acetic acid, ( O=C(OCC)COc2 56.5 1223958 http://www.s PHYSPROP
    25382 sulindac CS(=O)c1ccc(c 183 1265914 http://www.s PHYSPROP
    25383 6-nonenamideOc1ccc(cc1OC 65 1265957 http://www.s PHYSPROP
    25384 anethole (tranCOc1ccc(/C=C 21.35 1266027 http://www.s PHYSPROP
    25385 coniferyl alco Oc1ccc(cc1OC 74 1266063 http://www.s PHYSPROP
    25386 2-propenoic aNc1ccc(/C=C/ 121.5 1266391 http://www.s PHYSPROP
    25387 allylthiourea NC(=S)NCC=C 78 1266393 http://www.s PHYSPROP
    25388 2-propenal, 3-O=CC=Cc1ccc 54 1266397 http://www.s PHYSPROP
    25389 3-(o-methoxypCOc2ccccc2C= 158 1266427 http://www.s PHYSPROP
    25390 cyclovalone Oc1ccc(cc1OC 178.5 1266900 http://www.s PHYSPROP
    25391 2,6-dibenzyli O=C2C(CCCC2= 117.5 1266977 http://www.s PHYSPROP
    25392 3-phenyl-2-prN#CC=Cc1cccc 22 1267328 http://www.s PHYSPROP
    25393 idrocilamide OCCNC(=O)/C= 101 1267352 http://www.s PHYSPROP
    25394 hexyl cinnamiO=CC(/CCCCCC 39.2 1267362 http://www.s PHYSPROP
    25395 3-phenylprop-O=C(/C=C/c1c 44 1267366 http://www.s PHYSPROP
    25396 cinnamic acid,FC(=C/c1cccc 157.5 1267384 http://www.s PHYSPROP
    25397 (1,4-diphenyl C(C=C/c1ccccc 152 1267739 http://www.s PHYSPROP
    25398 4,4-dimethyl- CC(C)(C)C(=O) 43 1302769 http://www.s PHYSPROP
    25399 heptanal, 2-( O=CC(CCCCC)= 80 1361549 http://www.s PHYSPROP
    25400 codlemone CC=CC=CCCCC 32 1403270 http://www.s PHYSPROP
    25401 ethanedithioam
    S=C(NCCO)C( 93.35 1463825 http://www.s PHYSPROP
    25402 1h-azepine, h O=C(COC(=O)c 107.5 1760721 http://www.s PHYSPROP
    25403 acetamide, 2-(CC(C)(C)NC(= 112.5 1875930 http://www.s PHYSPROP
    25404 1-acetyl-2-thi CC(=O)NC(N)= 165 2005797 http://www.s PHYSPROP
    25405 n,n-dibutylthi CCCCNC(=S)N 64 2005824 http://www.s PHYSPROP
    25406 thiobarbituricO=C1CC(=O)N 235 2005830 http://www.s PHYSPROP
    25407 n,n-dimethylt CNC(=S)NC 62 2005833 http://www.s PHYSPROP
    25408 ethylenethiouS=C1NCCN1 203 2005851 http://www.s PHYSPROP
    25409 2(1h)-pyridin S=C1C=CC=CN 129 2005897 http://www.s PHYSPROP
    25410 2-mercaptothiS=C1NCCS1 106 2005898 http://www.s PHYSPROP
    25411 n-methylthiouNC(=S)NC 120 2005903 http://www.s PHYSPROP
    25412 n,n'-trimethy S=C1NCCCN1 211 2005976 http://www.s PHYSPROP
    25413 thiosemicarbaNC(=S)NN 183 2005980 http://www.s PHYSPROP
    25414 thiourea NC(N)=S 182 2005981 http://www.s PHYSPROP
    25415 sulfonium, tri CS(C)(C)I 217.5 2005985 http://www.s PHYSPROP
    25416 thioacetamid CC(N)=S 115.5 2006126 http://www.s PHYSPROP
    25417 guanylthioureN=C(N)NC(N)= 172 2006692 http://www.s PHYSPROP
    25418 boronic acid, OB(O)c1ccccc 166.5 2015070 http://www.s PHYSPROP
    25419 2,3,5-trifluor Fc1cc(F)cc(O) 29 2015113 http://www.s PHYSPROP
    25420 tamoxifen CN(C)CCOc1ccc 97 2015313 http://www.s PHYSPROP
    25421 3-bromo-6-met
    Nc1cc(Br)ccc1 33 2016549 http://www.s PHYSPROP
    25422 chlorthiamid S=C(N)c1c(Cl) 151.5 2016563 http://www.s PHYSPROP
    25423 n,n-diethylthi CCNC(=S)NCC 78 2016737 http://www.s PHYSPROP
    25424 thiourea, n-(2OCCNC(S)=NC 78 2016968 http://www.s PHYSPROP
    25425 1-methyl-3-beCNC(=S)NCc1c 75 2017176 http://www.s PHYSPROP
    25426 3-hydroxythioOc1cc(S)ccc1 16.5 2018271 http://www.s PHYSPROP
    25427 ethionamide CCc1cc(ccn1)C 163 2041901 http://www.s PHYSPROP
    25428 butyl silane CCCC[SiH3] -138 2049872 http://www.s PHYSPROP
    25429 mucochloric aO=CC(Cl)=C(Cl 127 2052308 http://www.s PHYSPROP
    25430 difluoroiodo FC(F)I -122 2055525 http://www.s PHYSPROP
    25431 4-nhac-2266-t[O-]N1C(CC(NC 145 2056203 http://www.s PHYSPROP
    25432 perfluorotetr FC(F)(C(F)(F)C( 189 2056687 http://www.s PHYSPROP
    25433 1-propene, 1,2Cl/C(F)=C(/Cl) -137 2062482 http://www.s PHYSPROP
    25434 thiourea, (2-mS=C(N)Nc1ccc 162 2067367 http://www.s PHYSPROP
    25435 sulfatolamide Nc1ccc(cc1)S( 179 2272143 http://www.s PHYSPROP
    25436 sulfathiourea Nc1ccc(cc1)S( 182 2272143 http://www.s PHYSPROP
    25437 rhynchophylli O=C(OC)C(=C 216 2272190 http://www.s PHYSPROP
    25438 zantac (raniti [O-][N+](=O) 69.5 2272523 http://www.s PHYSPROP x salt - AL
    25439 fusidic acid O=C(O)C(CCC 192.5 2272544 http://www.s PHYSPROP
    25440 tiocarlide CC(C)CCOc1cc 146 2272774 http://www.s PHYSPROP
    25441 2-azacyclohepS=C1CCCCCN1 108.5 2274139 http://www.s PHYSPROP
    25442 thioformamidNC=S 26.5 2275727 http://www.s PHYSPROP
    25443 cortisone OCC(=O)[C@@ 222 2280529 http://www.s PHYSPROP
    25444 o-acetylacycloCC(=O)OCCOC 242 2280639 http://www.s PHYSPROP
    25445 tetradecanoic CCCCCCCCCCC 20.5 2283665 http://www.s PHYSPROP
    25446 4,5-dichloro- O=C2OC(=O)c1 121 2284619 http://www.s PHYSPROP
    25447 1-hexyl-4-car O=C(O)C1CC( 42.5 2296653 http://www.s PHYSPROP
    25448 thiamylal O=C1NC(=S)NC 132.5 2297298 http://www.s PHYSPROP
    25449 glycine, n,n'- O=C(O)CN=C(/ 220.5 2297300 http://www.s PHYSPROP
    25450 barbituric,2-t O=C1NC(=S)NC 160.5 2297301 http://www.s PHYSPROP
    25451 thialbarbital O=C2NC(=S)N 149 2297316 http://www.s PHYSPROP
    25452 1,2-dichloro-1Cl/C(F)=C(/Cl) -130.5 2297331 http://www.s PHYSPROP
    25453 n-ethylthiour NC(=S)NCC 112 2297335 http://www.s PHYSPROP
    25454 o-ethyl thioc NC(=S)OCC 41 2297336 http://www.s PHYSPROP
    25455 thiobutabarbitO=C1NC(=S)NC 169 2297366 http://www.s PHYSPROP
    25456 1,2,3,4,5,6-h Cl/C(C(Cl)CCl) 58.5 2297396 http://www.s PHYSPROP
    25457 hydantoin, 5,5S=C1NC(=S)C(N 263 2297402 http://www.s PHYSPROP
    25458 2-butene, 2,3-ClC(=C(/Cl)C(F -67.3 2297407 http://www.s PHYSPROP
    25459 phosphamidoO=P(OC)(OC)O -45 2297538 http://www.s PHYSPROP
    25460 timiperone Fc1ccc(cc1)C 202 2297930 http://www.s PHYSPROP
    25461 fenchlorazole-ClC(Cl)(Cl)c2 110 2298445 http://www.s PHYSPROP
    25462 n-(1,2-diphen O=C(NC(Cc1cc 159 2298538 http://www.s PHYSPROP
    25463 loflucarban Clc2cc(NC(=S) 163.5 2298550 http://www.s PHYSPROP
    25464 urea, 1,3-bis( S=C(Nc2cccc1 207.5 2298558 http://www.s PHYSPROP
    25465 octafluoro-2- FC(=C(/F)C(F)( -129 2298630 http://www.s PHYSPROP
    25466 nitenpyram Clc1ccc(CN(CC 82 2298774 http://www.s PHYSPROP
    25467 nitenpyram Clc1ccc(CN(CC 83.5 2298774 http://www.s PHYSPROP
    25468 oxymetholoneO=C3CC4CCC2C 187.5 2298779 http://www.s PHYSPROP
    25469 benazolin-ethO=C(OCC)CN2c 79.2 2298829 http://www.s PHYSPROP
    25470 diafenthiuronCC(C)(C)NC(=S 146 2298854 http://www.s PHYSPROP
    25471 1-piperidinyloxCC1(CC(CC(N1 102.5 2298888 http://www.s PHYSPROP
    25472 chloromethiu Clc1cc(C)c(NC 175 2298907 http://www.s PHYSPROP
    25473 goitrin S=C1NCC(C=C 50 2299106 http://www.s PHYSPROP
    25474 dimethyl arsi C[As]C -136.1 2299205 http://www.s PHYSPROP x metal - AL
    25475 trans-mevinp COP(=O)(OC)O 5.9 2299473 http://www.s PHYSPROP
    25476 quinidine COc1cc2c(cc1 174 2300697 http://www.s PHYSPROP
    25477 thiamine disulNc2nc(C)ncc2 177 2301699 http://www.s PHYSPROP
    25478 procymate NC(=O)OC(CC 128.5 2312494 http://www.s PHYSPROP
    25479 pyrinoline OC(C=1C=C/C(C 147 2314542 http://www.s PHYSPROP
    25480 1-hexyl-4-metO=C(OC)C1CC 4 2316225 http://www.s PHYSPROP
    25481 fentrazamide O=C(N(CC)C1C 79 2338981 http://www.s PHYSPROP
    25482 isopropazol Cn2nc(c1cc(C( 80 2340732 http://www.s PHYSPROP
    25483 2-bromo-1-chlBrCC(Cl)(F)F -76 2340753 http://www.s PHYSPROP
    25484 1-nonanol, 9-cClCCCCCCCCC 28 2341963 http://www.s PHYSPROP
    25485 salinomycin O=C(O)[C@H] 113 2342058 http://www.s PHYSPROP
    25486 propanoic acidCC(C)(OC1CCC 75 2342976 http://www.s PHYSPROP
    25487 1h-benzotriazNC(=O)C(C)(C 187 2505663 http://www.s PHYSPROP
    25488 lactulose OCC(=O)C(O)C 169 2527472 http://www.s PHYSPROP
    25489 bas 480f Fc1ccc(cc1)C4 136.2 2564795 http://www.s PHYSPROP
    25490 algestone aceCC(=O)C53OC( 150.5 2575526 http://www.s PHYSPROP
    25491 19-norpregna-1
    Oc2cc3CCC1C4 280 2621342 http://www.s PHYSPROP
    25492 9,10-anthracen
    [O-][N+](=O)c 296 2623724 http://www.s PHYSPROP
    25493 quinoline, 5,7 Fc1ccc(cc1)Oc 106.7 2635909 http://www.s PHYSPROP
    25494 phenol, 4-amiO=[N+]([O-])c 126 2661194 http://www.s PHYSPROP
    25495 poly((6-((1,1, CC1(C)CC(CC(C 138 2689046 http://www.s PHYSPROP
    25496 1,2-dihydroxyOc1ccc(cc1O)[ 175 2745027 http://www.s PHYSPROP
    25497 nitrogen dioxiO=[N+]=O -9.3 2844644 http://www.s PHYSPROP
    25498 p-xenylcarbimO=C=Nc1ccc(c 56 2847659 http://www.s PHYSPROP
    25499 2-amino-4-nitNc1cc(ccc1O)[ 144 2848685 http://www.s PHYSPROP
    25500 ethoxysulfuroO=C(Nc1nc(cc 145 2858750 http://www.s PHYSPROP
    25501 1h-benzotriazoO=C(O)C(C)(C 181.5 2866829 http://www.s PHYSPROP
    25502 glucovanillin O=Cc2ccc(OC1 189 2882053 http://www.s PHYSPROP
    25503 sumatrol C=C(C)C2Oc3c 195 2898626 http://www.s PHYSPROP
    25504 l-proline, 1-[ OC(=O)C2CCCN 149.5 2923375 http://www.s PHYSPROP
    25505 1h-benzotriazoc1cccc2c1nn 104.5 2999358 http://www.s PHYSPROP
    25506 hydrazine, (2, NNc1ccc(cc1[N 194 3001507 http://www.s PHYSPROP
    25507 1h-benzotriazNC(=O)C(CC)n 143 3004571 http://www.s PHYSPROP
    25508 benzoylhydraziO=[N+]([O-]) 124 3009396 http://www.s PHYSPROP
    25509 helicin O=Cc2ccccc2 175 3016543 http://www.s PHYSPROP
    25510 sorbitan monoOC(COC(=O)C 57 3021342 http://www.s PHYSPROP
    25511 valrubicin CCCCC(=O)OCC 135.5 3021992 http://www.s PHYSPROP
    25512 2h-benzotriazoc1cccc2nn(nc 46.5 3028857 http://www.s PHYSPROP
    25513 vinblastine O=C(OC)C2(CC 213.5 3050201 http://www.s PHYSPROP
    25514 flurogestone CC(=O)C4(OC( 267.5 3055327 http://www.s PHYSPROP
    25515 viquidil C=CC3CNCCC3C 60 3057498 http://www.s PHYSPROP
    25516 p-(2,4-dinitro Oc2ccc(Nc1ccc 194 3083088 http://www.s PHYSPROP
    25517 uridine, 2',3'- O=C1NC(=O)N( 186 3084094 http://www.s PHYSPROP
    25518 3-chloro-4,6-dO=[N+]([O-])c 92 3117105 http://www.s PHYSPROP
    25519 estradiol mus ClCCN(CCCl)c 52.5 3156916 http://www.s PHYSPROP
    25520 sarmentogeniOC3CC4CCC2C5 280 3165757 http://www.s PHYSPROP
    25521 phaseolin Oc4cc5OCC1C( 177.5 3279224 http://www.s PHYSPROP
    25522 phenol, 2-amiNc1c(cccc1O)[ 216.5 3329016 http://www.s PHYSPROP
    25523 tepa, -n(-phe C/C(C)=N/N(c 120.5 3381088 http://www.s PHYSPROP
    25524 hydrazinecarbN=C(NN)N[N+] 185 3409467 http://www.s PHYSPROP
    25525 phenol, 4,4'-pOc1ccc(cc1)C( 132 3411278 http://www.s PHYSPROP
    25526 n-(2,4-dinitr [O-][N+](=O)c 188 3474806 http://www.s PHYSPROP
    25527 benzenesulfonNS(=O)(=O)c1 111.5 3476859 http://www.s PHYSPROP
    25528 4-pregnene-17OCC(O)C3(O)C 208.5 3487278 http://www.s PHYSPROP
    25529 1,4-benzenediO=[N+]([O-])c 140 3542441 http://www.s PHYSPROP
    25530 3-nitro-o-phe Nc1cccc([N+]( 158 3562738 http://www.s PHYSPROP
    25531 benzoic acid, OC(=O)c1c(Br) 150.5 3601367 http://www.s PHYSPROP
    25532 acetic acid, tr ClC(Cl)(Cl)C(= 25.5 3606249 http://www.s PHYSPROP
    25533 c.i. disperse v [O-][N+](=O)c 257 3621963 http://www.s PHYSPROP
    25534 tepa, -n(-me) C/C(C)=N/N(C 92.5 3651353 http://www.s PHYSPROP
    25535 linamarin CC(C)(OC1OC( 145 3656327 http://www.s PHYSPROP
    25536 exemestane O=C3C=C4C(=C 189.5 3659700 http://www.s PHYSPROP
    25537 2,6-dideoxy-3COC1C(O)C(C) 101 3677079 http://www.s PHYSPROP
    25538 gypsogenin O=C(O)C45CCC 275 3681302 http://www.s PHYSPROP
    25539 quillaic acid O=C(O)C35CCC 294 3681498 http://www.s PHYSPROP
    25540 tephrosin COc1cc3c(cc1 198 3682953 http://www.s PHYSPROP
    25541 hexythiazox Clc1ccc(cc1) 108.25 3753586 http://www.s PHYSPROP
    25542 terreic acid CC1=C(O)C(= 127 3755306 http://www.s PHYSPROP
    25543 clobetasol ClCC(=O)C4(O 196.25 3820970 http://www.s PHYSPROP
    25544 desogestrel C=C3CC1(CC) 109.5 3848314 http://www.s PHYSPROP
    25545 simvastatin CC(C)(CC)C(= 136.5 3866078 http://www.s PHYSPROP
    25546 benzenesulfonNS(=O)(=O)c1c 151 4028187 http://www.s PHYSPROP
    25547 2-amino-4,6-dNc1cc(cc([N+] 169 4103087 http://www.s PHYSPROP
    25548 ezetimibe Fc1ccc(cc1)C( 165 4160369 http://www.s PHYSPROP
    25549 2-amino-5-nitNc1ccc(cc1O)[ 208.5 4165030 http://www.s PHYSPROP
    25550 sucralose OC1C(OC(CO)C 130 4243140 http://www.s PHYSPROP
    25551 tabernanthineCOc4cc5nc1c( 214 4265369 http://www.s PHYSPROP
    25552 hydantoic acidS=C2NC(=O)CN 160 4266692 http://www.s PHYSPROP
    25553 2-amino-4-nitNc1ccc(cc1N)[ 199.5 4286892 http://www.s PHYSPROP
    25554 thebainone O=C3C=CC4C2C 151.5 4323111 http://www.s PHYSPROP
    25555 acetamide, 2-NC(=O)COC(=O 121 4345375 http://www.s PHYSPROP
    25556 hydrocortisonOCC(=O)C4(OC 218.5 4395301 http://www.s PHYSPROP
    25557 dimethisteronCC3CC2C(CCC1 102 4400915 http://www.s PHYSPROP
    25558 noxythiolin CNC(=S)NCO 89 4418329 http://www.s PHYSPROP
    25559 diethyl malea O=C(C=C/C(= -8.8 4436353 http://www.s PHYSPROP
    25560 dibutyl malea O=C(/C=C/C( -85 4436357 http://www.s PHYSPROP
    25561 benzyl cinnamO=C(OCc1cccc 39 4437893 http://www.s PHYSPROP
    25562 cinnamamide NC(=O)/C=C/c 149 4437896 http://www.s PHYSPROP
    25563 fraxetin COc1cc2C=CC( 231 4437972 http://www.s PHYSPROP
    25564 quercetin Oc1ccc(cc1O) 316.5 4444051 http://www.s PHYSPROP
    25565 4h-1-benzopyrCOc1ccc(cc1) 256.5 4444070 http://www.s PHYSPROP
    25566 acacetin COc1ccc(cc1) 263 4444099 http://www.s PHYSPROP
    25567 apigenin Oc1ccc(cc1)C 347.5 4444100 http://www.s PHYSPROP
    25568 scopoletin COc1cc2C=CC 204 4444113 http://www.s PHYSPROP
    25569 retinol palmit CC=1CCCC(C)( 28.5 4444162 http://www.s PHYSPROP
    25570 4-hydroxy-3- Oc1ccc(cc1OC 84 4444167 http://www.s PHYSPROP
    25571 7-hydroxy-4- Oc1ccc2c(c1) 195.5 4444190 http://www.s PHYSPROP
    25572 daphnetin Oc1ccc2C=CC 262 4444191 http://www.s PHYSPROP
    25573 methyl oleateO=C(CCCCCCC -19.9 4444205 http://www.s PHYSPROP
    25574 cyclosporin a CC(CC=CC)C(O 149.5 4444325 http://www.s PHYSPROP
    25575 kaempferol Oc1ccc(cc1)C 277 4444395 http://www.s PHYSPROP
    25576 3-dehydroretiCC=1C=CCC(C) 77.5 4444397 http://www.s PHYSPROP
    25577 9h-pyrido[3,4 COc1ccc3c(c1 273 4444445 http://www.s PHYSPROP
    25578 1,3-dichloroprClC=C/CCl -50 4444456 http://www.s PHYSPROP
    25579 mycophenolate
    Oc3c1C(=O)OC 93.5 4444535 http://www.s PHYSPROP
    25580 cicutoxin CCCC(O)C=CC 54 4444576 http://www.s PHYSPROP
    25581 harmane Cc2nccc1c3cc 236.5 4444755 http://www.s PHYSPROP
    25582 esculetin Oc1cc2C=CC( 276 4444764 http://www.s PHYSPROP
    25583 umbelliferoneOc1ccc2C=CC( 230.5 4444774 http://www.s PHYSPROP
    25584 yangonin COC=2C=C(/C= 156 4444896 http://www.s PHYSPROP
    25585 5,7-hydroxyfl Oc2cc(O)cc1O 285.5 4444926 http://www.s PHYSPROP
    25586 diosmetine COc1ccc(cc1O 253.5 4444931 http://www.s PHYSPROP
    25587 fisetin Oc1ccc(cc1O) 330 4444933 http://www.s PHYSPROP
    25588 galangin Oc2cc(O)cc1O 214.5 4444935 http://www.s PHYSPROP
    25589 gentisin Oc3cc(OC)cc2 266.5 4444955 http://www.s PHYSPROP
    25590 morin Oc3ccc(C=2Oc 303.5 4444989 http://www.s PHYSPROP
    25591 myricetin Oc1cc(cc(O)c 357 4444991 http://www.s PHYSPROP
    25592 rhammnetin Oc1ccc(cc1O) 295 4445008 http://www.s PHYSPROP
    25593 trans-asaroneCOc1cc(OC)c( 62.5 4445072 http://www.s PHYSPROP
    25594 prunetin Oc1ccc(cc1)C 239.5 4445116 http://www.s PHYSPROP
    25595 rottlerin CC(=O)c4c(O)c 212 4445144 http://www.s PHYSPROP
    25596 bifenthrin ClC(=C/C3C(C( 69 4445165 http://www.s PHYSPROP
    25597 lambda-cyhaloClC(=C/C3C(C( 49.2 4445166 http://www.s PHYSPROP
    25598 tefluthrin ClC(=C/C2C(C( 44.6 4445167 http://www.s PHYSPROP
    25599 hydramethylnCC3(C)CNC(=NN 190 4445168 http://www.s PHYSPROP
    25600 4h-1-benzopyrOc1ccc2c(c1) 246 4445181 http://www.s PHYSPROP
    25601 tranilast COc1cc(ccc1O 212 4445411 http://www.s PHYSPROP
    25602 dolsulepine CN(C)CCC=C1/ 56 4445580 http://www.s PHYSPROP
    25603 tripolidine Cc1ccc(cc1)C 60 4445597 http://www.s PHYSPROP
    25604 2-hexenoic acCCCC=CC(=O) 36.5 4445834 http://www.s PHYSPROP
    25605 3-hexenoic acCCC=CCC(=O) 12 4445835 http://www.s PHYSPROP
    25606 hept-2-enoic CCCCC=CC(=O -19 4445836 http://www.s PHYSPROP
    25607 dec-2-enoic acO=C(O)C=CCC 12 4445851 http://www.s PHYSPROP
    25608 dec-3-enoic acO=C(O)CC=CC 18 4445852 http://www.s PHYSPROP
    25609 dodec-2-enoicO=C(O)C=CCC 17.1 4445856 http://www.s PHYSPROP
    25610 palmitoleic acO=C(O)CCCCC -0.1 4445872 http://www.s PHYSPROP
    25611 9-hexadecenoiO=C(O)CCCCC 0.5 4445872 http://www.s PHYSPROP
    25612 petroselinic a O=C(O)CCCC/ 29.8 4445881 http://www.s PHYSPROP
    25613 vaccenic acid O=C(O)CCCCC 44 4445885 http://www.s PHYSPROP
    25614 13-docosenoicO=C(O)CCCCC 33.8 4445899 http://www.s PHYSPROP
    25615 deca-2,4-dienoO=C(O)C=CC= 49.5 4445909 http://www.s PHYSPROP
    25616 linoleic acid O=C(O)CCCCC -8.5 4445923 http://www.s PHYSPROP
    25617 octadeca-9,11,O=C(O)CCCCC 71.5 4445947 http://www.s PHYSPROP
    25618 9,12,15-octadec
    O=C(O)CCCCC -16.5 4445949 http://www.s PHYSPROP
    25619 12-hydroxy-9-o
    CCCCCCC(O)C 5.5 4446070 http://www.s PHYSPROP
    25620 traumatic acidO=C(O)CCCCC 165.5 4446155 http://www.s PHYSPROP
    25621 2,4-heptadiena
    CCC=CC=CC=O 84.5 4446442 http://www.s PHYSPROP
    25622 2,4,6-octatrie CC=CC=CC=CC 56.8 4446452 http://www.s PHYSPROP
    25623 1-propene, 1-cCC=CCl -134.8 4447442 http://www.s PHYSPROP
    25624 1-propene, 1-cCC=CCl -99 4447442 http://www.s PHYSPROP
    25625 cinnamyl anthNc2ccccc2C(= 61 4447445 http://www.s PHYSPROP
    25626 methyl linoleaO=C(CCCCCCC -35 4447491 http://www.s PHYSPROP
    25627 tetrachlorvinpClc1cc(C(=CCl 96 4447527 http://www.s PHYSPROP
    25628 stirofos Clc1cc(C(=CCl 97.5 4447527 http://www.s PHYSPROP
    25629 2,4,6,8-nonateCc1c(C)c(/C= 229 4447573 http://www.s PHYSPROP
    25630 nalmefene C=C1CC[C@@] 107.5 4447642 http://www.s PHYSPROP
    25631 cis-2-butene CC=C/C -138.9 4449912 http://www.s PHYSPROP
    25632 acipimox [O-][n+]1cc(n 178.5 4470534 http://www.s PHYSPROP
    25633 5,8,11,14-eicoO=C(O)CCCC= -49.5 4471967 http://www.s PHYSPROP
    25634 eicosa-5,8,11,O=C(O)CCCC= -49.5 4471967 http://www.s PHYSPROP
    25635 beta-bromostBrC=Cc1ccccc 7 4473543 http://www.s PHYSPROP
    25636 chondrillasterCC(C)C(CC)/C 168.5 4474578 http://www.s PHYSPROP
    25637 vitamin d2 C=C3CCC(O)CC 116.5 4474626 http://www.s PHYSPROP
    25638 9-cycloheptadO=C1CCCCCCC 32.5 4475121 http://www.s PHYSPROP
    25639 cocaine CN3C1CCC3C(C 98 4475153 http://www.s PHYSPROP
    25640 cinnamic acid Oc1cc(C=C/C( 211.5 4475249 http://www.s PHYSPROP
    25641 6,7-dihydroxyOc1cc2c(cc1O 275 4477791 http://www.s PHYSPROP
    25642 lumisterol CC(C)C(C)/C= 118 4477828 http://www.s PHYSPROP
    25643 ergosterol CC(C)C(C)/C= 170 4477828 http://www.s PHYSPROP
    25644 pectolinarigenCOc1ccc(cc1) 221 4478521 http://www.s PHYSPROP
    25645 sulfuretin Oc1ccc(cc1O) 303 4479262 http://www.s PHYSPROP
    25646 2,4-hexadienoiCC=CC=CC(=O 15 4481192 http://www.s PHYSPROP
    25647 2,4-hexadienoiCC=CC=CC(=O 15 4481192 http://www.s PHYSPROP
    25648 furazolidone [O-][N+](=O) 255 4481255 http://www.s PHYSPROP
    25649 2-butanone o C/C(CC)=NO -29.5 4481809 http://www.s PHYSPROP
    25650 butanal, oxim CCCC=NO -29.5 4481812 http://www.s PHYSPROP
    25651 acetaldehyde CC=NO 45 4481813 http://www.s PHYSPROP
    25652 propionaldeh CCC=NO 40 4481995 http://www.s PHYSPROP
    25653 benzaldoximeON=Cc1ccccc1 35 4482130 http://www.s PHYSPROP
    25654 benzaldehyde,ON=Cc1ccccc1 36.5 4482130 http://www.s PHYSPROP
    25655 3-hexenedinitrN#CCC=CCC# 76 4482226 http://www.s PHYSPROP
    25656 2-furanacrylonN#CC=Cc1ccc 38 4482635 http://www.s PHYSPROP
    25657 2-pentene, 4,4CC=CC(C)(C)C -135.4 4483636 http://www.s PHYSPROP
    25658 4,4-dimethyl- CC=CC(C)(C)C -115.2 4483636 http://www.s PHYSPROP
    25659 cis-2-penteneCC=CCC -151.4 4483639 http://www.s PHYSPROP
    25660 trans-2-penteCC=CCC -140.2 4483639 http://www.s PHYSPROP
    25661 nifuroxazide O=[N+]([O-])c 298 4495115 http://www.s PHYSPROP
    25662 chartreusin OC7C(OC)C(O) 185 4508202 http://www.s PHYSPROP
    25663 pyrocalciferol CC(C)C(C)/C= 94 4508237 http://www.s PHYSPROP
    25664 robinin OC6C(O)C(O)C 250 4508978 http://www.s PHYSPROP
    25665 tuberin COc1ccc(/C=C 132.5 4508984 http://www.s PHYSPROP
    25666 cerulenin NC(=O)C1OC1 93.5 4508994 http://www.s PHYSPROP
    25667 3-hexene, 2-me
    CCC=CC(C)C -141.6 4509420 http://www.s PHYSPROP
    25668 prostaglandinOC1CC(O)C(/C 30 4510139 http://www.s PHYSPROP
    25669 prostaglandinOC1CC(=O)C(C 67 4510140 http://www.s PHYSPROP
    25670 fumagillin CC1(OC1CC=C 194.5 4510162 http://www.s PHYSPROP
    25671 josamycin CC(C)CC(=O)O 131.5 4510187 http://www.s PHYSPROP
    25672 morantel Cc2ccsc2/C= 240 4510219 http://www.s PHYSPROP
    25673 quercitrin Oc1ccc(cc1O) 170 4510257 http://www.s PHYSPROP
    25674 sphingosine NC(CO)C(O)C 67 4510275 http://www.s PHYSPROP
    25675 benzoin oxim OC(C(=NO)c1c 151 4510333 http://www.s PHYSPROP
    25676 benzene, (1-me
    C/C(=CC)c1ccc -23.5 4510361 http://www.s PHYSPROP
    25677 4-nitrocinna O=[N+]([O-])c 141.5 4510371 http://www.s PHYSPROP
    25678 heptanal, oxi CCCCCCC=NO 57.5 4510399 http://www.s PHYSPROP
    25679 methyl-3-methOc1ccc(cc1OC 129 4510464 http://www.s PHYSPROP
    25680 2-propenoyl chClC(=O)/C=C/c 36 4510481 http://www.s PHYSPROP
    25681 phenol, 2-eth CCOc1ccc(cc1 87 4510500 http://www.s PHYSPROP
    25682 ectylurea CC/C(=CC)C(= 198 4510673 http://www.s PHYSPROP
    25683 1-penten-3-onCCC(=O)/C=C/ 38.5 4510677 http://www.s PHYSPROP
    25684 1-hexen-3-oneCC(C)CC(=O)/ 43 4510678 http://www.s PHYSPROP
    25685 2-propen-1-ol,O=COCC=Cc1c 0 4510982 http://www.s PHYSPROP
    25686 lasiocarpine CC(C)(O)C(O) 95 4511280 http://www.s PHYSPROP
    25687 2-butenedioicO=C(Oc1ccccc 73 4511536 http://www.s PHYSPROP
    25688 mevinphos O=P(OC)(OC)O 13.95 4511751 http://www.s PHYSPROP
    25689 mevinphos (trO=P(OC)(OC)O 21 4511751 http://www.s PHYSPROP
    25690 1,1'-(1,2-ethe C(=Cc1ccccc1) -5 4512351 http://www.s PHYSPROP
    25691 2,4-hexadiened
    OC(=O)/C=C/C 301 4512358 http://www.s PHYSPROP
    25692 but-2-enedioicCC(C)OC(=O)/ 2.1 4512524 http://www.s PHYSPROP
    25693 cassaine CN(C)CCOC(=O 142.5 4512579 http://www.s PHYSPROP
    25694 2-hexene, 3-me
    CC=C(C)CCC -118.5 4512637 http://www.s PHYSPROP
    25695 2-hexene, 4-me
    CC=CC(C)CC -125.7 4512638 http://www.s PHYSPROP
    25696 2-hexene, 5-me
    CC(C)CC=CC -124.3 4512641 http://www.s PHYSPROP
    25697 4-octene, (z)- CCCC=CCCC -118.7 4512642 http://www.s PHYSPROP
    25698 4-octene CCCC=CCCC -90 4512642 http://www.s PHYSPROP
    25699 2-methyl-heptCCCC=CC(C)C -107.5 4512644 http://www.s PHYSPROP
    25700 3-heptene (cisCCCC=CCC -136.6 4512648 http://www.s PHYSPROP
    25701 3-heptene (tr CCCC=CCC -136.6 4512648 http://www.s PHYSPROP
    25702 3-hexene, 2,2-CCC=CC(C)(C) -137.4 4512650 http://www.s PHYSPROP
    25703 3-methyl-butyCC(C)CC=NO 48.5 4512713 http://www.s PHYSPROP
    25704 (3-bromo-pro BrCC=Cc1cccc 34 4512814 http://www.s PHYSPROP
    25705 4-undecene, (zCCCCCCC=CCC -97 4513469 http://www.s PHYSPROP
    25706 4-undecene, (CCCCCCC=CCC -63.7 4513469 http://www.s PHYSPROP
    25707 but-2-enedioi OC(=O)/C=C/C 70 4513971 http://www.s PHYSPROP
    25708 methomyl CC(=NOC(=O) 78 4514527 http://www.s PHYSPROP
    25709 butocarboximO=C(ON=C(/C) 25 4514630 http://www.s PHYSPROP
    25710 febantel O=C(OC)N/C(N 129.5 4514715 http://www.s PHYSPROP
    25711 dis. a. 18 [O-][N+](=O)c 307 4514753 http://www.s PHYSPROP
    25712 sulfur S 112 4515054 http://www.s PHYSPROP
    25713 octadeca-9,12O=C(CCCCCCC -35 4515259 http://www.s PHYSPROP
    25714 vitamin d3 C=C3CCC(O)CC 84.5 4515720 http://www.s PHYSPROP
    25715 cymoxanil N#C/C(=NOC) 160.5 4516330 http://www.s PHYSPROP
    25716 maleamic acidNC(=O)/C=C/C 172.5 4516364 http://www.s PHYSPROP
    25717 2,4-pentadiene
    C=CC=CC#N -60 4516500 http://www.s PHYSPROP
    25718 1,5,9-cyclododC1C=CCCC=CC -1.5 4516522 http://www.s PHYSPROP
    25719 2,6-octadieneCC=CCCC=CC -76 4516549 http://www.s PHYSPROP
    25720 ethyl oleate O=C(CCCCCCC -32 4516584 http://www.s PHYSPROP
    25721 octadec-9-enoiO=C(CCCCCCC 5.8 4516584 http://www.s PHYSPROP
    25722 5-undecene, (zCCCCC=CCCCC -106.5 4516600 http://www.s PHYSPROP
    25723 5-undecene, (CCCCC=CCCCC -61.1 4516600 http://www.s PHYSPROP
    25724 2-octene (cis) CCCCCC=CC -100.2 4516601 http://www.s PHYSPROP
    25725 2-octene (tranCCCCCC=CC -87.7 4516601 http://www.s PHYSPROP
    25726 2-octene CCCCCC=CC -80 4516601 http://www.s PHYSPROP
    25727 2-undecene, (zCCCCCCCCC=C -66.5 4516605 http://www.s PHYSPROP
    25728 2-undecene, (CCCCCCCCC=C -48.3 4516605 http://www.s PHYSPROP
    25729 (3-beta)-stigmCC(C)C(CC)/C 170 4516718 http://www.s PHYSPROP
    25730 9-octadecenoic
    O=C(CCCCCCC -32 4516818 http://www.s PHYSPROP
    25731 2-butene, 2-chCC=C(/C)Cl -19 4516900 http://www.s PHYSPROP
    25732 9-octadecenoic
    OCC(O)COC(= 35 4516959 http://www.s PHYSPROP
    25733 thiofanox O=C(ON=C(CSC 57 4517040 http://www.s PHYSPROP
    25734 5-hepten-3-onCC/C(=CC)C(C 74.5 4517125 http://www.s PHYSPROP
    25735 tranid ClC2C(=NOC( 143.5 4517276 http://www.s PHYSPROP
    25736 13-decosenami
    NC(=O)CCCCC 77.5 4517399 http://www.s PHYSPROP
    25737 trans-1,4-hex C=CCC=CC -138.7 4517520 http://www.s PHYSPROP
    25738 trichothecin CC=CC(=O)OC2 118 4517766 http://www.s PHYSPROP
    25739 2,6-octadiene,CC=CC(C)C(C) -64.8 4517791 http://www.s PHYSPROP
    25740 2-pentenoic acCCC=C(/C)C(= 24.4 4517851 http://www.s PHYSPROP
    25741 silane, 1,2-ethC[Si](C)(C)/C= -18.5 4518243 http://www.s PHYSPROP
    25742 1,3-hexadien-C=CC=CC#C -81 4518794 http://www.s PHYSPROP
    25743 1,3,5-cyclooctC1=CC=CC=CC -83 4518804 http://www.s PHYSPROP
    25744 1,5-cyclooctadC1C=CCC=CCC -70 4518877 http://www.s PHYSPROP
    25745 1,4-cycloocta C1C=CCC=CCC -53 4518877 http://www.s PHYSPROP
    25746 cis-1,3,5-hexaC=CC=CC=C -12 4518927 http://www.s PHYSPROP
    25747 trans-1,3,5-heC=CC=CC=C -12 4518927 http://www.s PHYSPROP
    25748 acetaldehyde,[O-][N+](=O)c 166.5 4518991 http://www.s PHYSPROP
    25749 2,4-hexadieneCC=CC=C(/C)C -74.2 4519103 http://www.s PHYSPROP
    25750 benzene, 1-nitO=[N+]([O-])c 73 4519935 http://www.s PHYSPROP
    25751 2,6-dimethyl-oCC(C)=CC=CC( -20.6 4520017 http://www.s PHYSPROP
    25752 kawain O=C2C=C(CC(/ 105.5 4520267 http://www.s PHYSPROP
    25753 chalcone, 3-niO=[N+]([O-])c 145.5 4520653 http://www.s PHYSPROP
    25754 benzoximate COc1c(c(ccc1 73 4520747 http://www.s PHYSPROP
    25755 2-ethylhexyl O=C(/C=C/C(= -10 4521171 http://www.s PHYSPROP
    25756 piperic acid O=C(O)/C=C/C 215 4521337 http://www.s PHYSPROP
    25757 benzene, 1,1'-CC(/C=C/c1ccc 47.5 4521343 http://www.s PHYSPROP
    25758 cinnamedrineOC(C(C)N(C)C/ 75 4521391 http://www.s PHYSPROP
    25759 1-butenylben CCC=Cc1ccccc -43.1 4521401 http://www.s PHYSPROP
    25760 3-butenoic aciO=C(O)CC=Cc1 87 4521404 http://www.s PHYSPROP
    25761 2,4,6-octatrienCC(C)=CC=CC( -35.4 4521739 http://www.s PHYSPROP
    25762 azodrin O=P(OC)(OC)O 55 4522049 http://www.s PHYSPROP
    25763 b-benzalbuty NC(=O)CC(/C) 133 4522265 http://www.s PHYSPROP
    25764 2-propenoic aCOc1ccc(/C=C -25 4523729 http://www.s PHYSPROP
    25765 phenol, 2-metOc1c(cccc1OC 81 4523859 http://www.s PHYSPROP
    25766 p-nitrobenzal O=[N+]([O-])c 128 4523938 http://www.s PHYSPROP
    25767 kadethrin O=C(OCc2cc(C 31 4524100 http://www.s PHYSPROP
    25768 benzene, 1,1'-ClC(=C/c1cccc 53.5 4524371 http://www.s PHYSPROP
    25769 radicinin CC=CC1=CC=2O 221.5 4524383 http://www.s PHYSPROP
    25770 1,2-(di-(a-pyr C(=C/c1ccccn1 118.5 4524483 http://www.s PHYSPROP
    25771 2-diphacetyl- NN=C2/c1cccc 242 4524653 http://www.s PHYSPROP
    25772 2,4-pentadieno
    OC1(/C=CC(C) 160 4524740 http://www.s PHYSPROP
    25773 pyrrobutaminClc3ccc(CC(= 48.5 4525194 http://www.s PHYSPROP
    25774 benzene, 1,1'-Cc2ccccc2/C= 83 4525271 http://www.s PHYSPROP
    25775 mitragynine O=C(OC)C(=CO 104 4525455 http://www.s PHYSPROP
    25776 2-propen-1-onO=[N+]([O-])c 159 4526395 http://www.s PHYSPROP
    25777 chlorfenvinphClc1cc(Cl)ccc -20 4526766 http://www.s PHYSPROP
    25778 benzo b thiopO=C3c4ccccc4 359 4527286 http://www.s PHYSPROP
    25779 rhodoxanthin O=C2C=C(C)/C 219 4528470 http://www.s PHYSPROP
    25780 quercimeritri Oc1ccc(cc1O) 248 4529331 http://www.s PHYSPROP
    25781 etozolin O=C(OCC)/C= 140 4531520 http://www.s PHYSPROP
    25782 piperonyl ace CC(=O)/C=Cc1 111 4532611 http://www.s PHYSPROP
    25783 folescutol Oc2cc3OC(=O 232 4536088 http://www.s PHYSPROP
    25784 9-eicosenoic aO=C(O)CCCCC 23 4574378 http://www.s PHYSPROP
    25785 ethene, 1-broBrC=CCl -86.7 4575447 http://www.s PHYSPROP
    25786 butyl oleate O=C(CCCCCCC -26.5 4575598 http://www.s PHYSPROP
    25787 2-methyl-1,3-C=C(C)/C=CC 75.5 4575651 http://www.s PHYSPROP
    25788 2-propenal, 3-O=[N+]([O-])c 118.5 4575718 http://www.s PHYSPROP
    25789 2,5-dimethyl- C=C(C)/C=C/C -9 4575931 http://www.s PHYSPROP
    25790 1,2-diiodoetheIC=C/I -14 4576037 http://www.s PHYSPROP
    25791 2-propenyl-phOc1ccccc1C=C -6 4576085 http://www.s PHYSPROP
    25792 irigenin Oc1cc(cc(OC) 185 4576563 http://www.s PHYSPROP
    25793 ximoprofen O=C(O)C(C)c1 178 4576581 http://www.s PHYSPROP
    25794 ethanone, 1-pON=C(/C)c1cc 60 4576915 http://www.s PHYSPROP
    25795 bas 490f O=C(OC)/C(=N 99 4588320 http://www.s PHYSPROP
    25796 benzeneaceton
    N#CC(=NOCC# 55 4588400 http://www.s PHYSPROP
    25797 akh-7088 Clc2cc(ccc2Oc 58 4590690 http://www.s PHYSPROP
    25798 estrone Oc3cc4CCC1[ 260.2 4642435 http://www.s PHYSPROP
    25799 6-phenyl-hexaCC(=O)C=CC=C 68 4647469 http://www.s PHYSPROP
    25800 benzeneacetoni
    ON=C(C#N)c1c 129 4648061 http://www.s PHYSPROP
    25801 furonazide CC(=NNC(=O)c 202.3 4655810 http://www.s PHYSPROP
    25802 oxirane, monoCCCCCCCCCC 1.7 4675429 http://www.s PHYSPROP
    25803 1-lauryl-4-me O=C(OC)C1CC 27.5 4676486 http://www.s PHYSPROP
    25804 1h-benzimidazCC(C)S(=O)(= 198.5 4678111 http://www.s PHYSPROP
    25805 tetrachlorvin Clc1cc(C(=CCl 97 4719431 http://www.s PHYSPROP
    25806 dimethomorpO=C(C=C(/c1c 148 4735560 http://www.s PHYSPROP
    25807 1,7,7-trimeth CC2(C)C1C/C( 118 4743055 http://www.s PHYSPROP
    25808 docos-13-en-1CCCCCCCCC=C 35 4744195 http://www.s PHYSPROP
    25809 piprozolin O=C(OCC)/C= 86.5 4744588 http://www.s PHYSPROP
    25810 2-chloro-2-butCC=C(/Cl)C(= 99.8 4748060 http://www.s PHYSPROP
    25811 metochalconeCOc2cc(ccc2C 97 4795331 http://www.s PHYSPROP
    25812 diniconazole OC(/C(=C/c1cc 145 4802970 http://www.s PHYSPROP
    25813 octadec-9-enoO=C(Nc1cccc 41 4811262 http://www.s PHYSPROP
    25814 cis-9-octadec CCCCCCCCC=C 25 4864652 http://www.s PHYSPROP
    25815 diallate ClC=C(Cl)CSC( 25 4874545 http://www.s PHYSPROP
    25816 motretinide Cc1c(C)c(/C= 179.5 4880635 http://www.s PHYSPROP
    25817 plicamycin C[C@@H](O)[C 181.5 4885486 http://www.s PHYSPROP
    25818 dimestrol COc1ccc(cc1)C 124 4899193 http://www.s PHYSPROP
    25819 hydroxyiminoCC(=O)/C=N/ 69 4911438 http://www.s PHYSPROP
    25820 2,3-butanedi CC(=O)C(C)=N 76.8 4917792 http://www.s PHYSPROP
    25821 pyraclostrobi O=C(OC)N(OC) 64.45 4928348 http://www.s PHYSPROP
    25822 angelica lactoO=C1C=COC1 18 4934683 http://www.s PHYSPROP
    25823 1,4-dichloro-2ClCC=C/CCl -48 4937374 http://www.s PHYSPROP
    25824 octane-2,3-di CCCCCC(=NO) 59 4937810 http://www.s PHYSPROP
    25825 4-chlorocrotonClCC=CC(=O)O 83 4938755 http://www.s PHYSPROP
    25826 cinmetacin O=C(O)Cc2c1c 170 4938825 http://www.s PHYSPROP
    25827 cinepazet COc1cc(cc(OC 96 4939323 http://www.s PHYSPROP
    25828 2-pyridinemeth
    O=[N+]([O-])c 170.5 4940737 http://www.s PHYSPROP
    25829 p-fluorobenzaFc1ccc(C=NO) 83.5 4940754 http://www.s PHYSPROP
    25830 azanidazole Cn2c(cnc2/C=C 233.5 4940835 http://www.s PHYSPROP
    25831 enanthotoxin CCCC(O)CCC= 87 4941097 http://www.s PHYSPROP
    25832 uniconazole-pOC(C(=C/c1ccc 153 4941231 http://www.s PHYSPROP
    25833 uniconazole OC(C(=C/c1ccc 153 4941231 http://www.s PHYSPROP
    25834 diniconazole OC(C(=C/c1ccc 148.5 4941232 http://www.s PHYSPROP
    25835 rhodopin CC(C)(O)CCCC 171 4941472 http://www.s PHYSPROP
    25836 undec-9-en-1-CC=CCCCCCCC 6 4941474 http://www.s PHYSPROP
    25837 astaxanthin CC2(C)CC(O)C 182.5 4942184 http://www.s PHYSPROP
    25838 2,4-pentadiena
    O=CC=CC=Cc1 42.5 4942342 http://www.s PHYSPROP
    25839 chlorofumaronN#CC=C(Cl)C# 60.5 4945182 http://www.s PHYSPROP
    25840 cyclosulfamurO=C(Nc1nc(cc 161.9 4953619 http://www.s PHYSPROP
    25841 pyrimidifen Clc2c(NCCOc1 70 4953620 http://www.s PHYSPROP
    25842 nifuroxime O=[N+]([O-]) 163 4979197 http://www.s PHYSPROP
    25843 acetamide, 2, ClC(Cl)C(=O) 138 4982688 http://www.s PHYSPROP
    25844 benzamide, n-(O=C(Nc1ccc2n 212 4982689 http://www.s PHYSPROP
    25845 benzamide, 3,Clc1ccc(cc1C 191 4982690 http://www.s PHYSPROP
    25846 benzamide, n-(COc1cc(cc(OC 130.5 4982691 http://www.s PHYSPROP
    25847 benzamide, n-([O-][N+](=O) 236.5 4982692 http://www.s PHYSPROP
    25848 acetamide, 2-ClCC(=O)Nc1c 176.5 4982693 http://www.s PHYSPROP
    25849 carbamic acid,O=C(OCC)Nc1c 148 4982694 http://www.s PHYSPROP
    25850 benzamide, n-O=C(Nc1ccc2n 165.5 4982695 http://www.s PHYSPROP
    25851 benzamide, 4-Clc1ccc(cc1)C 229 4982696 http://www.s PHYSPROP
    25852 benzamide, n-[O-][N+](=O)c 280 4982697 http://www.s PHYSPROP
    25853 benzamide, n-COc1cc(cc(OC 113 4982698 http://www.s PHYSPROP
    25854 n-ethylidene- CC=NNc1cccc 99.5 5020586 http://www.s PHYSPROP
    25855 cicrotoic acid CC(=C/C(=O)O 85.5 5020605 http://www.s PHYSPROP
    25856 9-octadeceneni
    CCCCCCCCC=C -1 5020782 http://www.s PHYSPROP
    25857 triticonazole Clc1ccc(cc1)C 140 5020874 http://www.s PHYSPROP
    25858 flucycloxuron Fc1cccc(F)c1C 143.6 5020876 http://www.s PHYSPROP
    25859 azoxystrobin O=C(OC)/C(=C 116 5020878 http://www.s PHYSPROP
    25860 nitrofurantoinO=[N+]([O-]) 263 5036498 http://www.s PHYSPROP
    25861 nifurtimox O=S2(=O)CC(C 181 5246596 http://www.s PHYSPROP
    25862 methisazone NC(=S)NN=C2c 245 5259074 http://www.s PHYSPROP
    25863 dantrolene [O-][N+](=O) 279.5 5290202 http://www.s PHYSPROP
    25864 clodinafop-pr O=C(OCC#C)C( 59.5 5291880 http://www.s PHYSPROP
    25865 1,2,4-triazole Clc2ccc(Cn1cn 67 6445141 http://www.s PHYSPROP
    25866 2-butanone, ( [O-][N+](=O)c 116.8 7838476 http://www.s PHYSPROP
    25867 isonitrosoace O=C(/C=N/O)c 129 7840755 http://www.s PHYSPROP
    25868 1-phenyl-1,2- O=C(C(C)=NO) 114 7840781 http://www.s PHYSPROP
    25869 aldicarb CC(C)(C=NOC( 99 7844539 http://www.s PHYSPROP
    25870 nidroxyzone O=[N+]([O-]) 214 7844540 http://www.s PHYSPROP
    25871 hydrofuramidC(=N/C(/N=C/ 117 7844541 http://www.s PHYSPROP
    25872 aldicarb oxim ON=CC(C)(C)S 21 7844560 http://www.s PHYSPROP
    25873 aldicarb sulfo CC(C)(/C=N/O 141 7844561 http://www.s PHYSPROP
    25874 gophacide Clc2ccc(OP(=S 105 7844636 http://www.s PHYSPROP
    25875 ethienocarb N#CCCC(C)(C) 123 7845104 http://www.s PHYSPROP
    25876 butoxycarbox CC(C(C)=NOC( 87 7845475 http://www.s PHYSPROP
    25877 nifurzide O=C(NN=CC=Cc1 235.5 7845510 http://www.s PHYSPROP
    25878 nifurfoline [O-][N+](=O) 206 7845534 http://www.s PHYSPROP
    25879 verazide O=C(N/N=C/c1 189 7848692 http://www.s PHYSPROP
    25880 pymetrozine CC=2CN(/N=C/ 217 7850487 http://www.s PHYSPROP
    25881 ssf-126 CNC(=O)C(=NO 88 7850488 http://www.s PHYSPROP
    25882 oxabetrinil N#C/C(=NOCC 77.7 7850531 http://www.s PHYSPROP
    25883 alanycarb CC(SC)=NOC(= 47 7850539 http://www.s PHYSPROP
    25884 isomethiozin CC(C)(C)C1=N 159.3 7850545 http://www.s PHYSPROP
    25885 fenpyroximat Cc3nn(C)c(Oc1 102 7850857 http://www.s PHYSPROP
    25886 benzaldehyde,CCN(CC)c3ccc( 94.5 7854514 http://www.s PHYSPROP
    25887 oxamyl O=C(C(=NOC(= 101 7869433 http://www.s PHYSPROP
    25888 thiodicarb CN(SN(C)C(=O 173 7875353 http://www.s PHYSPROP
    25889 pyriminobac- C/C(=NOC)c2c 107 7878771 http://www.s PHYSPROP
    25890 tepa,n-p-no2 O=P(N/N=C/c1 149 7879944 http://www.s PHYSPROP
    25891 tepa,n-p-no2-O=P(N(/N=C/c 149.5 7933456 http://www.s PHYSPROP
    25892 tepa,n-benzyl O=P(N(/N=C/c 149 7945036 http://www.s PHYSPROP
    25893 tralomethrin BrC(Br)(Br)C( 143 7985670 http://www.s PHYSPROP
    25894 emtricitabine FC1=CN(C(=O 138 8013489 http://www.s PHYSPROP
    25895 ammonium olO=C(CCCCCCC 71 8058437 http://www.s PHYSPROP
    25896 indoxacarb FC(F)(F)Oc1c 88.1 8112367 http://www.s PHYSPROP
    25897 dpx-jw062 FC(F)(F)Oc1c 140.5 8112367 http://www.s PHYSPROP
    25898 n2,o-diacetyl CC(=O)Nc1ncc 134 8170099 http://www.s PHYSPROP
    25899 thymyl n-iso O=C(Oc1cc(C) 57 8374657 http://www.s PHYSPROP
    25900 5-chloro-[1,4 Clc1cccc2c1C 163 8417170 http://www.s PHYSPROP
    25901 .beta.,.beta.- CC=2CCCC(C)( 183 8432151 http://www.s PHYSPROP
    25902 o-t-butyl car CC(C)(C)NC(= 106.5 8523767 http://www.s PHYSPROP
    25903 n2-acetyldeoxCC(=O)Nc1ncc 181 8530222 http://www.s PHYSPROP
    25904 phenytoin,3- O=C(OCN1C(=O 131.1 8536105 http://www.s PHYSPROP
    25905 o-acetyldeoxyCC(=O)OCCOCn 135 8597688 http://www.s PHYSPROP
    25906 benzoic acid, O=C(OCN1C(= 117.5 8599779 http://www.s PHYSPROP
    25907 dionine CCOc1ccc2C[ 200 8601161 http://www.s PHYSPROP
    25908 ethanone, 1-( CC(=O)c1cc2cc 169.5 8640859 http://www.s PHYSPROP
    25909 codeine n-oxi COc1ccc2C[C 231.5 8646374 http://www.s PHYSPROP
    25910 5,8-dichloroquClc1ccc(Cl)c2 97.5 8663570 http://www.s PHYSPROP
    25911 e-838 S=P(OCC)(OCC 38 8671899 http://www.s PHYSPROP
    25912 2h-benzotriazoO=C(O)C(C)(C 152.5 8831195 http://www.s PHYSPROP
    25913 1h-indole-3-a COc1ccc(cc1)C 274.5 8841101 http://www.s PHYSPROP
    25914 1h-indole-3-a Oc1ccc(cc1)CN 240 8863783 http://www.s PHYSPROP
    25915 oleyl alcohol (CCCCCCCC/C= 6.5 8928798 http://www.s PHYSPROP
    25916 1,2,4-triazole COc2ccc(Cn1c 41.5 9020622 http://www.s PHYSPROP
    25917 1-tridecanol, CC(C)CCCCCC 10.5 9053802 http://www.s PHYSPROP
    25918 tert-dodecaneCCCCC(S)(CCC -7.5 9107782 http://www.s PHYSPROP
    25919 mefenpyr-dietO=C(OCC)C2(C 51 9112846 http://www.s PHYSPROP
    25920 indanofan O=C4c1ccccc1 61 9221265 http://www.s PHYSPROP
    25921 isopropyl (4-c O=S(=O)(CC(=O 41 9283761 http://www.s PHYSPROP
    25922 acetamide, 2-CCCCNC(=O)CO 69.5 9370760 http://www.s PHYSPROP
    25923 phenol, 2-iod Cc1cccc(I)c1O 15.5 9394100 http://www.s PHYSPROP
    25924 levorphanol Oc2ccc3C[C@ 198.5 9405685 http://www.s PHYSPROP
    25925 morpholine, 4-O=C(COC(=O) 103.5 9440180 http://www.s PHYSPROP
    25926 1,2-dibromo-1BrC(Br)C(F)F -61.3 9588311 http://www.s PHYSPROP
    25927 propene, 1,2-dClC=C(Cl)C(F)( -109.2 9703191 http://www.s PHYSPROP
    25928 triamcinoloneOCC(=O)[C@@ 293 9743016 http://www.s PHYSPROP
    25929 trifloxystrobinFC(F)(F)c1cc 72.9 9839700 http://www.s PHYSPROP
    25930 pentoxazone O=C3O/C(C(=O 104 9888955 http://www.s PHYSPROP
    25931 xibornol CC3(C)C1CCC3( 95 9951982 http://www.s PHYSPROP
    25932 diiodofluoro FC(I)I -34.5 9996877 http://www.s PHYSPROP
    25933 p-hydroxypro CC(Oc1ccccc1 149 10004266 http://www.s PHYSPROP
    25934 2-(2-hydroxypOc3ccccc3c1n 123.5 10178788 http://www.s PHYSPROP
    25935 dichlorometh Clc1c(c(Cl)c(Cl 119.5 10178791 http://www.s PHYSPROP
    25936 1-(dichloromeClc1ccc(C(Cl)C 84 10178792 http://www.s PHYSPROP
    25937 bromo-bromoBrCOCBr -34 10178797 http://www.s PHYSPROP
    25938 1,2,3,4-tetrac ClC=C(/Cl)C(/C -4 10178801 http://www.s PHYSPROP
    25939 8-chloro-2-na Oc1cc2c(cc1)c 101 10178926 http://www.s PHYSPROP
    25940 1,5-dimethyl- Cc1cc(Cl)nn1C 47.5 10178966 http://www.s PHYSPROP
    25941 3-chloro-2-hydOc1c(cccc1Cl 21 10178994 http://www.s PHYSPROP
    25942 2,3,4,6-tetrac Clc1cc(Cl)c(Cl 94 10179008 http://www.s PHYSPROP
    25943 2,3,5-trichlor Cc1cc(Cl)cc(Cl 45.5 10179009 http://www.s PHYSPROP
    25944 trichloromethyClC(Cl)(Cl)C(= 34 10179012 http://www.s PHYSPROP
    25945 4-methylcycloh
    C[C@H]1CC[C -9.2 10179026 http://www.s PHYSPROP
    25946 silane, ethoxytF[Si](F)(F)OCC -122 10179150 http://www.s PHYSPROP
    25947 silane, ethyltrCC[Si](F)(F)F -105 10179151 http://www.s PHYSPROP
    25948 p-methoxybenz
    COc1ccc(cc1) 185 10181338 http://www.s PHYSPROP
    25949 beta-phenylprO=C(O)CCc1cc 107 10181339 http://www.s PHYSPROP
    25950 phenylacetic aOC(=O)Cc1ccc 76.5 10181341 http://www.s PHYSPROP
    25951 2-(2-hydroxypOc3ccccc3c1n 131 10181821 http://www.s PHYSPROP
    25952 dicoumarol OC=3c4ccccc4 290 10183330 http://www.s PHYSPROP
    25953 o-methoxyacetCOc1ccccc1NC 87.5 10188566 http://www.s PHYSPROP
    25954 dioscorine CC=3C[C@@]2 54.5 10194088 http://www.s PHYSPROP
    25955 maleic acid O=C(O)/C=C/C 130.5 392248 http://www.s PHYSPROP
    25956 acetic acid, di FC(F)C(=O)O -1 10200426 http://www.s PHYSPROP
    25957 fluoroacetic a FCC(=O)O 35.2 10205670 http://www.s PHYSPROP
    25958 2(1h)-quinoli OC2=CC(=O)N( 270 10211152 http://www.s PHYSPROP
    25959 harmaline COc1ccc3c(c1 230 10211258 http://www.s PHYSPROP
    25960 zeaxanthin CC2(C)CC(O)C 215.5 10225633 http://www.s PHYSPROP
    25961 benzaldehyde,Oc1ccccc1C= 57 10229769 http://www.s PHYSPROP
    25962 2-hydroxybenzOc2ccccc2/C= 49.5 10237273 http://www.s PHYSPROP
    25963 trifluoroaceticFC(F)(F)C(=O) -15.2 10239201 http://www.s PHYSPROP
    25964 4-methylacetaO=C(C)Nc1ccc 152 10243171 http://www.s PHYSPROP
    25965 librium Clc1ccc2N=C(C 236.2 10248513 http://www.s PHYSPROP
    25966 propanenitrileN#CCCOc2cccc 64 10250740 http://www.s PHYSPROP
    25967 2-furancarboxy
    O=C(O)c1ccco 133.5 10251740 http://www.s PHYSPROP
    25968 4-hydroxycouOC2=CC(=O)Oc 213.5 10254753 http://www.s PHYSPROP
    25969 l-sparteine C3CCCN4C[C@ 30.5 10254876 http://www.s PHYSPROP
    25970 p-methyoxybeCOc1ccc(cc1) 166.5 10256859 http://www.s PHYSPROP
    25971 n-p-tolyl-ben O=C(Nc1ccc(C) 158 10274392 http://www.s PHYSPROP
    25972 2-butenedioicO=C(O)C=C(/C 204.5 10289044 http://www.s PHYSPROP
    25973 2,3,3-trichlor Cl/C(Cl)=C(/C 76 10289059 http://www.s PHYSPROP
    25974 1-hydroxy-5,1Oc2cccc1nc3c 158 10293196 http://www.s PHYSPROP
    25975 desaspidin bbOC2=C(Cc1c(O 150 10295071 http://www.s PHYSPROP
    25976 2,6-dimethylbCc1cccc(C)c1 116 10295497 http://www.s PHYSPROP
    25977 p-phenylazop Oc2ccc(/N=N/ 155 10296254 http://www.s PHYSPROP
    25978 1-(phenylazo)Oc3ccc1ccccc 134 10296256 http://www.s PHYSPROP
    25979 p-aminoacetanO=C(C)Nc1ccc 166.5 10297844 http://www.s PHYSPROP
    25980 acetamide, n-O=C(C)Nc1ccc 110 10298354 http://www.s PHYSPROP
    25981 bromoacetic aBrCC(=O)O 50 10301338 http://www.s PHYSPROP
    25982 4-pyridineald ON=Cc1ccncc 131.5 10302295 http://www.s PHYSPROP
    25983 chanoclavine CC(CO)=CC1c3 221 10302455 http://www.s PHYSPROP
    25984 3-pyridine-al ON=Cc1ccccn 151.5 10302871 http://www.s PHYSPROP
    25985 1h-benzimidazCc1ccc2nc(C) 203 10344748 http://www.s PHYSPROP
    25986 rifamycin sv CC(=O)OC4C(C 300 10396152 http://www.s PHYSPROP
    25987 dimethyl phosO=P(OC)OC -60 10415644 http://www.s PHYSPROP
    25988 4,4'-dimetho COc2ccc(N=[N+ 127 10429945 http://www.s PHYSPROP
    25989 2-me-3-oh-1, O=C2c1ccccc1 173.5 10430996 http://www.s PHYSPROP
    25990 acetamide, n-CC(=O)NC(=O) 104.5 10436392 http://www.s PHYSPROP
    25991 4-methyl-5-pro
    CC=1C(=S)SSC 49 10437288 http://www.s PHYSPROP
    25992 7-quinolinol Oc1cc2ncccc2 239 10437304 http://www.s PHYSPROP
    25993 5(1,2-dihydro OC=1C(=O)OC 168.5 10437567 http://www.s PHYSPROP
    25994 1,2,4-triazole Fc2ccc(Cn1cnc 64 10437735 http://www.s PHYSPROP
    25995 allopurinol, 1-CC(=O)n2ncc1 252 10437749 http://www.s PHYSPROP
    25996 2,3-naphthalen
    CCc1cc2cc(O)c 149 10438014 http://www.s PHYSPROP
    25997 2h-benzotriazNC(=O)C(C)n1 169.5 10438042 http://www.s PHYSPROP
    25998 allopurinol, 1 CCC(=O)n2ncc 261 10438073 http://www.s PHYSPROP
    25999 acetamide, 2-CNC(=O)COC(= 111.5 10438089 http://www.s PHYSPROP
    26000 2,3-dimethox COC1=C(OC)C( 62.5 10438147 http://www.s PHYSPROP
    26001 1(2h)-pyrimidO=C1NC(=O)C( 226.5 10438191 http://www.s PHYSPROP
    26002 benzenesulfonO=S(N)(=O)c1 95.5 10438273 http://www.s PHYSPROP
    26003 5-ethyl-4-phenCCC=2SSC(=O) 82 10438282 http://www.s PHYSPROP
    26004 1,2,4-triazole Clc1ccc(cc1Cl 46.5 10438285 http://www.s PHYSPROP
    26005 5h-thieno[3,2NS(=O)(=O)c1 213.5 10438326 http://www.s PHYSPROP
    26006 4h-thieno[2,3NS(=O)(=O)c1 222 10438327 http://www.s PHYSPROP
    26007 4h-thieno[2,3NS(=O)(=O)c1 169 10438329 http://www.s PHYSPROP
    26008 5h-thieno[3,2NS(=O)(=O)c1 157.5 10438330 http://www.s PHYSPROP
    26009 2-thiophenesuNS(=O)(=O)c1 63 10438332 http://www.s PHYSPROP
    26010 2,3-naphthaleCCOc1cc2cc(O 131.5 10438440 http://www.s PHYSPROP
    26011 2h-benzotriazNC(=O)C(C)(C 173.5 10438446 http://www.s PHYSPROP
    26012 2h-benzotriazNC(=O)C(CC)n 127.5 10438448 http://www.s PHYSPROP
    26013 2h-benzotriazNC(=O)CC(C)n 152.5 10438450 http://www.s PHYSPROP
    26014 1h-benzotriazNC(=O)CC(C)n 103 10438453 http://www.s PHYSPROP
    26015 2h-benzotriazO=C(O)CC(C)n 82.5 10438468 http://www.s PHYSPROP
    26016 allopurinol, 1 CCCC(=O)n2nc 223.5 10438492 http://www.s PHYSPROP
    26017 acetamide, 2-CN(C)C(=O)CO 81.5 10438513 http://www.s PHYSPROP
    26018 acetamide, 2-CCNC(=O)COC( 106 10438514 http://www.s PHYSPROP
    26019 benzamide, 2-NC(=O)c1cccc 92.5 10438557 http://www.s PHYSPROP
    26020 minoxidil Nc1cc(nc(N)[ 248 10438564 http://www.s PHYSPROP
    26021 benzenemethan
    Oc1ccc(cc1O) 109 10438579 http://www.s PHYSPROP
    26022 benzenesulfonO=S(N)(=O)c1 78.5 10438694 http://www.s PHYSPROP
    26023 benzenesulfonNS(=O)(=O)c1 117 10438748 http://www.s PHYSPROP
    26024 benzenesulfonNS(=O)(=O)c1c 110 10438752 http://www.s PHYSPROP
    26025 4h-thieno[2,3NS(=O)(=O)c1 165 10438770 http://www.s PHYSPROP
    26026 5h-thieno[3,2NS(=O)(=O)c1 190.5 10438771 http://www.s PHYSPROP
    26027 2-thiophenesuNS(=O)(=O)c1 48.5 10438773 http://www.s PHYSPROP
    26028 1,2,4-triazole CCCCc2ccc(Cn 37.5 10438869 http://www.s PHYSPROP
    26029 2h-benzotriazNC(=O)C(CCC) 126.5 10438902 http://www.s PHYSPROP
    26030 2h-benzotriazNC(=O)CCC(C) 102 10438905 http://www.s PHYSPROP
    26031 1h-benzotriazNC(=O)C(CCC) 125 10438907 http://www.s PHYSPROP
    26032 azetidine, 1-[ O=C(COC(=O)c 74.5 10438924 http://www.s PHYSPROP
    26033 pentanoic acidO=C(O)CCC(C) 86 10438930 http://www.s PHYSPROP
    26034 pentanoic acidO=C(O)CCC(C) 73 10438931 http://www.s PHYSPROP
    26035 2h-benzotriazoO=C(OCC)C(C) 39.5 10438934 http://www.s PHYSPROP
    26036 acetamide, 2-CCN(C)C(=O)C 20 10438984 http://www.s PHYSPROP
    26037 acetamide, 2-CCCNC(=O)COC 89.5 10438986 http://www.s PHYSPROP
    26038 acetamide, 2-CC(C)NC(=O)C 129.5 10438987 http://www.s PHYSPROP
    26039 drazoxolon CC2=NOC(=O) 168 10439157 http://www.s PHYSPROP
    26040 benzenesulfonO=S(N)(=O)c1 86 10439207 http://www.s PHYSPROP
    26041 benzenesulfonNS(=O)(=O)c1 101 10439258 http://www.s PHYSPROP
    26042 benzenesulfonO=S(N)(=O)c1 165 10439264 http://www.s PHYSPROP
    26043 benzenesulfonNS(=O)(=O)c1c 110.5 10439265 http://www.s PHYSPROP
    26044 5h-thieno[3,2NS(=O)(=O)c1 266 10439280 http://www.s PHYSPROP
    26045 4h-thieno[2,3NS(=O)(=O)c1 242.5 10439281 http://www.s PHYSPROP
    26046 benzenesulfonClc1cc(ccc1S 127 10439282 http://www.s PHYSPROP
    26047 4h-thieno[2,3NS(=O)(=O)c1 167.5 10439285 http://www.s PHYSPROP
    26048 5h-thieno[3,2NS(=O)(=O)c2 187 10439286 http://www.s PHYSPROP
    26049 5h-thieno[3,2NS(=O)(=O)c1 164 10439287 http://www.s PHYSPROP
    26050 4h-thieno[2,3NS(=O)(=O)c1 174 10439288 http://www.s PHYSPROP
    26051 2-thiophenesuO=S(=O)(CCCO 107 10439292 http://www.s PHYSPROP
    26052 2h-benzotriazNC(=O)C(CCCC 101.5 10439439 http://www.s PHYSPROP
    26053 1h-benzotriazNC(=O)C(CCCC 118 10439441 http://www.s PHYSPROP
    26054 pyrrolidine, 1 O=C(COC(=O)c 58 10439461 http://www.s PHYSPROP
    26055 2h-benzotriazoO=C(OCC)C(CC 48.5 10439469 http://www.s PHYSPROP
    26056 acetamide, n-CC(=O)N(C)C( 102.5 10439498 http://www.s PHYSPROP
    26057 butanamide, 4CN(C)C(=O)CC 40.5 10439505 http://www.s PHYSPROP
    26058 benzoic acid, CCN(CC)C(=O) 72.5 10439507 http://www.s PHYSPROP
    26059 acetamide, 2-NC(=O)CNC(=O 151.5 10439521 http://www.s PHYSPROP
    26060 butanoic acid NC(=O)c1cccc 57 10439550 http://www.s PHYSPROP
    26061 acetamide, 2-OCCN(C)C(=O) 79 10439551 http://www.s PHYSPROP
    26062 benzamide, n-Oc1ccc(cc1O) 139.5 10439556 http://www.s PHYSPROP
    26063 acetic acid, 3 O=S(N)(=O)c1 87.5 10439715 http://www.s PHYSPROP
    26064 benzenesulfonNS(=O)(=O)c1 103 10439792 http://www.s PHYSPROP
    26065 benzenesulfonNS(=O)(=O)c1c 140.5 10439793 http://www.s PHYSPROP
    26066 thieno[2,3-b]fNS(=O)(=O)c1 203 10439807 http://www.s PHYSPROP
    26067 benzenesulfonO=S(N)(=O)c1 150 10439810 http://www.s PHYSPROP
    26068 benzenesulfonNS(=O)(=O)c1c 104 10439811 http://www.s PHYSPROP
    26069 benzenesulfonNc1cc(ccc1S( 129 10439813 http://www.s PHYSPROP
    26070 benzenesulfonFc1cc(ccc1S( 165 10439817 http://www.s PHYSPROP
    26071 2-thiophenesuO=S(=O)(CCCC 109 10439835 http://www.s PHYSPROP
    26072 allopurinol, 1 Oc3ncnc1c3cn 271 10439923 http://www.s PHYSPROP
    26073 salinazid O=C(N/N=C/c1 232 10439927 http://www.s PHYSPROP
    26074 acetamide, n-(CC(=O)Nc1ccc 94 10439957 http://www.s PHYSPROP
    26075 piperidine, 1- O=C(COC(=O)c 88 10439990 http://www.s PHYSPROP
    26076 2h-benzotriazoO=C(OCC)C(CC 36.5 10439996 http://www.s PHYSPROP
    26077 propanamide,CCN(CC)C(=O)
    2 53.5 10440027 http://www.s PHYSPROP
    26078 acetamide, n-NC(=O)CN(C)C 101.5 10440039 http://www.s PHYSPROP
    26079 propanamide,NC(=O)C(C)NC 201.5 10440040 http://www.s PHYSPROP
    26080 glycine, n-[(b O=C(O)CN(C)C 106.5 10440055 http://www.s PHYSPROP
    26081 o-(pivaloylox CC(C)(C)C(=O 95 10440063 http://www.s PHYSPROP
    26082 acetamide, 2-CCN(CCO)C(=O 79 10440065 http://www.s PHYSPROP
    26083 1h-benzimidazo
    O=C(OC)n1c3c 123.5 10440142 http://www.s PHYSPROP
    26084 2-thiophenesuO=C(c1csc(c1) 176 10440273 http://www.s PHYSPROP
    26085 2-thiophenesuO=C(c1csc(c1) 192.5 10440278 http://www.s PHYSPROP
    26086 malotilate S=C/C(C=S)=C 60.5 10440297 http://www.s PHYSPROP
    26087 benzenesulfonNS(=O)(=O)c1c 163 10440311 http://www.s PHYSPROP
    26088 benzenesulfonO=S(N)(=O)c1 134.5 10440313 http://www.s PHYSPROP
    26089 benzenesulfonNc1cc(ccc1S( 137 10440318 http://www.s PHYSPROP
    26090 benzenesulfonFc1cc(ccc1S( 130 10440321 http://www.s PHYSPROP
    26091 acetic acid, 2 O=S(=O)(CCOC 115 10440346 http://www.s PHYSPROP
    26092 acetamide, 2-(C=CCN(CC=C)C 42.5 10440513 http://www.s PHYSPROP
    26093 2-naphthaleneCCCCNC(=O)c1 194 10440514 http://www.s PHYSPROP
    26094 2-azetidinecarOC(=O)C2CCN2 149.5 10440572 http://www.s PHYSPROP
    26095 4-piperidinol, OC1CCN(CC1)C 121.5 10440578 http://www.s PHYSPROP
    26096 acetamide, 2-CCCCCCNC(=O) 130.5 10440585 http://www.s PHYSPROP
    26097 2-propenamide
    Oc1ccc(/C=C/ 142 10440586 http://www.s PHYSPROP
    26098 acetamide, 2-CCCN(CCC)C(= 20 10440587 http://www.s PHYSPROP
    26099 acetamide, 2-CC(C)N(C(C)C 105.5 10440588 http://www.s PHYSPROP
    26100 benzoic acid, O=C(C)Oc1ccc 75.5 10440610 http://www.s PHYSPROP
    26101 benzoic acid, O=C(C)Oc1ccc 80.5 10440611 http://www.s PHYSPROP
    26102 benzoic acid, O=C(C)Oc1ccc 51.5 10440623 http://www.s PHYSPROP
    26103 acetamide, 2-OCCN(CCO)C(= 81 10440643 http://www.s PHYSPROP
    26104 1h-benzimidazo
    O=C(OCC)n1c3 84.5 10440696 http://www.s PHYSPROP
    26105 acetamide, 2-ClCC(=O)Nc1c 150.5 10440736 http://www.s PHYSPROP
    26106 2h-benzotriazoCS(=O)(=O)Nc 126.5 10440758 http://www.s PHYSPROP
    26107 2-furansulfon O=C(c1coc(c1) 181 10440764 http://www.s PHYSPROP
    26108 acetic acid, 5 O=S(N)(=O)c1 84 10440799 http://www.s PHYSPROP
    26109 2-thiophenesuO=C(c1csc(c1) 174 10440853 http://www.s PHYSPROP
    26110 2-furansulfon O=S(=O)(c1coc 185 10440866 http://www.s PHYSPROP
    26111 thieno[2,3-b] NS(=O)(=O)c2 244 10440868 http://www.s PHYSPROP
    26112 2-furansulfon O=S(=O)(c1coc 175 10440875 http://www.s PHYSPROP
    26113 benzoic acid, NS(=O)(=O)c1 124 10440885 http://www.s PHYSPROP
    26114 benzenesulfonFc1cc(ccc1S( 134.5 10440894 http://www.s PHYSPROP
    26115 2-thiophenesuO=S(=O)(c1csc 185 10440899 http://www.s PHYSPROP
    26116 2-thiophenesuO=S(=O)(c1csc 145 10440903 http://www.s PHYSPROP
    26117 2-thiophenesuO=S(=O)(c1csc 193 10440904 http://www.s PHYSPROP
    26118 acetic acid, 3 O=S(=O)(CCCO 104 10440918 http://www.s PHYSPROP
    26119 toxaphene (e ClC1C2C(Cl)C(C 77 10440990 http://www.s PHYSPROP
    26120 2-propenamide
    Oc2ccc(/C=CC 165 10441062 http://www.s PHYSPROP
    26121 2h-benzotriazO=C(OCC)Nc1c 121.5 10441139 http://www.s PHYSPROP
    26122 piperidine, 1- CC2CCCC(C)N2 118 10441160 http://www.s PHYSPROP
    26123 piperidine, 1- O=C(COC(=O)c 54.5 10441161 http://www.s PHYSPROP
    26124 l-prolinamide,O=C(N)C2CCCN 194.5 10441173 http://www.s PHYSPROP
    26125 l-proline, n-[ OC(=O)C2CCCN 116.5 10441190 http://www.s PHYSPROP
    26126 acetamide, 2-CCCCCCN(C)C( 100.5 10441196 http://www.s PHYSPROP
    26127 glycine, n-[(b O=C(OCC)CN(C 39.5 10441221 http://www.s PHYSPROP
    26128 acetamide, 2-OCC(CO)(CO)N 126.5 10441275 http://www.s PHYSPROP
    26129 1-(3,5-dimethCc1cc(cc(C)c 219.5 10441379 http://www.s PHYSPROP
    26130 isopropyl (1-( O=S(=O)(c1ccc 50.8 10441389 http://www.s PHYSPROP
    26131 acetamide, 2, ClC(Cl)C(=O) 119 10441458 http://www.s PHYSPROP
    26132 2-furansulfon O=S(=O)(c1coc 117.5 10441470 http://www.s PHYSPROP
    26133 benzenesulfonO=S(N)(=O)c1 223 10441476 http://www.s PHYSPROP
    26134 benzoic acid, O=S(=O)(CCO) 99 10441486 http://www.s PHYSPROP
    26135 benzenesulfonO=S(=O)(CCCO) 169 10441490 http://www.s PHYSPROP
    26136 2-thiophenesuO=S(=O)(c1csc 170 10441498 http://www.s PHYSPROP
    26137 solvent red 1 COc3ccccc3/N 183 10441568 http://www.s PHYSPROP
    26138 phenprocoumOC=1c3ccccc3 179.5 10441592 http://www.s PHYSPROP
    26139 2-propenamide
    Oc2ccc(/C=CC 158 10441617 http://www.s PHYSPROP
    26140 2h-benzotriazoCC(C)(C)C(=O 135.5 10441680 http://www.s PHYSPROP
    26141 l-proline, n-[ O=C(COC(=O)c 72.5 10441742 http://www.s PHYSPROP
    26142 acetamide, 2-CC(C)CN(CC(C 44.5 10441749 http://www.s PHYSPROP
    26143 acetamide, 2-(CCCCN(CCCC)C 25 10441750 http://www.s PHYSPROP
    26144 benzoic acid, O=C(C)Oc1ccc 76.5 10441768 http://www.s PHYSPROP
    26145 benzoic acid, O=C(C)Oc1ccc 186 10441778 http://www.s PHYSPROP
    26146 acetamide, 2-CC(O)CN(CC(C 105.5 10441792 http://www.s PHYSPROP
    26147 acetamide, 2-COCCN(CCOC)C 57.5 10441793 http://www.s PHYSPROP
    26148 1h-benzimidazo
    CC(C)COC(=O) 72.5 10441845 http://www.s PHYSPROP
    26149 acetamide, 2,2ClC(Cl)(Cl)C( 136 10441960 http://www.s PHYSPROP
    26150 2-thiophenesuO=S(=O)(CCCO 94 10441973 http://www.s PHYSPROP
    26151 2h-benzotriazoCC(C)COC(=O) 121 10442103 http://www.s PHYSPROP
    26152 benzoic acid, O=C(COC(=O) 97.5 10442170 http://www.s PHYSPROP
    26153 benzoic acid, O=C(C)Oc1ccc 132.5 10442178 http://www.s PHYSPROP
    26154 tepa 4-(piperi O=C(NP(=O)(N 143 10442316 http://www.s PHYSPROP
    26155 tepa 4-(n-oh-pO=C(NP(=O)(N 177 10442324 http://www.s PHYSPROP
    26156 benzamide, n-(O=C(Nc1ccc2n 165 10442440 http://www.s PHYSPROP
    26157 warfarin CC(=O)CC(C1= 161 10442445 http://www.s PHYSPROP
    26158 1-(2-methyl),2Cc2ccccc2C(=O 214.5 10442472 http://www.s PHYSPROP
    26159 1-(4-methyl),2O=C(NN(C(=O)c 187.5 10442473 http://www.s PHYSPROP
    26160 1-(2-fluoro),2 O=C(c1ccccc1F 183.5 10442499 http://www.s PHYSPROP
    26161 1-(4-fluoro),2 O=C(c1ccc(F)c 217.5 10442500 http://www.s PHYSPROP
    26162 1-(3-fluoro),2 O=C(c1cc(F)cc 176.5 10442501 http://www.s PHYSPROP
    26163 2-propenamide
    COc1cc(ccc1O 201 10442517 http://www.s PHYSPROP
    26164 nalidixic amidO=C(OCC)CNC( 198.5 10442546 http://www.s PHYSPROP
    26165 nalidixic amidO=C(OC)C(C)N 176 10442547 http://www.s PHYSPROP
    26166 1,4-naphthaleCC(=O)Oc2c1c 70.5 10442553 http://www.s PHYSPROP
    26167 benzoic acid, O=C(C)Oc1ccc 50.5 10442585 http://www.s PHYSPROP
    26168 benzoic acid, O=C(C)Oc1ccc 108.5 10442586 http://www.s PHYSPROP
    26169 1,4-naphthalen
    CC(=O)Oc2c1c 102.5 10442590 http://www.s PHYSPROP
    26170 glycine, n-[[[ O=C(C)Oc1ccc 68.5 10442604 http://www.s PHYSPROP
    26171 clozapine CN1CCN(CC1)C 183.5 10442628 http://www.s PHYSPROP
    26172 1-(2-chloro),2O=C(c1ccccc1C 161.5 10442648 http://www.s PHYSPROP
    26173 1-(4-chloro),2O=C(c1ccc(Cl) 212.5 10442649 http://www.s PHYSPROP
    26174 1-(3-chloro),2O=C(c1cc(Cl)c 180.5 10442650 http://www.s PHYSPROP
    26175 piroxicam OC=2c1ccccc1 199 10442653 http://www.s PHYSPROP
    26176 progabide Clc1ccc(cc1)/ 134 10442693 http://www.s PHYSPROP
    26177 1,4-naphthalen
    CC(=O)Oc1c(OC 133.5 10442711 http://www.s PHYSPROP
    26178 1-(4-bromo),2O=C(c1ccc(Br) 228.5 10442762 http://www.s PHYSPROP
    26179 1-(3-bromo),2O=C(c1cc(Br)c 217.5 10442763 http://www.s PHYSPROP
    26180 1-(2-bromo),2O=C(c1ccccc1B 195.5 10442764 http://www.s PHYSPROP
    26181 1,4-naphthaleCC(=O)Oc2c1c 102.5 10442778 http://www.s PHYSPROP
    26182 1-(4-iodo),2-dO=C(c1ccc(I)c 234.5 10442792 http://www.s PHYSPROP
    26183 1-(3-iodo),2-dO=C(c1cc(I)cc 255.5 10442793 http://www.s PHYSPROP
    26184 1-(3-cyano),2-O=C(N(NC(=O)c 173.5 10442817 http://www.s PHYSPROP
    26185 1-(4-cyano),2-O=C(NN(C(=O)c 199.5 10442818 http://www.s PHYSPROP
    26186 1-(2-ethyl),2- CCc2ccccc2C(= 177.5 10442843 http://www.s PHYSPROP
    26187 1-(3,4-dimethyCc1ccc(cc1C)C 225.5 10442844 http://www.s PHYSPROP
    26188 1-(2,5-dimethyCc2ccc(C)cc2C 197.5 10442845 http://www.s PHYSPROP
    26189 1-(2,4-dimethyCc2cc(C)ccc2C 195.5 10442846 http://www.s PHYSPROP
    26190 1-(2,3-dimethyO=C(c1cccc(C) 204.5 10442848 http://www.s PHYSPROP
    26191 1-(3-methoxy)COc1cc(ccc1)C 188.5 10442859 http://www.s PHYSPROP
    26192 1-(2-methoxy)COc2ccccc2C( 181.5 10442860 http://www.s PHYSPROP
    26193 1-(4-methoxy)COc1ccc(cc1)C 221.5 10442861 http://www.s PHYSPROP
    26194 1-naphthalenec
    CC(=O)Oc2c1c 152.5 10442889 http://www.s PHYSPROP
    26195 2-naphthalenec
    CC(=O)Oc2c1c 124.5 10442890 http://www.s PHYSPROP
    26196 1-(2,6-difluor O=C(c1c(F)ccc 194.5 10442925 http://www.s PHYSPROP
    26197 1,4-naphthalen
    CC(=O)Oc2c1c 69.5 10442945 http://www.s PHYSPROP
    26198 1,4-naphthalen
    CC(=O)Oc2c1c 77.5 10442946 http://www.s PHYSPROP
    26199 benzoic acid, O=C(C)Oc1ccc 47.5 10442971 http://www.s PHYSPROP
    26200 benzamide, 4-Clc1ccc(cc1) 180 10442999 http://www.s PHYSPROP
    26201 1-(2-methylthiCSc2ccccc2C(= 196.5 10443012 http://www.s PHYSPROP
    26202 coumachlor Clc1ccc(cc1) 169 10443016 http://www.s PHYSPROP
    26203 1-(3-chloro-2-Cc1c(cccc1Cl) 213.5 10443027 http://www.s PHYSPROP
    26204 1-(2-chloro-6-O=C(c1c(F)ccc 209.5 10443056 http://www.s PHYSPROP
    26205 1-(3,4-dichlor Clc1ccc(cc1Cl 238.5 10443097 http://www.s PHYSPROP
    26206 1-(2,6-dichlor O=C(c1c(Cl)cc 198.5 10443099 http://www.s PHYSPROP
    26207 1-(2,3-dichlor Clc1c(cccc1Cl 209.5 10443100 http://www.s PHYSPROP
    26208 n(24-no2-6cl [O-][N+](=O)c 134 10443113 http://www.s PHYSPROP
    26209 1-(3-nitro),2- O=[N+]([O-])c 222.5 10443211 http://www.s PHYSPROP
    26210 1-(2-nitro),2- O=[N+]([O-])c 181.5 10443212 http://www.s PHYSPROP
    26211 1-(4-nitro),2- O=[N+]([O-])c 250.5 10443213 http://www.s PHYSPROP
    26212 2-propenamide
    COc1cc(ccc1O 99 10443234 http://www.s PHYSPROP
    26213 nalidixic amidO=C(OC)C(NC( 155 10443258 http://www.s PHYSPROP
    26214 acetamide, 2-CCCCCCN(CCCC 162.5 10443283 http://www.s PHYSPROP
    26215 benzenesulfonCc1ccc(cc1)S 126 10443322 http://www.s PHYSPROP
    26216 2h-benzotriazNc1ccc(cc1)S 207 10443323 http://www.s PHYSPROP
    26217 buthiobate CC(C)(C)c1ccc 32 10443365 http://www.s PHYSPROP
    26218 benzamide, n-(Clc1ccc(cc1C 207 10443368 http://www.s PHYSPROP
    26219 n(2,4-no2-6-cfFC(F)(F)c2cc(c 105 10443382 http://www.s PHYSPROP
    26220 n(24-no2-6cl [O-][N+](=O)c2 126 10443383 http://www.s PHYSPROP
    26221 indoramin O=C(NC3CCN(C 209 10443415 http://www.s PHYSPROP
    26222 benzamide, n-([O-][N+](=O) 227.5 10443427 http://www.s PHYSPROP
    26223 acenocoumari[O-][N+](=O) 197 10443441 http://www.s PHYSPROP
    26224 1-(3,4-dimethCOc1cc(ccc1O 205.5 10443471 http://www.s PHYSPROP
    26225 nalidixic amidO=C(OC)C(NC( 142 10443488 http://www.s PHYSPROP
    26226 1,4-naphthaleCC(C)C(=O)Oc 95.5 10443494 http://www.s PHYSPROP
    26227 1-(4-trifluoro FC(F)(F)c1ccc 228.5 10443532 http://www.s PHYSPROP
    26228 1-(3-trifluoro FC(F)(F)c1ccc 203.5 10443533 http://www.s PHYSPROP
    26229 1-(2-trifluoro FC(F)(F)c2ccc 172.5 10443534 http://www.s PHYSPROP
    26230 1-(2,3,4,5-tet Fc1c(cc(F)c(F 158.5 10443558 http://www.s PHYSPROP
    26231 tepa 4-(piperi CC3(C)CN3P(= 179 10443614 http://www.s PHYSPROP
    26232 tepa 4-(n-oh-pCC3(C)CN3P(= 202.5 10443620 http://www.s PHYSPROP
    26233 2-naphthalenol
    Oc4ccc1ccccc 195 10443663 http://www.s PHYSPROP
    26234 benzamide, n-(FC(F)(F)c1ccc 215.5 10443752 http://www.s PHYSPROP
    26235 benzoic acid, Fc1c(c(F)c(F) 200.5 10443818 http://www.s PHYSPROP
    26236 2h-benzotriazo[O-][N+](=O)c 194 10443828 http://www.s PHYSPROP
    26237 tepa 4-(n-oh-pCC3(C)CN3P(= 193 10443850 http://www.s PHYSPROP
    26238 n(24-no2-6cf3FC(F)(F)c2cc( 98 10443851 http://www.s PHYSPROP
    26239 propanoic acidCC(C)(C)C(=O) 179 10443938 http://www.s PHYSPROP
    26240 cyclopenta[b]pO=C(O)C(CCc1 109 10443939 http://www.s PHYSPROP
    26241 n(24-no2-6cf3FC(F)(F)c2cc( 125 10443969 http://www.s PHYSPROP
    26242 benzamide, n-(COc1cc(cc(OC 129 10444050 http://www.s PHYSPROP
    26243 ethyl biscoumOC=1c4ccccc4 154 10444159 http://www.s PHYSPROP
    26244 hydrocortisonCCCC(=O)OCC( 218.5 10444306 http://www.s PHYSPROP
    26245 brodifacoum Brc1ccc(cc1) 230 10444663 http://www.s PHYSPROP
    26246 milbemectin aOC3C(C)=CC4C 213.5 10444762 http://www.s PHYSPROP
    26247 milbemectin aOC3C(C)=CC4C 213.5 10444793 http://www.s PHYSPROP
    26248 rokitamycin CCC(=O)OC1(C 116 10445151 http://www.s PHYSPROP
    26249 4-(4-nitrophe Oc2ccc(/N=N/c 216 10447013 http://www.s PHYSPROP
    26250 21h,23h-porpn2c3cc5nc(cc4 360 10447586 http://www.s PHYSPROP
    26251 phenylphosphiO=P(O)c1cccc 84 10449255 http://www.s PHYSPROP
    26252 dibenzyl phosO=P(OCc1cccc -5 10449934 http://www.s PHYSPROP
    26253 t-butylphosphCC(C)(C)OP(= 192 10449952 http://www.s PHYSPROP
    26254 phosphonic aciO=P(Oc1ccccc 12 10449956 http://www.s PHYSPROP
    26255 methylphosphiCP(=O)O -40.01 10450135 http://www.s PHYSPROP
    26256 dimethyl glyo CC(=NO)C(/C) 245.5 10466342 http://www.s PHYSPROP
    26257 2,3-pentanediC/C(=NO)C(CC 172.5 10466745 http://www.s PHYSPROP
    26258 4-methyl-2-(pOc2ccc(C)cc2 108.5 10466802 http://www.s PHYSPROP
    26259 2,4-dihydrox Oc2cc(O)ccc2 170 10466804 http://www.s PHYSPROP
    26260 benzoic acid, Oc1c(O)c(Br)c 150 10467245 http://www.s PHYSPROP
    26261 aldosterone OCC(=O)[C@H 166.5 10468436 http://www.s PHYSPROP
    26262 morphine Oc1ccc2CC4[ 255 10468442 http://www.s PHYSPROP
    26263 aureomycin NC(=O)C1=C(O 168.5 10468443 http://www.s PHYSPROP
    26264 cholesterol CC(C)CCCC(C 148.5 10468445 http://www.s PHYSPROP
    26265 thiazinamium O=S(=O)(OC)O 208 10468446 http://www.s PHYSPROP
    26266 tributyrin O=C(CCC)OC(O -75 10468450 http://www.s PHYSPROP
    26267 codeine COc1ccc2C[C 157.5 10468461 http://www.s PHYSPROP
    26268 aminotris(hy NC(OC)(OC)O 171.5 10468462 http://www.s PHYSPROP
    26269 oxytetracylcinNC(=O)C=3C(= 184.5 10468463 http://www.s PHYSPROP
    26270 disperse red 9O=C3c1ccccc1 171 10468464 http://www.s PHYSPROP
    26271 dienestrol Oc1ccc(cc1)C( 227.5 10468466 http://www.s PHYSPROP
    26272 7-methyl quinCc1ccc2c(c1) 300 10468467 http://www.s PHYSPROP
    26273 inositol O[C@@H]1C(O 225 10468468 http://www.s PHYSPROP
    26274 1-iodonaphth IC2CCCC1CCC 4.2 10468470 http://www.s PHYSPROP
    26275 triethylene gl CCC(CC)C(=O -10 10468473 http://www.s PHYSPROP
    26276 o-aminoazotoCc2ccccc2/N= 102 10468476 http://www.s PHYSPROP
    26277 paramorphineCOC=1C=CC3[ 193 10468480 http://www.s PHYSPROP
    26278 codeine methCOC1CCC2CC3 260 10468487 http://www.s PHYSPROP
    26279 salicin OC2[C@H](O) 207 10468496 http://www.s PHYSPROP
    26280 fluocortolone OCC(=O)C4C(C 188 10468502 http://www.s PHYSPROP
    26281 rutin OC5C(O)C(COC 125 10468503 http://www.s PHYSPROP
    26282 lead acetate CC(=O)O.CC(= 327.4 10468506 http://www.s PHYSPROP x metal and salt - AL
    26283 aconitine CC(=O)O[C@] 204 10468507 http://www.s PHYSPROP
    26284 propoxypheneCN(C)CC(C)C(C 75.5 10468519 http://www.s PHYSPROP
    26285 raffinose OC3C(O)[C@@ 80 10468537 http://www.s PHYSPROP
    26286 propranolol CC(C)NC(O)/C 96 10468540 http://www.s PHYSPROP
    26287 heroin CC(=O)Oc1cc 173 10468561 http://www.s PHYSPROP
    26288 alpha-peltatinCOc1cc(cc(OC 236 10468562 http://www.s PHYSPROP
    26289 lactitol OC1C(OCC(O)C 146 10468565 http://www.s PHYSPROP
    26290 acetamide, 2, BrC(Br)(Br)C( 121.5 10468568 http://www.s PHYSPROP
    26291 2,3,4-pyridineOC(=O)c1nccc 250 10468577 http://www.s PHYSPROP
    26292 norbormide O=C5NC(=O)C4 194 10468605 http://www.s PHYSPROP
    26293 simetryn CSc1nc(nc(n1) 82.5 10468606 http://www.s PHYSPROP
    26294 methadone hyCCC(=O)C(CC(C 235 10468607 http://www.s PHYSPROP x salt - AL
    26295 tricresyl phos Cc1ccc(cc1)OP -33 10468621 http://www.s PHYSPROP
    26296 tetramethyl dCCC(O)C(O)C(C 37.5 10468623 http://www.s PHYSPROP
    26297 propanal, 2-( ON=CC(C)=NO 157 10468643 http://www.s PHYSPROP
    26298 phosphoric aciClc1cc(Cl)ccc 69.5 10468652 http://www.s PHYSPROP
    26299 l-tryptophan, O=C(OCC)C(Cc 106 10468654 http://www.s PHYSPROP
    26300 4'-((6-hydroxyOc2ccc(C)cc2 195 10468668 http://www.s PHYSPROP
    26301 lidoflazine Cc4cccc(C)c4N 160 10468684 http://www.s PHYSPROP
    26302 ajmaline OCC32CC5CC4C 206 10468704 http://www.s PHYSPROP
    26303 endrocide (enOC=1c4ccccc4 172 10468736 http://www.s PHYSPROP
    26304 c.i. disperse Oc4ccc(N=N/c 210.5 10468749 http://www.s PHYSPROP
    26305 calcium hypoc[O-]ClCl=O.[C 100 10468786 http://www.s PHYSPROP x metal salt -AL
    26306 silver perchlo [O-]Cl(=O)(=O -6.15 10468788 http://www.s PHYSPROP x metal salt -AL
    26307 phosphamidoCOP(=O)(OC)O -45 10468810 http://www.s PHYSPROP
    26308 bromofenoxi Brc1cc(cc(Br) 196.5 10468811 http://www.s PHYSPROP
    26309 phoxim CCOP(=S)(ON= 6.1 10468827 http://www.s PHYSPROP
    26310 mevinphos COP(=O)(OC)O 13.95 10468958 http://www.s PHYSPROP
    26311 bromadioloneBrc1ccc(cc1)c 205 10468969 http://www.s PHYSPROP
    26312 benzoic acid, Nc1ccc(cc1)C 69 10469012 http://www.s PHYSPROP
    26313 flubenzimine FC(F)(F)/N=C/ 118 10469017 http://www.s PHYSPROP
    26314 fosetyl-alumi CCOP(=O)O[Al 215 10469027 http://www.s PHYSPROP x metal - AL
    26315 dis. a. 1 OCCN(CCO)c2cc 190 10469037 http://www.s PHYSPROP
    26316 difenacoum OC=1c6ccccc6 216 10469075 http://www.s PHYSPROP
    26317 tifatol Cc2cc(C)c(N= 44 10469097 http://www.s PHYSPROP
    26318 benfuresate O=S(=O)(OCC) 30.1 10469126 http://www.s PHYSPROP
    26319 benzoic acid, O=C(OC)c1ccc 113 10469133 http://www.s PHYSPROP
    26320 benzoic acid, O=C(OC)c1cc( 113 10469134 http://www.s PHYSPROP
    26321 etobenzanid Clc2c(NC(=O)c 92.5 10469180 http://www.s PHYSPROP
    26322 tralkoxydim CC/C(=NOCC)C 106 10469196 http://www.s PHYSPROP
    26323 myclobutanil Clc1ccc(cc1)C 65.5 10469202 http://www.s PHYSPROP
    26324 ferimzone Cc2ccccc2C(C 175.5 10469206 http://www.s PHYSPROP
    26325 flocoumafen FC(F)(F)c1ccc 167.2 10469214 http://www.s PHYSPROP
    26326 chlorimuron-eO=C(OCC)c1cc 181 10469226 http://www.s PHYSPROP
    26327 flurtamone FC(F)(F)c3cc 152.5 10469259 http://www.s PHYSPROP
    26328 halosulfuron- O=S(=O)(NC(= 176 10469285 http://www.s PHYSPROP
    26329 acrinathrin CC1(C)C(C1C=C 81.5 10469290 http://www.s PHYSPROP
    26330 cycloxydim CCC/C(=NOCC 41 10469292 http://www.s PHYSPROP
    26331 trinexapac O=C1CC(CC(=O 144.4 10469309 http://www.s PHYSPROP
    26332 difethialone Brc1ccc(cc1)c 234.5 10469311 http://www.s PHYSPROP
    26333 4h-thieno[2,3NS(=O)(=O)c1 200 10469314 http://www.s PHYSPROP
    26334 glucopyranosid
    [O-][N+](=O) 199 10469321 http://www.s PHYSPROP
    26335 glucopyranosid
    [O-][N+](=O) 199 10469328 http://www.s PHYSPROP
    26336 metobenzuro CN(OC)C(=O)N 102 10469330 http://www.s PHYSPROP
    26337 glucopyranosid
    CCOC1OC(CO[N 199 10469338 http://www.s PHYSPROP
    26338 diflumetorim Clc2c(NC(CC)c 47.3 10469357 http://www.s PHYSPROP
    26339 butroxydim CCCC(=O)c1c( 80.8 10469362 http://www.s PHYSPROP
    26340 oxaziclomefo O=C1C(=C(C)OC 150 10469364 http://www.s PHYSPROP
    26341 d5-azo dye Brc2cc(cc(c2/ 132 10469508 http://www.s PHYSPROP
    26342 d6-anthrquin Oc3cc(OC1C=C 164 10469509 http://www.s PHYSPROP
    26343 diiodoacetic aIC(I)C(=O)O 110 10472789 http://www.s PHYSPROP
    26344 delta-hexachl Cl[C@H]1[C@H 141.5 10430682 http://www.s PHYSPROP
    26345 alpha-hexachlCl[C@@H]1[C@ 159.5 10468511 http://www.s PHYSPROP
    26346 beta-hexachloCl[C@H]1[C@H 314.5 10468512 http://www.s PHYSPROP
    26347 imidazol-4-co O=C(N)c1ncnc 205 10481959 http://www.s PHYSPROP
    26348 carbadox O=C(OC)NN=Cc2 240 10606106 http://www.s PHYSPROP
    26349 zearalenone Oc1cc(O)cc2C 164.5 10606251 http://www.s PHYSPROP
    26350 alpha-carotenCC2(C)CCC=C( 187.5 10606442 http://www.s PHYSPROP
    26351 ascorbyl palmiOC=1C(=O)OC 112 10606454 http://www.s PHYSPROP
    26352 hydroxystilba Oc2cc(ccc2/C 235 10612853 http://www.s PHYSPROP
    26353 1,3,2-benzodic1cccc2OBOc 12 10617125 http://www.s PHYSPROP
    26354 fluocortin butO=C(OCCCC)C( 195.1 10618564 http://www.s PHYSPROP
    26355 azadirachtin CC=C(/C)C(=O 156.5 10619174 http://www.s PHYSPROP
    26356 norgestimate CC(=O)OC2(C 216 10619295 http://www.s PHYSPROP
    26357 atovaquone Clc1ccc(cc1) 217.5 10619298 http://www.s PHYSPROP
    26358 1-chloro-5-ni [O-][N+](=O)c 111 10621904 http://www.s PHYSPROP
    26359 telithromycin CN(C)C5CC(C) 187.5 10628581 http://www.s PHYSPROP
    26360 azaserine OC(=O)C(N)CO 154 10633647 http://www.s PHYSPROP
    26361 violaxanthin CC3(C)CC(O)C 208 10644731 http://www.s PHYSPROP
    26362 vitamin k1 CC(C)CCCC(C) -20 10645804 http://www.s PHYSPROP
    26363 dimethylbora CBC -72.5 10645856 http://www.s PHYSPROP
    26364 diethylboraneCCBCC -56.3 10645859 http://www.s PHYSPROP
    26365 diflucortoloneOCC(=O)C4C(C 242 10662365 http://www.s PHYSPROP
    26366 posaconazole CC(O)C(CC)N1 171 10662366 http://www.s PHYSPROP
    26367 formebolone O=C2C=C3CCC1 210.5 10669812 http://www.s PHYSPROP
    26368 oxabolone OC=3C(=O)CC 189 10669828 http://www.s PHYSPROP
    26369 furazabol CC2(O)CCC1C 152.5 10669845 http://www.s PHYSPROP
    26370 c9-11 pareth- CCOCCCCCCC -20 10669981 http://www.s PHYSPROP
    26371 ruberythric acO=C4c3ccc(OC 260 10701795 http://www.s PHYSPROP
    26372 phenol, 2,2'-aOc2ccccc2/N= 173 10725475 http://www.s PHYSPROP
    26373 urochloralic a O=C(O)C1OC(O 142 10725686 http://www.s PHYSPROP
    26374 methymycin CN(C)C2CC(C) 196 10761144 http://www.s PHYSPROP
    26375 benzil dioxim ON=C(/C(=N/O 240 10761241 http://www.s PHYSPROP
    26376 1,4-naphthaleO=C2c1ccccc1 282 10764173 http://www.s PHYSPROP
    26377 lapachol C/C(C)=CCC=2 139.5 10770962 http://www.s PHYSPROP
    26378 undecylenic aO=C(O)CCCCC 24.5 10771160 http://www.s PHYSPROP
    26379 dichloroaceticClC(Cl)C(=O)O 13.5 10771217 http://www.s PHYSPROP
    26380 trichloroaceticClC(Cl)(Cl)C(= 57.5 10772050 http://www.s PHYSPROP
    26381 chloroacetic aClCC(=O)O 63 10772140 http://www.s PHYSPROP
    26382 borine trimet BN(C)(C)C 94 10774324 http://www.s PHYSPROP
    26383 fuscin O=C3C=C2C(=C 230 10774524 http://www.s PHYSPROP
    26384 2-benzofurancO=C(O)c1cc2c 192.5 10778469 http://www.s PHYSPROP
    26385 propanoic aci BrC(C)(C)C(=O 48.5 10790335 http://www.s PHYSPROP
    26386 acetic acid, chClC(F)(F)C(=O 25 10800462 http://www.s PHYSPROP
    26387 2,5-dichlorobeOC(=O)c1cc(Cl 154.4 10801689 http://www.s PHYSPROP
    26388 hexanedioic aO=C(CCCCC(= 29 10807625 http://www.s PHYSPROP
    26389 atropic acid OC(=O)C(=C)c 106.5 10816467 http://www.s PHYSPROP
    26390 2-nitrobenza O=[N+]([O-])c 176.6 11178542 http://www.s PHYSPROP
    26391 m-nitrobenza O=[N+]([O-])c 142.7 11202219 http://www.s PHYSPROP
    26392 17a-testosteroCC3(O)CCC2C 150 11224247 http://www.s PHYSPROP
    26393 tioclomarol Clc1ccc(s1)C( 104 11236578 http://www.s PHYSPROP
    26394 acetamide, 2-O=C(Nc1ccccc1 94 11279086 http://www.s PHYSPROP
    26395 dl-bromochlorBrC(Cl)C(=O)O 31.5 11307583 http://www.s PHYSPROP
    26396 3-methylacetaO=C(C)Nc1cc( 65.5 11332993 http://www.s PHYSPROP
    26397 coumafuryl CC(=O)CC(C1= 124 11338519 http://www.s PHYSPROP
    26398 1,3-benzenedio
    Oc2cc(O)ccc2/ 200 11341372 http://www.s PHYSPROP
    26399 dithiosalicylic SC(=S)c1ccccc 49 11458117 http://www.s PHYSPROP
    26400 3-bromo-5-chOc1cc(Br)cc(Cl 70 11500604 http://www.s PHYSPROP
    26401 3-bromo-5-meCc1cc(Br)cc(O 56.5 11500605 http://www.s PHYSPROP
    26402 2,7-dichloroquClc1cc2nc(Cl) 120 11507444 http://www.s PHYSPROP
    26403 1-butanaminium
    CCCC[N](CCCC 117 11588081 http://www.s PHYSPROP
    26404 fenadiazole Oc1ccccc1c2n 111.5 11595729 http://www.s PHYSPROP
    26405 quinestradiol CC54CCC2C(CC 99 11644434 http://www.s PHYSPROP
    26406 parvaquone OC2=C(C(=O)c 135.5 11644633 http://www.s PHYSPROP
    26407 silane, trichl Cc1cc(ccc1)[Si] -26 11665582 http://www.s PHYSPROP
    26408 1,4-naphthaleO=C2c1ccccc1 216.5 12997403 http://www.s PHYSPROP
    26409 salen Oc2ccccc2/C= 127.5 13007376 http://www.s PHYSPROP
    26410 dichlorofluor ClC(Cl)(F)I -107 13221492 http://www.s PHYSPROP
    26411 3-ethyl-3-pen CCC(CC)(CC)O 2.5 13222596 http://www.s PHYSPROP
    26412 dehydroergostCC(C)C(C)/C= 146 13226527 http://www.s PHYSPROP
    26413 metrizoic acidO=C(O)c1c(I)c 281.5 13282833 http://www.s PHYSPROP
    26414 lupulon CC(C)CC(=O)C 93 13433819 http://www.s PHYSPROP
    26415 metronidazol Cc1ncc([N+]([ 160.5 13490018 http://www.s PHYSPROP
    26416 dfdd Fc1ccc(cc1)C(= 77 13597790 http://www.s PHYSPROP
    26417 clomestrone O=C2C(Cl)CC1 179.5 13598431 http://www.s PHYSPROP
    26418 c.i. solvent o Cc3ccc(/N=N/c 166 13621577 http://www.s PHYSPROP
    26419 cnicin OCC(O)C(=C)C 143 13625278 http://www.s PHYSPROP
    26420 4,6-dimethylr Cc1cc(C)c(O)c 126.5 13675391 http://www.s PHYSPROP
    26421 diethylhexaneO=C(CCCCC(= -19.8 13835108 http://www.s PHYSPROP
    26422 1-(4-chlorophO=C(C)c1ccc(C 20 13835126 http://www.s PHYSPROP
    26423 p-toluidine Cc1ccc(N)cc1 43.6 13835151 http://www.s PHYSPROP
    26424 benzenamine,Cc1ccc(N)cc1 244 13835151 http://www.s PHYSPROP x salt JCB
    26425 1,4-benzenedNc1ccc(N)cc1 146 13835179 http://www.s PHYSPROP
    26426 1,4-diaminobeNc1ccc(N)cc1 275 13835179 http://www.s PHYSPROP x salt JCB
    26427 diethylene glyOCCOCCO -10.4 13835180 http://www.s PHYSPROP
    26428 1,4-butanedioOCCCCO 20.4 13835209 http://www.s PHYSPROP
    26429 2,5,8,11-tetr COCCOCCOCC -45 13835222 http://www.s PHYSPROP
    26430 1,2-propanediCC(O)CO -60 13835224 http://www.s PHYSPROP
    26431 ethylene glycoOCCO -13 13835235 http://www.s PHYSPROP
    26432 1,3-propanedio
    CC(C)(CO)CO 130 13835293 http://www.s PHYSPROP
    26433 anthraquinon O=C2c1ccccc1 286 13835294 http://www.s PHYSPROP
    26434 2,6-di-t-butyl CC(C)(C)c1cc( 71 13835296 http://www.s PHYSPROP
    26435 1,1-dichloroe C=C(Cl)Cl -122.5 13835316 http://www.s PHYSPROP
    26436 ethanolamineNCCO 10.3 13835336 http://www.s PHYSPROP
    26437 p-methoxyaceCOc1ccc(cc1) 38.5 13835344 http://www.s PHYSPROP
    26438 toluene diisocO=C=Nc1cc(c 20 13835351 http://www.s PHYSPROP
    26439 2,4/2,6-tolue O=C=Nc1cc(c 20 13835351 http://www.s PHYSPROP
    26440 2,4-toluene d O=C=N/c1cc(c 20.5 13835351 http://www.s PHYSPROP
    26441 1,2-diethoxyeCCOCCOCC -74 13835376 http://www.s PHYSPROP
    26442 diethylenetri NCCNCCN -39 13835401 http://www.s PHYSPROP
    26443 piperazine C1CNCCN1 106 13835459 http://www.s PHYSPROP
    26444 1,2-diaminoe NCCN 11.1 13835550 http://www.s PHYSPROP
    26445 1,2,3-trihydr Oc1cccc(O)c1 133 13835557 http://www.s PHYSPROP
    26446 hexamethylenNCCCCCCN 41.5 13835579 http://www.s PHYSPROP
    26447 diethanolami OCCNCCO 28 13835604 http://www.s PHYSPROP
    26448 triethanolami OCCN(CCO)CC 20.5 13835630 http://www.s PHYSPROP
    26449 triacetin O=C(C)OC(COC 78 13835706 http://www.s PHYSPROP
    26450 o-cresol Cc1ccccc1O 29.8 13835772 http://www.s PHYSPROP
    26451 1,1-diethoxyeCC(OCC)OCC -100 13835836 http://www.s PHYSPROP
    26452 2-amino-2-metCC(C)(N)CO 25.5 13835861 http://www.s PHYSPROP
    26453 triethylene gl OCCOCCOCCO -7 13835895 http://www.s PHYSPROP
    26454 erythritol OCC(O)C(O)C 121.5 13835932 http://www.s PHYSPROP
    26455 allylamine C=CCN -88.2 13835977 http://www.s PHYSPROP
    26456 2-(methylaminCNCCO -4.5 13836021 http://www.s PHYSPROP
    26457 1,3-benzenedNc1cccc(N)c1 63.5 13836283 http://www.s PHYSPROP
    26458 2-butoxyethanCCCCOCCO -74.8 13836399 http://www.s PHYSPROP
    26459 1-propanamine,
    FC(F)(N(C(F)(F) -52 13836500 http://www.s PHYSPROP
    26460 heptacosafluoFC(F)(N(C(F)(F) -50 13836523 http://www.s PHYSPROP
    26461 1,1-difluoroe C=C(F)F -144 13836545 http://www.s PHYSPROP
    26462 hexafluorobe Fc1c(F)c(F)c(F 5.3 13836549 http://www.s PHYSPROP
    26463 ethylene glycoCOCCOC -58 13836589 http://www.s PHYSPROP
    26464 2-ethoxyethanCCOCCO -70 13836591 http://www.s PHYSPROP
    26465 3-chloropropyC=CCCl -134.5 13836674 http://www.s PHYSPROP
    26466 1-chloro-2,3- ClCC1CO1 -57.2 13837112 http://www.s PHYSPROP
    26467 (chloromethylClCC1CO1 -26 13837112 http://www.s PHYSPROP x unlikely to be higher mp than bromo anal
    26468 dimethoxymeCOCOC -104.8 13837190 http://www.s PHYSPROP
    26469 trichloroethe ClC=C(Cl)Cl -84.7 13837280 http://www.s PHYSPROP
    26470 tetrachloroet Cl/C(Cl)=C(Cl) -22.3 13837281 http://www.s PHYSPROP
    26471 diethyl phthalO=C(OCC)c1cc -40.5 13837303 http://www.s PHYSPROP
    26472 dibutyl phthalO=C(OCCCC)c1 -35 13837319 http://www.s PHYSPROP
    26473 dimethyl phthCOC(=O)c1ccc 5.5 13837329 http://www.s PHYSPROP
    26474 morpholine C1CNCCO1 -4.8 13837537 http://www.s PHYSPROP
    26475 1,2-benzenedNc1ccccc1N 102.5 13837582 http://www.s PHYSPROP
    26476 dibutyl sebacaO=C(CCCCCCC -10 13837584 http://www.s PHYSPROP
    26477 1,2-dichloroe ClCCCl -35.5 13837650 http://www.s PHYSPROP
    26478 2-chlorophenoOc1ccccc1Cl 9.8 13837686 http://www.s PHYSPROP
    26479 1,4-butanedi NCCCCN 27.5 13837702 http://www.s PHYSPROP
    26480 catechol Oc1ccccc1O 105 13837760 http://www.s PHYSPROP
    26481 2-nitrophenolO=[N+]([O-])c 44.8 13837787 http://www.s PHYSPROP
    26482 allyl ether C=CCOCC=C -6 13837797 http://www.s PHYSPROP
    26483 1,2-dichlorob Clc1ccccc1Cl -16.7 13837988 http://www.s PHYSPROP
    26484 benzene, 1-etCOc1ccccc1C= 29 13838042 http://www.s PHYSPROP
    26485 4-hydroxy-4- CC(=O)CC(C)( -44 13838151 http://www.s PHYSPROP
    26486 bromoform BrC(Br)Br 8 13838404 http://www.s PHYSPROP
    26487 2-phenylphenOc2ccccc2c1c 59 13839012 http://www.s PHYSPROP
    26488 5-methylresorCc1cc(O)cc(O) 107.5 13839080 http://www.s PHYSPROP
    26489 p-cresol Cc1ccc(O)cc1 35.5 13839082 http://www.s PHYSPROP
    26490 3,4-dimethylpCc1cc(O)ccc1 60.8 13839105 http://www.s PHYSPROP
    26491 diethylene gl OCCOCCOCC -76 13839107 http://www.s PHYSPROP
    26492 ethoxyethylacCC(=O)OCCOC -61.7 13839109 http://www.s PHYSPROP
    26493 3,5-dimethylpCc1cc(O)cc(C) 63.6 13839110 http://www.s PHYSPROP
    26494 2,4-dimethylpCc1ccc(O)c(C) 24.5 13839123 http://www.s PHYSPROP
    26495 2,5-dimethylpCc1cc(O)c(C)c 74.8 13839128 http://www.s PHYSPROP
    26496 2,3-dimethylpCc1cccc(O)c1 72.8 13839151 http://www.s PHYSPROP
    26497 2,6-dimethylpCc1cccc(C)c1 45.7 13839174 http://www.s PHYSPROP
    26498 2-methylpyridCc1ccccn1 -66.7 13839199 http://www.s PHYSPROP
    26499 2-hydroxypropCC(O)C(=O)OC -66 13839235 http://www.s PHYSPROP
    26500 phenylacetonitN#CCc1ccccc1 -23.8 13839308 http://www.s PHYSPROP
    26501 1,6-hexanedioOCCCCCCO 42.8 13839416 http://www.s PHYSPROP
    26502 1,5-pentanediOCCCCCO -18 13839441 http://www.s PHYSPROP
    26503 carbitol aceta CCOCCOCCOC( -25 13839516 http://www.s PHYSPROP
    26504 diethylene gl CCCCOCCOCC -68 13839549 http://www.s PHYSPROP
    26505 1,3-propanediOCCCO -26.7 13839553 http://www.s PHYSPROP
    26506 2-methoxyethCOCCOCCOC -68 13839575 http://www.s PHYSPROP
    26507 1,2-dithioben Sc1ccccc1S 27 13840080 http://www.s PHYSPROP
    26508 benzene-1,2-dSc1ccccc1S 28.5 13840080 http://www.s PHYSPROP
    26509 alpha-chlorot ClCc1ccccc1 -45 13840690 http://www.s PHYSPROP
    26510 p-bromophenoOc1ccc(Br)cc1 66.4 13842573 http://www.s PHYSPROP
    26511 2,6-lutidine Cc1cccc(C)n1 -6.1 13842613 http://www.s PHYSPROP
    26512 tetranitrometO=[N+]([O-])C 13.8 13842838 http://www.s PHYSPROP
    26513 b,b,b-trichlor ClC(Cl)(Cl)C(C 97 13842993 http://www.s PHYSPROP
    26514 parathion S=P(Oc1ccc(cc 6.1 13844817 http://www.s PHYSPROP
    26515 hexafluoro-2 FC(F)(F)C(=O)C -125 13846015 http://www.s PHYSPROP
    26516 hexafluoroaceFC(F)(F)C(=O)C 19.5 13846015 http://www.s PHYSPROP x hydrate JCB
    26517 perfluorocycl FC1(F)C(F)(F)C -40.1 13846040 http://www.s PHYSPROP
    26518 p-phenylphenOc1ccc(cc1)c2 166 13846658 http://www.s PHYSPROP
    26519 p-t-butylyphe CC(C)(C)c1ccc 98 13846663 http://www.s PHYSPROP
    26520 p-hydroxybenzo
    Oc1ccc(cc1)C 117 13846749 http://www.s PHYSPROP
    26521 4-nitroaniline O=[N+]([O-])c 146 13846959 http://www.s PHYSPROP
    26522 ethanol, 2-br CC(=O)OCCBr -13.8 13847616 http://www.s PHYSPROP
    26523 1,3-propanediSCCCS -79 13848090 http://www.s PHYSPROP
    26524 dimethyl succCOC(=O)CCC( 19 13848341 http://www.s PHYSPROP
    26525 2-phenoxyethOCCOc1ccccc 14 13848467 http://www.s PHYSPROP
    26526 safrole C=CCc1ccc2O 11.2 13848731 http://www.s PHYSPROP
    26527 coumarin O=C1C=Cc2cc 71 13848793 http://www.s PHYSPROP
    26528 methyl salicyl Oc1ccccc1C(= -8 13848808 http://www.s PHYSPROP
    26529 2-(4-methyl-3CC1=CCC(CC1) 33 13850142 http://www.s PHYSPROP
    26530 alpha-terpine CC1=CCC(CC1) 37.5 13850142 http://www.s PHYSPROP
    26531 2-(4-methyl-c CC1=CCC(CC1) 40.5 13850142 http://www.s PHYSPROP
    26532 benzyl acetat CC(=O)OCc1cc -51.3 13850405 http://www.s PHYSPROP
    26533 benzenemethaSCc1ccccc1 -30 13851383 http://www.s PHYSPROP
    26534 alpha-bromotBrCc1ccccc1 -3 13851576 http://www.s PHYSPROP
    26535 chloromethoxCOCCl -103.5 13852893 http://www.s PHYSPROP
    26536 1,2-dichlorot ClC(F)(F)C(Cl)( -94 13853215 http://www.s PHYSPROP
    26537 2-nitroaniline O=[N+]([O-])c 71 13853943 http://www.s PHYSPROP
    26538 2-chloro-1-ni O=[N+]([O-])c 32.5 13853953 http://www.s PHYSPROP
    26539 1-bromo-2-chBrCCCl -16.7 13854130 http://www.s PHYSPROP
    26540 o-toluidine Cc1ccccc1N -14.4 13854136 http://www.s PHYSPROP
    26541 p-aminobenzoic
    Nc1ccc(cc1)C 92 13854242 http://www.s PHYSPROP
    26542 2-chloroanilinNc1ccccc1Cl -14 13854248 http://www.s PHYSPROP
    26543 1,1-dimethox CC(OC)OC -113.2 13854808 http://www.s PHYSPROP
    26544 4-methylquinoCc1ccnc2cccc 9.5 13854818 http://www.s PHYSPROP
    26545 2-dimethylamCN(C)CCO -59 13854944 http://www.s PHYSPROP
    26546 benzaldehyde,O=Cc1ccc(F)cc -10 13854995 http://www.s PHYSPROP
    26547 3-acetylpyridiCC(=O)c1cccn 13.5 13856009 http://www.s PHYSPROP
    26548 chloroacetylchClCC(Cl)=O -22 13856283 http://www.s PHYSPROP
    26549 2-phenylethy NCCc1ccccc1 -60 13856352 http://www.s PHYSPROP
    26550 ethyl cyanoacN#CCC(=O)OC -22.5 13856579 http://www.s PHYSPROP
    26551 4-fluoronitro Fc1ccc(cc1)[N 21 13856885 http://www.s PHYSPROP
    26552 benzyl benzoaO=C(OCc1cccc 21 13856959 http://www.s PHYSPROP
    26553 ethanamine, 2NCC(OCC)OCC -78 13857397 http://www.s PHYSPROP
    26554 3-dichlorobenClc1cccc(Cl)c1 -24.8 13857694 http://www.s PHYSPROP
    26555 methyl anthraNc1ccccc1C(= 24.5 13858096 http://www.s PHYSPROP
    26556 phenacylaminO=C(C)c1cccc 20 13859235 http://www.s PHYSPROP
    26557 piperonal O=Cc1ccc2OC 37 13859497 http://www.s PHYSPROP
    26558 benzenamine,CC(C)c1cccc(C -45 13859730 http://www.s PHYSPROP
    26559 tricaine Nc1cc(ccc1)C 149.5 13860074 http://www.s PHYSPROP x salt JCB
    26560 benzyl alcoholOCc1ccccc1 -15.2 13860335 http://www.s PHYSPROP
    26561 vanillin Oc1ccc(cc1OC 81.5 13860434 http://www.s PHYSPROP
    26562 3,4-xylidine Cc1cc(N)ccc1C 51 13860491 http://www.s PHYSPROP
    26563 m-bromoanili Nc1cc(Br)ccc1 18.5 13860633 http://www.s PHYSPROP
    26564 o-ethylanilineCCc1ccccc1N -46.5 13860641 http://www.s PHYSPROP
    26565 m-toluidine Cc1cc(N)ccc1 -31.3 13860692 http://www.s PHYSPROP
    26566 3,4-dichloroanNc1cc(Cl)c(Cl) 72 13860720 http://www.s PHYSPROP
    26567 2-methoxyanilNc1ccccc1OC 6.2 13860775 http://www.s PHYSPROP
    26568 2,4-dichloroanClc1cc(Cl)c(N) 63.5 13860817 http://www.s PHYSPROP
    26569 1,2-dimethox COc1ccccc1O 22.5 13861009 http://www.s PHYSPROP
    26570 furoyl chlorid ClC(=O)c1ccco -2 13861158 http://www.s PHYSPROP
    26571 2-furancarbonClC(=O)c1ccco -2 13861158 http://www.s PHYSPROP
    26572 trichloronitr ClC(Cl)(Cl)[N+ -64 13861343 http://www.s PHYSPROP
    26573 chlorothalonilClc1c(C#N)c(Cl 250 13861400 http://www.s PHYSPROP
    26574 trichloroacetoClC(Cl)(Cl)C#N -42 13861934 http://www.s PHYSPROP
    26575 allytrichlorosi C=CC[Si](Cl)(Cl 35 13862317 http://www.s PHYSPROP
    26576 1,2,4-trichlo Clc1cc(Cl)c(Cl 17 13862559 http://www.s PHYSPROP
    26577 decafluorobu FC(F)(C(F)(F)C( -129.1 13862701 http://www.s PHYSPROP
    26578 dimethylterepCOC(=O)c1ccc 141 13863300 http://www.s PHYSPROP
    26579 o-hydroxybenO=Cc1ccccc1 -7 13863618 http://www.s PHYSPROP
    26580 fufural O=Cc1ccco1 -38.1 13863629 http://www.s PHYSPROP
    26581 diethyl malonO=C(CC(=O)O -50 13863636 http://www.s PHYSPROP
    26582 trichloroacet ClC(Cl)(Cl)C=O -57.5 13863645 http://www.s PHYSPROP
    26583 p-nitrotoluen Cc1ccc(cc1)[N 51.6 13863774 http://www.s PHYSPROP
    26584 1,2,3-trichlo Clc1cccc(Cl)c1 53.5 13864445 http://www.s PHYSPROP
    26585 2-methoxyethy
    CC(=O)OCCOC -65.1 13864773 http://www.s PHYSPROP
    26586 1,2-ethanedithSCCS -41.2 13865015 http://www.s PHYSPROP
    26587 p-tolualdehydCc1ccc(C=O)c -6 13865424 http://www.s PHYSPROP
    26588 acetoacetic esCC(=O)CC(=O -45 13865426 http://www.s PHYSPROP
    26589 p-methylanisoCc1ccc(OC)cc -32 13865438 http://www.s PHYSPROP
    26590 butanedioic acO=C(CCC(=O) -29.2 13865454 http://www.s PHYSPROP
    26591 diethyl succin O=C(CCC(=O) -21 13865630 http://www.s PHYSPROP
    26592 o-ethylphenolCCc1ccccc1O 18 13865680 http://www.s PHYSPROP
    26593 phthaloyl chloO=C(Cl)c1cccc 15.5 13865683 http://www.s PHYSPROP
    26594 cadaverine NCCCCCN 9 13866593 http://www.s PHYSPROP
    26595 pentafluorob Fc1cc(F)c(F)c( -47.3 13866746 http://www.s PHYSPROP
    26596 1,4-dichlorob Clc1ccc(Cl)cc1 52.09 13866817 http://www.s PHYSPROP
    26597 succinyl chlor ClC(=O)CCC(Cl 20 13867055 http://www.s PHYSPROP
    26598 methyl cyanoaN#CCC(=O)OC -22.5 13867413 http://www.s PHYSPROP
    26599 2,2-bipyridinec1nc(ccc1)c2c 72 13867714 http://www.s PHYSPROP
    26600 cyclohexanamiNC2CCC(CC1C 15 13868371 http://www.s PHYSPROP
    26601 cyclohexanamin
    NC2CCC(CC1C 36.5 13868371 http://www.s PHYSPROP
    26602 cyclohexanamin
    NC2CCC(CC1C 61 13868371 http://www.s PHYSPROP
    26603 cyclohexanamiNC2CCC(CC1C 64.7 13868371 http://www.s PHYSPROP
    26604 2,4-dinitroch O=[N+]([O-])c 53 13868426 http://www.s PHYSPROP
    26605 1,4-dibromobBrc1ccc(Br)cc 87.3 13868640 http://www.s PHYSPROP
    26606 benzene, 1,4- Clc1cc(C)c(Cl) 71 13868642 http://www.s PHYSPROP
    26607 4-chloroiodo Ic1ccc(Cl)cc1 57 13868660 http://www.s PHYSPROP
    26608 4-chloroanilinNc1ccc(Cl)cc1 72.5 13869339 http://www.s PHYSPROP
    26609 4-methoxyanilNc1ccc(OC)cc 57.2 13869414 http://www.s PHYSPROP
    26610 2,5-dimethylan
    Cc1cc(N)c(C)c 15.5 13869434 http://www.s PHYSPROP
    26611 3-chloroanilinNc1cc(Cl)ccc1 -10.4 13869451 http://www.s PHYSPROP
    26612 2,4-dimethylan
    Cc1ccc(N)c(C) -14.3 13869462 http://www.s PHYSPROP
    26613 m-methoxyaniNc1cccc(OC)c -1 13869480 http://www.s PHYSPROP
    26614 2-methoxy-5- Nc1cc(C)ccc1 53 13869579 http://www.s PHYSPROP
    26615 2,5-dichloroanClc1ccc(Cl)c(N 50 13869655 http://www.s PHYSPROP
    26616 2,5-dimethoxyNc1cc(ccc1OC 82.5 13869661 http://www.s PHYSPROP
    26617 2-methylquinoCc1ccc2ccccc -1.5 13870160 http://www.s PHYSPROP
    26618 trifluoroacety FC(F)(F)C(Cl)= -146 13870615 http://www.s PHYSPROP
    26619 tartaric acid, OC(C(O)C(=O) 17 13871489 http://www.s PHYSPROP
    26620 tropine CN2C1CCC2CC 64 13871816 http://www.s PHYSPROP
    26621 pseudotropin CN2C1CCC2CC 109 13871816 http://www.s PHYSPROP
    26622 arecoline hyd CN1CC(=CCC1 157.5 13872064 http://www.s PHYSPROP x salt - AL
    26623 methyl chloroClCC(=O)OC -32.1 13872667 http://www.s PHYSPROP
    26624 allyl alcohol C=CCO -129 13872989 http://www.s PHYSPROP
    26625 benzenamine,CN(C)c1ccc(Br 55 13873600 http://www.s PHYSPROP
    26626 1,3,5-trinitro O=[N+]([O-])c 121.5 13873689 http://www.s PHYSPROP
    26627 hexachloroac ClC(Cl)(Cl)C(=O -2 13873693 http://www.s PHYSPROP
    26628 4-methylpyridCc1ccncc1 3.66 13874733 http://www.s PHYSPROP
    26629 methyl acetoaCC(=O)CC(=O) -80 13874867 http://www.s PHYSPROP
    26630 o-fluorotolue Cc1ccccc1F -62 13875158 http://www.s PHYSPROP
    26631 p-chlorotolue Cc1ccc(Cl)cc1 7.5 13875160 http://www.s PHYSPROP
    26632 1-bromo-2,4,5Cc1cc(C)c(Br) 73 13875161 http://www.s PHYSPROP
    26633 p-bromofluor Fc1ccc(Br)cc1 -17.4 13875180 http://www.s PHYSPROP
    26634 p-fluoroanisolFc1ccc(OC)cc1 -45 13875196 http://www.s PHYSPROP
    26635 o-chloroanisoCOc1ccccc1Cl -26.8 13875198 http://www.s PHYSPROP
    26636 3-fluoroanilin Fc1cccc(N)c1 -5 13875208 http://www.s PHYSPROP
    26637 o-dibromobenBrc1ccccc1Br 7.1 13875212 http://www.s PHYSPROP
    26638 4-chlorophenoOc1ccc(Cl)cc1 42.8 13875219 http://www.s PHYSPROP
    26639 m-chlorotolu Cc1cc(Cl)ccc1 -47.8 13875230 http://www.s PHYSPROP
    26640 p-bromotolueCc1ccc(Br)cc1 28.5 13875258 http://www.s PHYSPROP
    26641 benzene, 1-brCc1ccc(Br)c(C -17 13875259 http://www.s PHYSPROP
    26642 2-chlorotolue Cc1ccccc1Cl -35.6 13875281 http://www.s PHYSPROP
    26643 p-fluorotolue Cc1ccc(F)cc1 -56 13875283 http://www.s PHYSPROP
    26644 o-bromotolueCc1ccccc1Br -27.8 13875320 http://www.s PHYSPROP
    26645 trifluorometh FC(F)(F)c1cc(F -81.5 13875325 http://www.s PHYSPROP
    26646 benzene, 1-chCc1ccc(Cl)c(C) -32.5 13875329 http://www.s PHYSPROP
    26647 m-dibromobeBrc1cccc(Br)c -7 13875356 http://www.s PHYSPROP
    26648 benzene, 4-brCc1cc(Br)ccc1 -0.2 13875357 http://www.s PHYSPROP
    26649 benzene, 2-chCc1cc(Cl)c(C)c 1.6 13875362 http://www.s PHYSPROP
    26650 m-fluorotolueCc1cc(F)ccc1 -87 13875376 http://www.s PHYSPROP
    26651 m-bromochlorClc1cc(Br)ccc1 -21.5 13875377 http://www.s PHYSPROP
    26652 benzene, 2-chCc1cccc(C)c1C -35 13875381 http://www.s PHYSPROP
    26653 m-bromotolu Cc1cc(Br)ccc1 -39.8 13875392 http://www.s PHYSPROP
    26654 3-chlorophenoOc1cc(Cl)ccc1 33.5 13875432 http://www.s PHYSPROP
    26655 m-bromophenOc1cc(Br)ccc1 33 13875441 http://www.s PHYSPROP
    26656 2-fluoroanisolFc1ccccc1OC -39 13875445 http://www.s PHYSPROP
    26657 eugenol Oc1ccc(cc1OC -9.1 13876103 http://www.s PHYSPROP
    26658 3-butenenitrilC=CCC#N -87 13876176 http://www.s PHYSPROP
    26659 phenylacetal O=CCc1ccccc1 33.5 13876539 http://www.s PHYSPROP
    26660 adiponitrile N#CCCCCC#N 1 13876621 http://www.s PHYSPROP
    26661 1-bromo-2-meCOc1ccccc1Br 2.5 13881329 http://www.s PHYSPROP
    26662 benzene, 4-brClc1cc(Br)ccc1 25 13881395 http://www.s PHYSPROP
    26663 4-bromoanisoCOc1ccc(Br)cc 13.5 13881571 http://www.s PHYSPROP
    26664 2,2'-thiobiset OCCSCCO -10.2 13881956 http://www.s PHYSPROP
    26665 diethylene glyCCCCOCCOCC -60 13881964 http://www.s PHYSPROP
    26666 (dichloromethClC(Cl)c1ccccc -17 13882337 http://www.s PHYSPROP
    26667 benzotrichlor ClC(Cl)(Cl)c1c -5 13882366 http://www.s PHYSPROP
    26668 2-ethoxyethylCCOCCOC(=O) -47 13882938 http://www.s PHYSPROP
    26669 n,n-dimethyl- Nc1ccc(cc1)N( 53 13884246 http://www.s PHYSPROP
    26670 malononitrile N#CCC#N 32 13884495 http://www.s PHYSPROP
    26671 2-methyl-2,4-CC(O)CC(C)(C -50 13884973 http://www.s PHYSPROP
    26672 benzeneaceticO=C(OCC)Cc1c -29.4 13885245 http://www.s PHYSPROP
    26673 dehydroaceticO=C(C)C1C(=O 109 13887609 http://www.s PHYSPROP
    26674 naphthalene, FC2(F)C1(F)C(F -10 13888074 http://www.s PHYSPROP
    26675 flavaspidic aciOC2=C(Cc1c(O 156 13919894 http://www.s PHYSPROP
    26676 ethanedione, d
    ON=C(/C(=N/O 167 13941050 http://www.s PHYSPROP
    26677 1-nitro-2-chl [O-][N+](=O)c 99.5 13994696 http://www.s PHYSPROP
    26678 trimethylaminCN(C)(C)Cl 277.5 14126204 http://www.s PHYSPROP x salt - AL
    26679 5,6-dichloro- Clc1ccc2c(c1 181 14415899 http://www.s PHYSPROP
    26680 stearyl hydro CCCCCCCCCC 49.5 14446603 http://www.s PHYSPROP
    26681 5-oxo-4,5-dihyO=C(O)C1=CO 164 14482627 http://www.s PHYSPROP
    26682 1,4-naphthalen
    CC(=O)Oc2c1c 138 14604427 http://www.s PHYSPROP
    26683 silane, methyltCc1ccc(cc1)[Si 92 14615742 http://www.s PHYSPROP
    26684 ambuside O=S(N)(=O)c1 206 14679165 http://www.s PHYSPROP
    26685 flurandrenoli OCC(=O)C54OC 251 14691251 http://www.s PHYSPROP
    26686 cyproterone aCC(=O)C3(O) 200.5 14828857 http://www.s PHYSPROP
    26687 3-hydroxypyriOC=1/C=C\CN 191 14919704 http://www.s PHYSPROP
    26688 ethylidene di OC=1c4ccccc4 178 15148687 http://www.s PHYSPROP
    26689 cinchotoxine C=CC3CNCCC3C 59 15248088 http://www.s PHYSPROP
    26690 benzene, 1-meO=[N+]([O-])C 11.5 15291036 http://www.s PHYSPROP
    26691 thiocarbamic aNC(=O)SCC 109 15365993 http://www.s PHYSPROP
    26692 phenol, 3-metOc2cc(C)c(/N= 109 15438609 http://www.s PHYSPROP
    26693 dichlorprop-isClc1cc(Cl)cc -37 15538491 http://www.s PHYSPROP
    26694 2-chloro-8-meCc1cccc2ccc(C 61 15564506 http://www.s PHYSPROP
    26695 n-(tetrahydro O=C(C)ONC1C 112 15941973 http://www.s PHYSPROP
    26696 phosphonium,CCCCP(Cl)(CC 81.5 16371430 http://www.s PHYSPROP
    26697 bisbentiamineNc4nc(C)ncc4 146.5 16735701 http://www.s PHYSPROP
    26698 butorphanol Oc3ccc4C[C@ 216 16735714 http://www.s PHYSPROP
    26699 filicinic acid OC1=CC(=O)C= 214.5 16735811 http://www.s PHYSPROP
    26700 julocrotine CC(CC)C(=O)N 108.5 16735867 http://www.s PHYSPROP
    26701 phenicin OC2=C(C1=C(O 230 16735961 http://www.s PHYSPROP
    26702 gamma-hexach
    Cl[C@H]1[C@@ 112.5 16736910 http://www.s PHYSPROP
    26703 hematoporphyO=C(O)CCc2c( 172.5 16739170 http://www.s PHYSPROP
    26704 phosphorus suS=P(=S)SP(=S) 285 17293221 http://www.s PHYSPROP
    26705 hydrocortisonOCC(=O)[C@@ 218.5 17956308 http://www.s PHYSPROP
    26706 trifluoroboronFB(F)(F)O(CC) -60.4 17983029 http://www.s PHYSPROP
    26707 1,2-cyclohexaON=C1CCCCC 192 17983039 http://www.s PHYSPROP
    26708 1,2,3-trichlo Cc1cc(Cl)c(Cl) 45.5 18976129 http://www.s PHYSPROP
    26709 2,1,3-benzothc1cccc2nsnc1 43 19048445 http://www.s PHYSPROP
    26710 p-mercaptophO=C1C=CC(=S 29.5 19066718 http://www.s PHYSPROP
    26711 2-phenylbenziC1=CC=CC2=NC 293 19127843 http://www.s PHYSPROP
    26712 5-bromosalicylOC(=O)c1c(O) 169.8 19887395 http://www.s PHYSPROP
    26713 calcitriol C=C1C(/CC(O) 115 20117947 http://www.s PHYSPROP
    26714 naltrexone O=C1CC[C@@] 169 20121362 http://www.s PHYSPROP
    26715 1-xylylazo-2- Cc3cc(/N=N/c1 153 20152670 http://www.s PHYSPROP
    26716 amitraz Cc2ccc(/N=CN( 86 20171809 http://www.s PHYSPROP
    26717 4,4'-dipyridyl c1cc(ccn1)c2c 111 21105699 http://www.s PHYSPROP
    26718 3-hydroxybenO=Cc1cc(O)cc 108 21105795 http://www.s PHYSPROP
    26719 o-vanillin Oc1c(cccc1OC 44.5 21105848 http://www.s PHYSPROP
    26720 acetoin CC(=O)C(C)O 15 21105851 http://www.s PHYSPROP
    26721 3-isothiocyan C=CCN=C=S -80 21105854 http://www.s PHYSPROP
    26722 4-(2-propenylOc1ccc(CC=C) 15.8 21105856 http://www.s PHYSPROP
    26723 p-methoxybenz
    COc1ccc(CO)c 25 21105859 http://www.s PHYSPROP
    26724 phenol, 2-metCc1ccc(cc1O)C 1 21105867 http://www.s PHYSPROP
    26725 cinnamyl alcoOCC=Cc1ccccc 33 21105870 http://www.s PHYSPROP
    26726 m-cresol Cc1cc(O)ccc1 11.8 21105871 http://www.s PHYSPROP
    26727 dibenzyl etherC(OCc1ccccc1) 3.6 21105876 http://www.s PHYSPROP
    26728 p-dimethoxybCOc1ccc(OC)c 59 21105878 http://www.s PHYSPROP
    26729 dibenzyl keto O=C(Cc1ccccc 35 21105887 http://www.s PHYSPROP
    26730 benzaldehyde,CCOc1ccc(cc1 13.5 21105889 http://www.s PHYSPROP
    26731 ethyl 2-hydro Oc1ccccc1C(= 1 21105897 http://www.s PHYSPROP
    26732 5-ethyl-2-metCCc1cnc(C)cc1 -70.9 21105900 http://www.s PHYSPROP
    26733 3-ethylpyridinCCc1cccnc1 -76.9 21105905 http://www.s PHYSPROP
    26734 o-hydroxyace O=C(C)c1cccc 5 21105920 http://www.s PHYSPROP
    26735 benzenemethan
    OCc1ccc(cc1)C 28 21105932 http://www.s PHYSPROP
    26736 4-methyl-2-mOc1ccc(C)cc1 5.5 21105936 http://www.s PHYSPROP
    26737 p-anisaldehydCOc1ccc(C=O) 0 21105937 http://www.s PHYSPROP
    26738 cinnamic acid,O=C(/C=C/c1c 36 21105944 http://www.s PHYSPROP
    26739 2-methylanisoCc1ccccc1OC -34.1 21105959 http://www.s PHYSPROP
    26740 b-phenylethylCC(=O)OCCc1c -31.1 21105987 http://www.s PHYSPROP
    26741 thymol CC(C)c1ccc(C) 51.5 21105998 http://www.s PHYSPROP
    26742 2-methylbenzeCc1ccccc1S 15 21105999 http://www.s PHYSPROP
    26743 benzaldehyde,COc1cc(ccc1O 43 21106008 http://www.s PHYSPROP
    26744 3-chloro-nitr O=[N+]([O-])c 46 21106013 http://www.s PHYSPROP
    26745 2-chlorobenz O=Cc1ccccc1C 12.4 21106014 http://www.s PHYSPROP
    26746 2-chloroethanClCCO -67.5 21106015 http://www.s PHYSPROP
    26747 bis(2-chloroetClCCOCCCl -51.9 21106016 http://www.s PHYSPROP
    26748 4-chloro-3,5- Oc1cc(C)c(Cl)c 115 21106017 http://www.s PHYSPROP
    26749 3-methyl-4-chOc1ccc(Cl)c(C 67 21106018 http://www.s PHYSPROP
    26750 4-chlorobenz O=Cc1ccc(Cl)c 47.5 21106019 http://www.s PHYSPROP
    26751 p-chloronitro O=[N+]([O-])c 83.5 21106020 http://www.s PHYSPROP
    26752 benzenamine,Nc1ccc(OC)cc 29.5 21106028 http://www.s PHYSPROP
    26753 3-cyclohexeneO=CC1CC=CCC 2 21106029 http://www.s PHYSPROP
    26754 1,4-dichlorob ClCCCCCl -37.3 21106032 http://www.s PHYSPROP
    26755 2,2-dimethox CC(C)(OC)OC -47 21106033 http://www.s PHYSPROP
    26756 2,4-dichloron O=[N+]([O-])c1 34 21106035 http://www.s PHYSPROP
    26757 benzene, 2,4-dFc1cc(F)ccc1[ 9.8 21106036 http://www.s PHYSPROP
    26758 1-fluoro-2,4- Fc1ccc(cc1[N+ 25.8 21106037 http://www.s PHYSPROP
    26759 p-tert-amylphOc1ccc(cc1)C( 95 21106091 http://www.s PHYSPROP
    26760 dl-2,3-butandiCC(O)C(C)O 7.6 21106093 http://www.s PHYSPROP
    26761 2,3-butanedioCC(O)C(C)O 25 21106093 http://www.s PHYSPROP
    26762 2,3-butanedioCC(O)C(C)O 33 21106093 http://www.s PHYSPROP
    26763 3,4-dichloron Clc1ccc(cc1Cl) 43 21106095 http://www.s PHYSPROP
    26764 propanedioic aO=C(OC)CC(= -61.9 21106102 http://www.s PHYSPROP
    26765 ethyl-m-nitro O=[N+]([O-])c 47 21106111 http://www.s PHYSPROP
    26766 o-aminobenzoic
    Nc1ccccc1C(= 13 21106112 http://www.s PHYSPROP
    26767 4-hexylresorciOc1cc(O)ccc1 68 21106121 http://www.s PHYSPROP
    26768 phenol, 3-(ph Oc2cccc(Nc1cc 81.5 21106124 http://www.s PHYSPROP
    26769 hydroxyaceto CC(=O)CO -17 21106125 http://www.s PHYSPROP
    26770 3-iodonitrobeIc1cccc(c1)[N+ 38.5 21106127 http://www.s PHYSPROP
    26771 2-methoxy-4-(Oc1ccc(cc1OC -10 21106129 http://www.s PHYSPROP
    26772 phenol, 2-meth
    Oc1ccc(cc1OC 33.5 21106129 http://www.s PHYSPROP
    26773 2-methyl-3-buC#CC(C)(C)O 3 21106133 http://www.s PHYSPROP
    26774 m-methylanisCc1cc(OC)ccc -47 21106135 http://www.s PHYSPROP
    26775 benzoyl chlor COc1ccc(cc1)C 22 21106136 http://www.s PHYSPROP
    26776 methyleugenoCOc1cc(ccc1O -4 21106140 http://www.s PHYSPROP
    26777 4-allyl-1,2-d COc1cc(ccc1O 70 21106140 http://www.s PHYSPROP
    26778 di-2-chloroethClCCSCCCl 13.5 21106142 http://www.s PHYSPROP
    26779 2-nitrotoluen Cc1ccccc1[N+] -10 21106144 http://www.s PHYSPROP
    26780 3-nitroaceto O=[N+]([O-])c 81 21106145 http://www.s PHYSPROP
    26781 3-nitrotoluen Cc1cc(ccc1)[N 15.5 21106146 http://www.s PHYSPROP
    26782 p-nitroanisoleCOc1ccc(cc1)[ 54 21106148 http://www.s PHYSPROP
    26783 p-ethoxyanili CCOc1ccc(N)c 2.4 21106155 http://www.s PHYSPROP
    26784 1,2,3,4-tetra Fc1ccc(F)c(F)c -42 21106162 http://www.s PHYSPROP
    26785 1,2,4,5-tetra Clc1cc(Cl)c(Cl 139.5 21106163 http://www.s PHYSPROP
    26786 2,2,3,3-tetraf FC(F)C(F)(F)C -15 21106164 http://www.s PHYSPROP
    26787 4-methylbenzoN#Cc1ccc(C)c 29.5 21106167 http://www.s PHYSPROP
    26788 2,2,2-trifluor FC(F)(F)CO -43.5 21106169 http://www.s PHYSPROP
    26789 benzenamine,Brc1cc(Br)cc( 122 21106171 http://www.s PHYSPROP
    26790 2,4,6-trichlor Clc1cc(Cl)cc(C 69 21106172 http://www.s PHYSPROP
    26791 paraldehyde CC1OC(C)OC( 12.6 21106173 http://www.s PHYSPROP
    26792 2,4,6-collidineCc1cc(C)cc(C) -46 21106174 http://www.s PHYSPROP
    26793 triethylenete NCCNCCNCCN 12 21106175 http://www.s PHYSPROP
    26794 trifluoroaceti FC(F)(F)C(=O) -65 21106178 http://www.s PHYSPROP
    26795 trifluorometh FC(F)F -155.1 21106179 http://www.s PHYSPROP
    26796 titanium isoprCC(C)O[Ti](OC 20 21106214 http://www.s PHYSPROP x metal - AL
    26797 anabasine n1cc(ccc1)C2 9 21106257 http://www.s PHYSPROP
    26798 1,3-benzodioxCOc1cc(CC=C) 29.5 21106259 http://www.s PHYSPROP
    26799 isosafrole CC=Cc1ccc2O 8.2 21106329 http://www.s PHYSPROP
    26800 phenothiazinec1ccc2Sc3ccc 187.5 21106365 http://www.s PHYSPROP
    26801 1-phenyl-2-p O=C(C)Cc1ccc -15 21106366 http://www.s PHYSPROP
    26802 1,1-dichloro-2Cl/C(Cl)=C(F)F -116 21106435 http://www.s PHYSPROP
    26803 pentanedinitriN#CCCCC#N -29 21106442 http://www.s PHYSPROP
    26804 propargyl alcoC#CCO -50 21106466 http://www.s PHYSPROP
    26805 quinoxaline c1cccc2nccnc 28 21106470 http://www.s PHYSPROP
    26806 succinonitrile N#CCCC#N 54.5 21106481 http://www.s PHYSPROP
    26807 bis(chlorometh
    ClCOCCl -41.5 21106500 http://www.s PHYSPROP
    26808 chloroacetald ClCC=O -16.3 21106502 http://www.s PHYSPROP
    26809 1,2:3,4-diepo C1OC1C2CO2 -19 21106504 http://www.s PHYSPROP
    26810 1,2:3,4-diepo C1OC1C2CO2 3 21106504 http://www.s PHYSPROP
    26811 diepoxybutanC1OC1C2CO2 4 21106504 http://www.s PHYSPROP
    26812 1,2:3,4-diepoxC1OC1C2CO2 4 21106504 http://www.s PHYSPROP
    26813 bis(2-ethylhexCCC(CCCC)COC -55 21106505 http://www.s PHYSPROP
    26814 bis(4-dimeth CN(C)c2ccc(Cc 91.5 21106506 http://www.s PHYSPROP
    26815 2,4,5-trimethyCc1cc(C)c(N)c 68 21106508 http://www.s PHYSPROP
    26816 dichloroaceta ClC(Cl)C=O -37.5 21106511 http://www.s PHYSPROP
    26817 1,3-dichloroa ClCC(=O)CCl 45 21106513 http://www.s PHYSPROP
    26818 tribromoacet BrC(Br)(Br)C= -57.5 21106514 http://www.s PHYSPROP
    26819 methyl pentynC#CC(C)(O)CC -31 21106516 http://www.s PHYSPROP
    26820 3,4-dichlorot Cc1cc(Cl)c(Cl) -15.2 21106517 http://www.s PHYSPROP
    26821 m-aminoacet O=C(C)c1cc(N) 98.5 21106518 http://www.s PHYSPROP
    26822 3-methylpyridCc1cccnc1 -18.1 21106520 http://www.s PHYSPROP
    26823 2-fluor-benza O=Cc1ccccc1F -44.5 21106521 http://www.s PHYSPROP
    26824 2,3-dihydrobec1cccc2OCCc1 -21.5 21106522 http://www.s PHYSPROP
    26825 2-methylbenzoN#Cc1ccccc1C -13.5 21106523 http://www.s PHYSPROP
    26826 p-ethylanilineCCc1ccc(N)cc1 -4.8 21106525 http://www.s PHYSPROP
    26827 1,5-dichlorop ClCCCCCCl -72.8 21106526 http://www.s PHYSPROP
    26828 pentafluor-beFc1c(C=O)c(F)c 20 21106527 http://www.s PHYSPROP
    26829 2,3,4,5,6-pentFc1c(F)c(F)c(F 35.5 21106528 http://www.s PHYSPROP
    26830 ethanone, 1-(2O=C(C)c1ccc(C 33.5 21106529 http://www.s PHYSPROP
    26831 2,3,4-trimet COc1c(OC)c(c 15.8 21106530 http://www.s PHYSPROP
    26832 4-octylaniline Nc1ccc(CCCCC 20 21106531 http://www.s PHYSPROP
    26833 2-hydroxypropN#CC(C)O -40 21106532 http://www.s PHYSPROP
    26834 pyromellitic dO=C2OC(=O)c1 152.5 21106533 http://www.s PHYSPROP
    26835 2-ethyl-1,3-heCCCC(O)C(CC) -40 21106534 http://www.s PHYSPROP
    26836 1,3-dichloro- ClCC(O)CCl -4 21106535 http://www.s PHYSPROP
    26837 ethylene glycoCC(=O)OCCOC -31 21106536 http://www.s PHYSPROP
    26838 1,1-ethanediolCC(=O)OC(C)O 18.9 21106538 http://www.s PHYSPROP
    26839 2,6-diethylaniCCc1cccc(CC) 3.5 21106539 http://www.s PHYSPROP
    26840 1,2,3,4-tetra Clc1ccc(Cl)c(C 47.5 21106540 http://www.s PHYSPROP
    26841 benzoic acid, Clc1cc(ccc1)C 21 21106541 http://www.s PHYSPROP
    26842 4-ethylpyridinCCc1ccncc1 -90.5 21106560 http://www.s PHYSPROP
    26843 diallylamine C=CCNCC=C -88.4 21106561 http://www.s PHYSPROP
    26844 1-bromo-4-et CCc1ccc(Br)cc -43.5 21106562 http://www.s PHYSPROP
    26845 pentachlorob Clc1cc(Cl)c(Cl) 86 21106570 http://www.s PHYSPROP
    26846 1,2,3,5-tetra Clc1cc(Cl)c(Cl) 54.5 21106571 http://www.s PHYSPROP
    26847 2,3,5,6-tetra Clc1c([N+]([O- 99.5 21106573 http://www.s PHYSPROP
    26848 2,3-dichloron Clc1c(cccc1Cl) 61.5 21106574 http://www.s PHYSPROP
    26849 2,4,5-trichlor Clc1cc([N+]([O 57.5 21106575 http://www.s PHYSPROP
    26850 2-nitrobiphenO=[N+]([O-])c 37.2 21106576 http://www.s PHYSPROP
    26851 3,4-dichlorob Clc1ccc(C=O)c 44 21106577 http://www.s PHYSPROP
    26852 3,5-dimethylan
    Cc1cc(N)cc(C) 9.8 21106578 http://www.s PHYSPROP
    26853 p-nitroaceto O=[N+]([O-])c 81.8 21106581 http://www.s PHYSPROP
    26854 bis (2-ethoxy CCOCCOCCOC -45 21106583 http://www.s PHYSPROP
    26855 methyl styryl CC(=O)/C=C/c 41.5 21106584 http://www.s PHYSPROP
    26856 4-phenyl-but-CC(=O)/C=C/c 42 21106584 http://www.s PHYSPROP
    26857 n,n,n',n'-tet CN(C)c1ccc(cc 51 21106585 http://www.s PHYSPROP
    26858 ethanone, 1-( Oc1ccc(cc1OC 115 21106900 http://www.s PHYSPROP
    26859 benzene, 2,4- Brc1c(C)cc(C)c 65.5 21107500 http://www.s PHYSPROP
    26860 benzoic acid, CNc1ccccc1C( 19 21108245 http://www.s PHYSPROP
    26861 benzene, 1-fl Fc1ccc(I)cc1 -27 21108548 http://www.s PHYSPROP
    26862 1,2,4,5-tetra Fc1cc(F)c(F)cc 4.5 21108549 http://www.s PHYSPROP
    26863 p-difluorobenFc1ccc(F)cc1 -13 21108550 http://www.s PHYSPROP
    26864 4-aminoacetoO=C(C)c1ccc(N 106 21108576 http://www.s PHYSPROP
    26865 p-anisic acid, COc1ccc(cc1) 49 21108577 http://www.s PHYSPROP
    26866 p-nitrobiphenO=[N+]([O-])c 114 21109008 http://www.s PHYSPROP
    26867 pinacol CC(C)(O)C(C)( 43 21109330 http://www.s PHYSPROP
    26868 benzene, 1,3, COc1cc(cc(OC 54.5 21111723 http://www.s PHYSPROP
    26869 m-methoxyacCOc1cc(ccc1) 95.5 21111758 http://www.s PHYSPROP x clearly out of range JCB
    26870 3-aminopyridiNc1cccnc1 64.5 21111768 http://www.s PHYSPROP
    26871 2,4,5-trichlor Nc1cc(Cl)c(Cl) 96.5 21111772 http://www.s PHYSPROP
    26872 benzenamine,Cc1cc(C)c(N)c -5 21111773 http://www.s PHYSPROP
    26873 benzene, 1,4- CCOc1ccc(cc1 72 21111774 http://www.s PHYSPROP
    26874 1-chloro-2-c Clc1ccccc1CC 24 21111776 http://www.s PHYSPROP
    26875 benzaldehydeCOc1ccccc1C 37.5 21111781 http://www.s PHYSPROP
    26876 nicotinic acid COC(=O)c1ccc 42.5 21111785 http://www.s PHYSPROP
    26877 3-bromo-1-ni O=[N+]([O-])c 56 21111786 http://www.s PHYSPROP
    26878 1,3,5-trifluor Fc1cc(F)cc(F)c -5.5 21111798 http://www.s PHYSPROP
    26879 benzene, 1,2, COc1c(cccc1O 48.5 21111804 http://www.s PHYSPROP
    26880 benzene, 1-chlCCc1ccccc1Cl -82.7 21111805 http://www.s PHYSPROP
    26881 m-difluorobe Fc1cccc(F)c1 -69 21111806 http://www.s PHYSPROP
    26882 2,3-dichloroanNc1cccc(Cl)c1 24 21111810 http://www.s PHYSPROP
    26883 o-aminothiop Nc1ccccc1S 26 21111815 http://www.s PHYSPROP
    26884 o-bromoanilinNc1ccccc1Br 32 21111816 http://www.s PHYSPROP
    26885 benzaldehydeO=Cc1ccccc1B 21.5 21111817 http://www.s PHYSPROP
    26886 m-chlorobenzO=Cc1cc(Cl)cc 17.5 21111819 http://www.s PHYSPROP
    26887 3-methylthio Cc1ccsc1 -69 21111820 http://www.s PHYSPROP
    26888 4-methylbenzeCc1ccc(S)cc1 43 21111822 http://www.s PHYSPROP
    26889 3-methylbenzeCc1cc(S)ccc1 -20 21111833 http://www.s PHYSPROP
    26890 2,5-dichloro- O=Cc1cc(Cl)cc 58 21111840 http://www.s PHYSPROP
    26891 m-aminobenzon
    N#Cc1cc(N)cc 54.3 21111842 http://www.s PHYSPROP
    26892 phenol, 4-(ph Oc2ccc(Nc1ccc 73 21111849 http://www.s PHYSPROP
    26893 2,5-dichloron O=[N+]([O-])c1 56 21111865 http://www.s PHYSPROP
    26894 1-bromo-2-et CCc1ccccc1Br -67.9 21111882 http://www.s PHYSPROP
    26895 benzene, 1-brBrc1ccc(OCC) 4 21111894 http://www.s PHYSPROP
    26896 benzene, 1,2- ClCc1ccccc1CC 55 21111896 http://www.s PHYSPROP
    26897 2,4-dichlorot Clc1cc(Cl)c(C) -13.5 21111905 http://www.s PHYSPROP
    26898 1-chloro-2-fl Fc1ccccc1Cl -43 21111912 http://www.s PHYSPROP
    26899 4-methoxy-1-m
    COc1ccc(C)c(c 17 21111914 http://www.s PHYSPROP
    26900 4-fluoroacet O=C(C)c1ccc(F -45 21112023 http://www.s PHYSPROP
    26901 1a-hydroxychoC=C1C(/CC(O) 136 21112029 http://www.s PHYSPROP
    26902 cortisone acetCC(=O)OCC(= 222 21112101 http://www.s PHYSPROP
    26903 benzene, 2-brCc1cc(C)c(Br)c -1 21112244 http://www.s PHYSPROP
    26904 naphthalen-2-y
    N#CCc1ccc2cc 83 21112279 http://www.s PHYSPROP
    26905 benzonitrile, COc1ccc(C#N) 61.5 21112332 http://www.s PHYSPROP
    26906 m-cyanobenazO=Cc1cccc(C# 76.5 21112367 http://www.s PHYSPROP
    26907 2,3,5,6-tetraf Fc1cc(F)c(F)c( 31.5 21112533 http://www.s PHYSPROP
    26908 chloroacetic ClCC(=O)OC(= 46 21112535 http://www.s PHYSPROP
    26909 benzene, 1,4- BrCc1ccc(CBr) 144.5 21125563 http://www.s PHYSPROP
    26910 2,4-dimethylpCc1ccnc(C)c1 -64 21132380 http://www.s PHYSPROP
    26911 diphosgene ClC(=O)OC(Cl)( -57 21154424 http://www.s PHYSPROP
    26912 benzenamine,Nc1ccc(Cl)cc1 52 21159424 http://www.s PHYSPROP
    26913 benzoic acid, COc1ccc(cc1) 7.5 21159425 http://www.s PHYSPROP
    26914 4-ethylnitrob O=[N+]([O-])c -12.3 21159433 http://www.s PHYSPROP
    26915 4-hydroxydip Oc2ccc(Cc1ccc 84 21159439 http://www.s PHYSPROP
    26916 n-benzylanilinC(Nc1ccccc1)c 37.5 21159445 http://www.s PHYSPROP
    26917 benzeneacetalO=CCc1ccc(C) 40 21159447 http://www.s PHYSPROP
    26918 ethanol, 2-(et CCSCCO -100 21159459 http://www.s PHYSPROP
    26919 m-tolylacetat O=C(C)Oc1cc( 12 21159480 http://www.s PHYSPROP
    26920 m-methylpheny
    O=C(C)Oc1cc( 62 21159480 http://www.s PHYSPROP
    26921 ethanone, 1-(2Cc1cc(C)c(C)c 10.5 21159574 http://www.s PHYSPROP
    26922 acenaphthylenBrc1ccc3CCc2 52 21159578 http://www.s PHYSPROP
    26923 benzenamine,Brc1ccc(cc1)N 38 21159579 http://www.s PHYSPROP
    26924 ethanone, 1-( Cc1ccc(C)cc1C -18.1 21159593 http://www.s PHYSPROP
    26925 benzoic acid, COc1cc(ccc1O 60.8 21159598 http://www.s PHYSPROP
    26926 glycine, n-phen
    O=C(CNc1cccc 58 21159611 http://www.s PHYSPROP
    26927 1,2,3,5-tetra Fc1cc(F)c(F)c( -48 21159625 http://www.s PHYSPROP
    26928 benzene, 1-chCC(C)c1ccc(Cl -12.3 21159680 http://www.s PHYSPROP
    26929 2,3-dimethylaCc1c(C)cccc1 29 21159742 http://www.s PHYSPROP
    26930 benzeneaceton
    N#CCc1ccc(C) 18 21159744 http://www.s PHYSPROP
    26931 benzofuran, 7Cc1cccc2ccoc 109 21160526 http://www.s PHYSPROP
    26932 ethanone, 1-( COc1cc(ccc1O 51 21168556 http://www.s PHYSPROP
    26933 bromopentaflFc1c(F)c(F)c(F -31 21168727 http://www.s PHYSPROP
    26934 benzene, 1-fl Fc1ccccc1I -41.5 21168731 http://www.s PHYSPROP
    26935 3-fluoronitro Fc1cccc(c1)[N 41 21168762 http://www.s PHYSPROP
    26936 benzoic acid, 4Fc1ccc(cc1)C 26 21168776 http://www.s PHYSPROP
    26937 benzaldehyde,Cc1cc(C)cc(C) 14 21168786 http://www.s PHYSPROP
    26938 2-methylthio Cc1cccs1 -63.4 21168808 http://www.s PHYSPROP
    26939 benzenamine,CN(C)c1cccc(c 60.5 21168823 http://www.s PHYSPROP
    26940 benzene, 1-chClc1ccc(OCC)c 21 21168832 http://www.s PHYSPROP
    26941 benzene, (2-c ClCCOc1ccccc 28 21168833 http://www.s PHYSPROP
    26942 1,3-diiodobenIc1cccc(I)c1 40.4 21168837 http://www.s PHYSPROP
    26943 1,3-(bis-chlo ClCc1cccc(CCl 34.2 21168838 http://www.s PHYSPROP
    26944 2-hydroxy-4- O=Cc1cc(ccc1 4 21168855 http://www.s PHYSPROP
    26945 2-bromo-4,6-dClc1cc(Cl)cc(B 83.5 21168862 http://www.s PHYSPROP
    26946 n-methylpentFc1c(C)c(F)c(F -29.8 21168888 http://www.s PHYSPROP
    26947 alantolactoneCC1CCCC2(C)C 76 21169333 http://www.s PHYSPROP
    26948 colfosceril pa O=C(OC(COP( 234 21169349 http://www.s PHYSPROP
    26949 pentanoic acidO=C(CC(=O)OC -9 21169498 http://www.s PHYSPROP
    26950 ethanone, 2,2O=C(C(Cl)Cl)c 20.5 21169500 http://www.s PHYSPROP
    26951 2-propenenitriC=C(Cl)C#N -65 21169501 http://www.s PHYSPROP
    26952 2,6-dibromoanBrc1cccc(Br)c 87.5 21169503 http://www.s PHYSPROP
    26953 4,4'-difluorob Fc1ccc(cc1)c2 94.5 21169511 http://www.s PHYSPROP
    26954 3-methyl-4-acO=C(C)c1ccc( 128 21169891 http://www.s PHYSPROP
    26955 2-ethylnitrob O=[N+]([O-])c -12.3 21169893 http://www.s PHYSPROP
    26956 (4-methoxyphCOc2ccc(/N=N 56 21169898 http://www.s PHYSPROP
    26957 choline alfosc OC(COP(O)(=O 142.5 21169903 http://www.s PHYSPROP
    26958 ethanone, 1-( O=C(C)c1ccc( 21 21170123 http://www.s PHYSPROP
    26959 1-bromo-2,4- Clc1ccc(Br)c(C 26 21170125 http://www.s PHYSPROP
    26960 ethyl-3-hydroOc1cc(ccc1)C 74 21170129 http://www.s PHYSPROP
    26961 benzoic acid, COC(=O)c2ccc 52 21170130 http://www.s PHYSPROP
    26962 benzyl methylCOCc1ccccc1 -52.6 21170543 http://www.s PHYSPROP
    26963 benzenamine,Nc2cccc(Oc1cc 37 21170956 http://www.s PHYSPROP
    26964 2,4'-dichloro O=C(CCl)c1ccc 101.5 21170959 http://www.s PHYSPROP
    26965 2,4,6-tribrom COc1c(Br)cc(B 88 21170966 http://www.s PHYSPROP
    26966 m-nitroanisol COc1cccc(c1)[ 38.5 21170967 http://www.s PHYSPROP
    26967 2-methoxy-ben
    COc1ccccc1C 24.5 21171387 http://www.s PHYSPROP
    26968 4-tert-butyl- CC(C)(C)c1ccc 19 21171393 http://www.s PHYSPROP
    26969 benzene, pentFc1c(F)c(F)c(F -37 21171396 http://www.s PHYSPROP
    26970 2-chloroiodo Ic1ccccc1Cl 0.7 21171406 http://www.s PHYSPROP
    26971 1-propene, 3- C=CCI -99.3 21171407 http://www.s PHYSPROP
    26972 1,2-dibromobBrC(CC)CBr -65.4 21171408 http://www.s PHYSPROP
    26973 1,4-dichloro- Clc1ccc(Cl)c(I) 22 21171496 http://www.s PHYSPROP
    26974 ethanone, 1-( Cc1ccc(cc1C)C -3 21171502 http://www.s PHYSPROP
    26975 iodopentaflu Fc1c(F)c(F)c(F) -29 21171503 http://www.s PHYSPROP
    26976 1,2-dibromo-3Fc1c(F)c(F)c(F 12 21171504 http://www.s PHYSPROP
    26977 1,3,4-trimeth Cc1cc(C)c(C)c 71 21171505 http://www.s PHYSPROP
    26978 butanoic acid,O=C(C)CC(=O) -27.3 21171506 http://www.s PHYSPROP
    26979 diethyl azelat O=C(CCCCCCC -18.5 21171511 http://www.s PHYSPROP
    26980 benzaldehyde,CCOc1ccccc1 21 21171512 http://www.s PHYSPROP
    26981 4-bromo-1-ni O=[N+]([O-])c 127 21171513 http://www.s PHYSPROP
    26982 1-isopropyl- CC(C)c1ccc(Br -22.5 21171514 http://www.s PHYSPROP
    26983 benzene, 2-brCc1cc(Br)c(C) 9 21171515 http://www.s PHYSPROP
    26984 antimycin a 1 CC(C)CC(=O)O 149.5 21171714 http://www.s PHYSPROP
    26985 1,2-benzenediCN(C)c1ccccc 8.9 21171722 http://www.s PHYSPROP
    26986 3-(2-furyl)ac O=C(/C=C/c1c 47 21171723 http://www.s PHYSPROP
    26987 benzene, (2-bBrCC(C)c1cccc -59.3 21171858 http://www.s PHYSPROP
    26988 (3-chloro-pro ClCCCOc1cccc 12 21171891 http://www.s PHYSPROP
    26989 3,4-dimethoxy-
    COc1cc(ccc1O 43.5 21171999 http://www.s PHYSPROP
    26990 2,4-dichloro- Clc1cc(Cl)ccc 32 21172138 http://www.s PHYSPROP
    26991 1-ethyl-3-nit O=[N+]([O-])c -37.9 21172677 http://www.s PHYSPROP
    26992 ethanone, 2-( O=C(COC(C)=O 49 21241193 http://www.s PHYSPROP
    26993 benzal diacet CC(=O)OC(OC( 46 21242158 http://www.s PHYSPROP
    26994 benzene, 2-chlO=[N+]([O-])c 88 21242790 http://www.s PHYSPROP
    26995 ethanol, 2,2,2ClC(Cl)(Cl)C( 56.5 21242792 http://www.s PHYSPROP
    26996 benzene, 1-chlCCc1ccc(Cl)cc -62.6 21242799 http://www.s PHYSPROP
    26997 4-aminoacridiNc2cccc1cc3c 108 21243528 http://www.s PHYSPROP
    26998 9-methyl-9-azO=C1CC2CCCC 54 21244466 http://www.s PHYSPROP
    26999 1,2,3-triamin Nc1cccc(N)c1 103 21245510 http://www.s PHYSPROP
    27000 1,2,4-benzeneNc1cc(N)c(N)c 97.3 21245511 http://www.s PHYSPROP
    27001 2,4'-biphenyl Nc2ccccc2c1cc 54.5 21246540 http://www.s PHYSPROP
    27002 conhydrine OC(CC)C1CCC 121 21247621 http://www.s PHYSPROP
    27003 phenol, 2,4-biCC(C)(C)c1cc( 62.1 21247670 http://www.s PHYSPROP
    27004 benzene, (dic ClC(F)(Cl)c1cc -26.8 21257307 http://www.s PHYSPROP
    27005 n-methyl-1,4 Nc1ccc(NC)cc 36 21259528 http://www.s PHYSPROP
    27006 benzene, 1,3,5Cc1cc(C)cc(C) 44 21407855 http://www.s PHYSPROP
    27007 benzoic acid, COC(=O)c1ccc -2 21408853 http://www.s PHYSPROP
    27008 1,1'-azobis(cy N#CC2(/N=NC 116 21427655 http://www.s PHYSPROP
    27009 crocetin C/C(=CC=CC(C 286 21428986 http://www.s PHYSPROP
    27010 (4-methylphenCc2ccc(/N=N/c 71.5 21506275 http://www.s PHYSPROP
    27011 1,2,3,5-tetra Brc1cc(Br)c(Br 99.5 21509304 http://www.s PHYSPROP
    27012 benzene, 1,1' COc2ccccc2Oc 79.5 21510927 http://www.s PHYSPROP
    27013 seneciphyllineO=C1OCC3=CC 217.5 21511627 http://www.s PHYSPROP
    27014 1-chloro-4-(d Clc1ccc(cc1)N 45.5 21539179 http://www.s PHYSPROP
    27015 4-chloro-(dimeCN(C)c1ccc(Cl 35.5 21539183 http://www.s PHYSPROP
    27016 ethylacetoaceCC(=O)C(=C/c 60.5 23088906 http://www.s PHYSPROP
    27017 cycloheximideO=C2CC(C[C@ 119 23119503 http://www.s PHYSPROP
    27018 cyclorphan Oc3ccc4C[C@ 188 23149299 http://www.s PHYSPROP
    27019 tepa adamantyCC5(C)CN5P(= 130 23162301 http://www.s PHYSPROP
    27020 retrorsine O=C1OCC3=CC 212 23345558 http://www.s PHYSPROP
    27021 benzene, 1-chlCCc1cc(Cl)ccc -55 23346259 http://www.s PHYSPROP
    27022 isomesityl oxi C=C(C)CC(C)= -72.6 23350988 http://www.s PHYSPROP
    27023 o-acetotoluidiCc1ccccc1N(C 55.5 23351438 http://www.s PHYSPROP
    27024 benzenamine,Cc1c(C)c(C)c( 152.5 24007073 http://www.s PHYSPROP
    27025 1-hexen-3-oneOc1ccc(/C=C/ 131.5 24207192 http://www.s PHYSPROP
    27026 (2alpha,2abetCN1C3CC2CC1 108.5 24534715 http://www.s PHYSPROP
    27027 trioxsalen Cc2coc1c(C)c 234.5 24655579 http://www.s PHYSPROP
    27028 xanthophyll CC2(C)CC(O)C 196 24748311 http://www.s PHYSPROP
    27029 podophyllotoxCOc1cc(cc(O 183 24774779 http://www.s PHYSPROP
    27030 taxicatin COc1cc(cc(OC 170 24816786 http://www.s PHYSPROP
    27031 gentamicin CC(NC)C3CC( 105 24824094 http://www.s PHYSPROP
    27032 tetrodotoxin O[C@H]4C21N 225 25039495 http://www.s PHYSPROP
    27033 2,4,6-trichlo Clc1c(C)c(Cl)c 46 25999957 http://www.s PHYSPROP
    27034 1-(2-HydroxypO=C(c1ccccc1 20.85 13543812 http://scripts IUCr
    27035 2,2'-(3,3'-Did s1c(cc(c1c2sc 21.85 21130951 http://script IUCr
    27036 Cyclodecanol OC1CCCCCCCC 39.85 14436 http://scripts IUCr
    27037 (10S)-10-HydrO=C2c3c(c1c( 66.85 24731720 http://scripts IUCr
    27038 [(1S,3S)-3-AceO=C(O)C[C@@ 67.85 209536 http://scripts IUCr
    27039 4-HeptylbenzoO=C(O)c1ccc( 69.85 148691 http://scripts IUCr
    27040 1-{[(2S)-2-Me n1nn(c2ccccc 69.85 24731403 http://scripts IUCr
    27041 1-(6-MethylpyO=C(c1nc(ccc1 76.85 21132072 http://scripts IUCr
    27042 Ethyl (2Z)-2-p O=C(OCC)C(=C 77.85 21174987 http://scripts IUCr
    27043 4-Methyl-N-{2O=S(=O)(c1ccc 83.85 21105815 http://scripts IUCr
    27044 2-[(2R,4R)-2- Oc1ccccc1[C@ 89.85 24731523 http://scripts IUCr
    27045 (1R)-4-Oxo-1, O=C(O)[C@H]2 94.85 21185862 http://scripts IUCr
    27046 1,3,5-Triethyl O=C1N(C(=O)N 96.85 8306081 http://scripts IUCr
    27047 2-[(E)-(4-Met N#CSc2ccccc2 98.85 21174511 http://scripts IUCr
    27048 Methyl alpha-O[C@H]1[C@ 102.85 9031107 http://script IUCr
    27049 3-AminophenyO=S(=O)(Oc1cc 104.85 21136987 http://scripts IUCr
    27050 (3Z)-3-(2-Oxo O=C(C=C2c1cc 107.85 24731084 http://scripts IUCr
    27051 (3S,3'R)-1-AceBrc1ccc(cc1) 108.85 21181837 http://scripts IUCr
    27052 3-[(E)-2-(2,4- Clc1ccc(c(Cl) 109.85 24732093 http://scripts IUCr
    27053 Ethyl 1-acety O=C(n1nc(N)c 109.85 17626768 http://scripts IUCr
    27054 (3S)-1-Acetyl O=C(N4c1cccc 109.85 24731310 http://scripts IUCr
    27055 (1R)-3-OxoindO=C(O)[C@H]2 112.85 633584 http://scripts IUCr
    27056 3-[Benzyl(hydO1C[C@@H](O 114.85 21185887 http://scripts IUCr
    27057 Ethyl (2E)-3-[ O=C(c1ccccc1 117.85 24732052 http://scripts IUCr
    27058 Methyl (1S,8RO=C(OC)[C@@H 117.85 24731891 http://scripts IUCr
    27059 4-(1H-Benzotrn1c(c(c(N)n1c 123.85 9591602 http://scripts IUCr
    27060 2,6-Bis[(3,5- n1c(cc(n1Cc2c 124.85 21131393 http://scripts IUCr
    27061 N-(4-IsopropoO=C(Nc1ccc(O 129.85 85916 http://scripts IUCr
    27062 (3R)-1-Acetyl O=C(N2c1ccc 132.85 24731409 http://scripts IUCr
    27063 (3S)-3-Acetyl O=C([C@@]1(c 138.85 21178061 http://scripts IUCr
    27064 1-(2-Deoxy-be[O-][N+](=O 139.85 10238876 http://scripts IUCr
    27065 Methyl (1S,2'RO=C(OC)[C@H] 144.85 9813102 http://scripts IUCr
    27066 (2E)-2-(3-ChloO=S(=O)(N3c1c 144.85 21182084 http://scripts IUCr
    27067 N-Benzoyl-N-(Clc3ccc(N(C(= 144.85 21132435 http://scripts IUCr
    27068 (5beta)-AndroO=C2[C@]1(C 146.85 389114 http://scripts IUCr
    27069 (2R,3S,6S)-2, O=C3C[C@@H]( 147.85 21174739 http://scripts IUCr
    27070 (1R,5R,6R)-1'-O=C(N4C(=O) 150.85 24731433 http://scripts IUCr
    27071 (2E)-2-(4-Met O=S(=O)(N3c1c 151.85 21182086 http://scripts IUCr
    27072 (1R,5S)-1,5-DiO=C2N(c1cccc 151.85 24731295 http://scripts IUCr
    27073 (3'R)-1,1'-Dia O=C(N2c1cccc 151.85 21181964 http://scripts IUCr
    27074 Methyl (6S)-1 O=C(OC)[C@@] 152.85 21182038 http://scripts IUCr
    27075 (2E)-2-(4-MethO=S(=O)(N3c1c 154.85 21182085 http://scripts IUCr
    27076 3-[2,2-Bis(4-f Fc1ccc(cc1)/C 156.85 21132197 http://scripts IUCr
    27077 Phenazine n1c3c(nc2c1cc 157.85 4593 http://scripts IUCr
    27078 1-[2,6-DichlorFC(F)(F)c1cc( 159.85 21179215 http://scripts IUCr
    27079 (1R,5S)-1,5-DiO=C4N(c1ccccc 159.85 24731227 http://scripts IUCr
    27080 (8R,9S,10R,13O=C5C1=CC(= 161.85 8958974 http://scripts IUCr
    27081 Ethyl (6aS,8S O=C(OCC)[C@@ 161.85 21181905 http://scripts IUCr
    27082 2-[(E)-2-(3,4 Oc1c(cccc1OC 164.85 21183280 http://scripts IUCr
    27083 (1S,3aR,4S,6a O=C(Oc1ccc( 165.85 204830 http://scripts IUCr
    27084 (9aR,12aR)-11O1c4c(O[C@]2 165.85 21181755 http://scripts IUCr
    27085 Methyl (1S,6'RO=C(OC)[C@@ 171.85 24731884 http://scripts IUCr
    27086 (2S)-2-[(1S,2S O=C(O)[C@H] 172.85 21183136 http://scripts IUCr
    27087 6-(Pyridin-3-y n1nc3sc(nn3c 174.85 580712 http://scripts IUCr
    27088 (2E)-2-(Hydro O=C(Nc1ccccc 174.85 5259039 http://scripts IUCr
    27089 1,3,5-TrimethyO=C1N(C(=O)N 175.85 12670 http://scripts IUCr
    27090 N-(4-Acetyl-2 O=C(Nc2ccc(cc 176.85 21132375 http://scripts IUCr
    27091 2,2'-(3,4-DibuClc1ccc(cc1)c 177.85 24741087 http://scripts IUCr
    27092 (2E)-3-(2,4-Di O=[N+]([O-])c 178.85 4880671 http://scripts IUCr
    27093 (3Z)-1-Acetyl O=C(c1ccccc1 179.85 9501918 http://scripts IUCr
    27094 4-Amino-5-(4-Clc1ccc(cc1) 180.85 341586 http://scripts IUCr
    27095 (6R)-6-[(1S)- O=C3C=CC(c1c 183.85 21182592 http://scripts IUCr
    27096 (3E)-1-Acetyl-O=C(c1ccccc1 188.85 9340340 http://scripts IUCr
    27097 (5alpha)-3-OxO=C(O)CC[C@ 188.85 4446995 http://scripts IUCr
    27098 10,10-DimethoOC3(c1c(cccc1 188.85 21107482 http://scripts IUCr
    27099 7-Chloro-1H-i Clc1cccc2c1N 189.85 305113 http://scripts IUCr
    27100 (2a'R,3R,7a'R)O=C(N4C(=O)[ 192.85 21181909 http://scripts IUCr
    27101 2-Deoxy-2-[(mO=C(OC)N[C@ 195.85 21474808 http://scripts IUCr
    27102 (8R,9S,10R,13O=C4C=C5C(= 206.85 9902312 http://scripts IUCr
    27103 (1s,3s,5R,6s,7 O=C(O[C@H]3 208.85 21185806 http://scripts IUCr
    27104 (4aR,9R,9aR)- [O-][N+](=O) 218.85 21179840 http://scripts IUCr
    27105 Androst-4-eneO=C3CC[C@H] 221.85 133080 http://scripts IUCr
    27106 (2E)-3-(6-Nitr [O-][N+](=O) 223.85 24743292 http://scripts IUCr
    27107 3,5,11,13-Tet Brc4cc3c(N2Cc 225.18 21127472 http://scripts IUCr
    27108 3-(2-Chloro-6 Fc3cccc(Cl)c 240.85 21126074 http://scripts IUCr
    27109 1,8-Diphenyl- O2O[C@@]4(c1 243.85 24724831 http://scripts IUCr
    27110 5-{[(6-Chloro O=C1OC(OC(=O 250.85 17920090 http://scripts IUCr
    27111 (2S)-2-[(5S,8 O=C(O)[C@H] 252.85 21186062 http://scripts IUCr
    27112 (17beta)-3-OxO=C(O)[C@H] 253.85 89868 http://scripts IUCr
    27113 4-Methyl-2,2,O=C6c3c(c1ccc 264.85 21132514 http://scripts IUCr
    27114 Pyrazine-2,3- O=C(c1nccnc1 267.85 65937 http://scripts IUCr
    27115 Dimethyl (4S, O=C(OC)[C@H] 97.35 21182692 http://scripts IUCr
    27116 Methyl (4S)-3-O=S2(=O)OC[ -45.15 9076965 http://scripts IUCr
    27117 Hexahydro-2a,[N@]12CC[N@ -14.65 9161505 http://scripts IUCr
    27118 (4R,4aS,6R)-4 O=C2C=C1CC[ 36.85 1064812 http://scripts IUCr
    27119 2-Chloro-4-meClc1nc2ccccc2 56.85 62656 http://scripts IUCr
    27120 (1R,5S)-2,2,5 O=C3[C@]2(ON 56.85 21182478 http://scripts IUCr
    27121 N-(2-Phenyletn2cccc3cccc( 57.6 21133062 http://scripts IUCr
    27122 Methyl (2E)-3-O=C(OC)C=Cc1 59.35 21187423 http://scripts IUCr
    27123 3-NitrobenzenO=S(Cl)(=O)c1 60.85 8163 http://scripts IUCr
    27124 Methyl 3-(2-{(O=S(=O)(c1cc 67.53 21174709 http://scripts IUCr
    27125 (1S,2S,5S)-4,6O[C@H]2C=C( 70.85 79247 http://scripts IUCr
    27126 Methyl (2S)-2-S=C1SC=C(N1O 69.85 21181472 http://scripts IUCr
    27127 (2E)-3-(2,4-D Clc2cc(Cl)ccc 72.35 4800760 http://scripts IUCr
    27128 1-(Allyloxy)- Brc2c(OC/C=C 80.85 21174163 http://scripts IUCr
    27129 4-(Pyridin-4-y n2c(c1ccncc1 81.35 1223142 http://scripts IUCr
    27130 4-Chloro-2-(me
    Clc1nc(nc(c1 83.85 21132976 http://scripts IUCr
    27131 1-(4-IodophenO=C(c1ccc(I)c 84.85 65701 http://scripts IUCr
    27132 1-(4-IodophenO=C(c1ccc(I)c 85.35 65701 http://scripts IUCr
    27133 Isophthalalde O=Cc1cccc(C= 87.85 32002 http://scripts IUCr
    27134 Isophthalalde O=Cc1cccc(C= 88.85 32002 http://scripts IUCr
    27135 Methyl 3,6-bi O=C(OC[C@H] 89.85 8983928 http://scripts IUCr
    27136 Methyl 4-{[(4 O=C(OC)c2ccc( 90.35 1395878 http://scripts IUCr
    27137 (2R)-4-(Benzy O=C(O[C@@H]( 90.85 24738719 http://scripts IUCr
    27138 2-(4-MethylphO=C2C=CC=NN2 97.85 21138116 http://scripts IUCr
    27139 2,5-Dimethyl-4O=[N+]([O-])c 98.35 534434 http://scripts IUCr
    27140 2-[(E)-2-(3,4 O=C(Oc1c(ccc 101.35 21183281 http://scripts IUCr
    27141 (1R)-4-[(2R)- N2=N[C@@H](c 102.35 21187241 http://scripts IUCr
    27142 (2-ChlorophenClc3ccccc3P(c 105.35 268684 http://scripts IUCr
    27143 Dispiro[cyclopO=C2C4=C(C(= 103.35 24732455 http://scripts IUCr
    27144 1-(2,4-Difluor O=C(c1ccc(F) 105.35 511198 http://scripts IUCr
    27145 (1S)-4-[(1R)- N2=N[C@H](c1 107.85 21187238 http://scripts IUCr
    27146 Ethyl (6-chlor O=C(OCC)Cn1c 108.35 21136893 http://scripts IUCr
    27147 (1R,2R)-2-(2, O(c1c(OC)ccc 110.85 24731424 http://scripts IUCr
    27148 1-{[2-(2,4-Dic Clc1cc(Cl)c(c 112.35 39401 http://scripts IUCr
    27149 3-Deoxy-beta-O[C@H]1C[C@ 111.35 21186173 http://scripts IUCr
    27150 (1S)-4-[(3S)- N2=N[C@H](c1 113.35 21187240 http://scripts IUCr
    27151 4,6-Dichloro- Clc1nc(SC)nc( 113.85 541368 http://scripts IUCr
    27152 N-[(2Z)-3-MetO=C(N=C1/SC= 113.85 11073971 http://scripts IUCr
    27153 (2-Bromopheny
    Brc3ccccc3P(c 113.85 101130 http://scripts IUCr
    27154 3-[3-(4-ButoxyN#CCCN1N=C( 114.55 21130684 http://scripts IUCr
    27155 (17beta)-17-EO(c1cc4c(cc 114.35 21174674 http://scripts IUCr
    27156 (1R,9S)-4,5,6 O=C4c1c(OC)c 114.35 23148094 http://scripts IUCr
    27157 2-Chloro-3-(4 ClC1=C(C(=O) 120.35 206998 http://scripts IUCr
    27158 (2S)-1-NitrosoO=C(O)[C@H] 115.35 20163476 http://scripts IUCr
    27159 Ethyl 5-methyO=C(c1cccc(c1 115.35 21130804 http://scripts IUCr
    27160 (1E)-1-Phenyl-Fc2nc(ON=C(c1 116.85 21187443 http://scripts IUCr
    27161 [(4S)-6,7-Dim O=C(c1ccc2OC 118.35 21180431 http://scripts IUCr
    27162 (1Z)-2,2,2-Tri FC(F)(F)C(=NO 118.85 21187684 http://scripts IUCr
    27163 (2E)-1-(2-Nap O=C(c2cc1ccc 119.35 4584644 http://scripts IUCr
    27164 3,3'-[(1R,3R)- O=C(O)CC[C@ 121.35 21184224 http://scripts IUCr
    27165 3-Benzoyl-1,3-O=C2SCCN2C(= 121.35 24732776 http://scripts IUCr
    27166 2-[(E)-2-(4-H Oc1c(cc(cc1OC 124.35 21183049 http://script IUCr
    27167 4-{[2-(MethoxO=C(Nc1ccccc 124.85 603907 http://scripts IUCr
    27168 (E,E)-N,N'-Et Clc2ccc(/C=N/ 125.35 126782 http://scripts IUCr
    27169 N,N-Dimethyl-4
    [O-][N+](=O)c 126.35 17159 http://scripts IUCr
    27170 Methyl (1R,8SO=C(OC)C4=C( 127.35 21187728 http://scripts IUCr
    27171 1,3-Bis(2,2-d O=C(N1C(=O)C 128.35 21138514 http://scripts IUCr
    27172 2,3,4,5-Tetra Fc2c(F)c(F)c( 130.35 21138872 http://scripts IUCr
    27173 (1S,5R,7R)-1, O=C2N(C(=O)[ 134.35 21174672 http://scripts IUCr
    27174 2,4-Di-tert-buN(/c1ccccc1SC 135.35 21178907 http://scripts IUCr
    27175 N-(DiphenylmO=CNC(c1cccc 135.85 2999193 http://scripts IUCr
    27176 3,6-Dibromo-9Brc3cc2c1cc(B 139.35 548641 http://scripts IUCr
    27177 Diethyl 2,2'-( O=C(OCC)Cn1 139.85 21137289 http://scripts IUCr
    27178 3-[(2S,3R)-3-CCl[C@@]3(Cc 141.05 21174110 http://scripts IUCr
    27179 1-(3-Chloro-4 Clc1c(ccc(c1 140.1 616537 http://scripts IUCr
    27180 (2R,3S,5R,6S) O=C2[C@@H]([ 140.35 21175031 http://scripts IUCr
    27181 2-Phenyl-1,3-dO=C(N1CCCCC1 144.35 21134395 http://scripts IUCr
    27182 N-Benzoyl-N-(O=C(N(C(=O)c1 148.35 21138345 http://scripts IUCr
    27183 (2Z)-2-(1,3-B O=C1C(SC2=N 151.35 4688744 http://scripts IUCr
    27184 (2E)-3-(3,4-D Clc3ccc(C=CC( 153.35 4833348 http://scripts IUCr
    27185 2-Nitro-N-ph O=C(Nc1ccccc1 153.85 628486 http://scripts IUCr
    27186 4-MethylpyridO=C1C(=CC=N 153.85 9587245 http://scripts IUCr
    27187 (13cR)-13c-MeO=C3CCc4cccc 154.35 24731560 http://scripts IUCr
    27188 2,2,4,4-Tetra Clp2(Cl)np1(O 154.35 21133254 http://scripts IUCr
    27189 N-(4-AminobeO=S(=O)(N(Cc1 154.85 21125802 http://scripts IUCr
    27190 3-(DihydroxybO=C(O)c1cccc 157.35 21472636 http://scripts IUCr
    27191 Methyl [(1S)-1[O-][N+](=O) 157.85 21174608 http://scripts IUCr
    27192 4,6-Di(morphol
    n1c(nc(nc1N2 158.85 21123258 http://scripts IUCr
    27193 4-(4-Methylphe
    S=C2ON=C(c1c 159.35 21136433 http://scripts IUCr
    27194 8-{(2E)-2-[1-( N(/Nc2c1ncccc 159.85 24730951 http://scripts IUCr
    27195 [(1S)-2,2-Dic O=C(N1[C@H]( 159.85 21178904 http://scripts IUCr
    27196 N-CyclohexyldO=P1(Oc3c(c2 159.85 24729596 http://scripts IUCr
    27197 (1R,2R,4S,6S)-O=C(O)[C@@ 161.35 10188496 http://scripts IUCr
    27198 Methyl (2aR,2O=C(OC)[C@@ 162.35 21187729 http://scripts IUCr
    27199 (3E)-4-{5-(Di Ic1c(ccc(N(C) 164.35 24731528 http://script IUCr
    27200 (2E,6E)-2,6-B O=C/3/C(=C/c 165.85 1825682 http://scripts IUCr
    27201 Ethyl (R)-[(3 O=P(OCC)(c1c 167.1 8084070 http://scripts IUCr
    27202 Mesitylacetic O=C(O)Cc1c(cc 167.85 70500 http://scripts IUCr
    27203 (2E)-3-(2-FluoFc2ccccc2C=C( 168.85 21178726 http://scripts IUCr
    27204 Dimethyl 1-(c O=C(OC)C2=C( 168.85 21187129 http://scripts IUCr
    27205 (3beta,5alphaN(C)(C)[C@H 172.35 9591990 http://scripts IUCr
    27206 1-Biphenyl-4- O=C(Nc1ccc(c 173.85 75140 http://scripts IUCr
    27207 4-(Quinolin-4-N#Cc3cc(Oc1c 175.45 21126533 http://scripts IUCr
    27208 (2R,3S)-3-HydO=C(N(C)C)[C 176.35 21187300 http://scripts IUCr
    27209 16-(IsopropoxO=C(O)C2=C(C 176.35 21187673 http://scripts IUCr
    27210 Dimethyl 1,3-dO=C(OC)c2c(c3 178.35 21132473 http://scripts IUCr
    27211 (Benzoyloxy)mO=S(=O)(N)c2c 179.35 21136512 http://scripts IUCr
    27212 4-Oxo-4-{[(3b O=C(O)CCC(= 179.85 8246069 http://scripts IUCr
    27213 3-(4-ChlorophClC(=O)c1cc2c 180.35 24741189 http://scripts IUCr
    27214 Dimethyl 1-{[ O=C(OC)C2=C( 180.35 21187775 http://scripts IUCr
    27215 (1aR,1a'S,2R,3O=C3[C@@]1( 182.05 21174170 http://scripts IUCr
    27216 [(4S,5S)-2,5-DN2=C(O[C@@H 186.35 21107262 http://scripts IUCr
    27217 1,3-Di(morphoO=C(N1CCOCC1 186.85 2643768 http://scripts IUCr
    27218 4-[(4-ChlorophClc4ccc(Sc2nc 188.85 21131952 http://scripts IUCr
    27219 (2R,3S,5R,6S) Clc1ccc(cc1) 190.35 21175030 http://scripts IUCr
    27220 (2E)-2-(2-Flu Fc2ccccc2/C= 192.35 21174256 http://scripts IUCr
    27221 Ethyl 1-oxo-6 FC(F)(F)c2c(c 192.85 21138724 http://scripts IUCr
    27222 (3S)-4,5,6,7-T Clc3c2c(C(=O) 194.35 21185306 http://scripts IUCr
    27223 1,8-DihydroxyO=C3c2c(c(O) 200.35 21178900 http://scripts IUCr
    27224 6-Chloro-N-(2,Clc1nc(nc(n1) 200.85 21123255 http://scripts IUCr
    27225 5-Ethyl-1,3,4- n1nc(sc1CC)N 201.35 24633 http://scripts IUCr
    27226 Ethyl (1R)-3- O=C(OCC)C2=C 201.35 892141 http://scripts IUCr
    27227 Methyl (1R,2SO=C(OC)[C@] 202.85 24727253 http://scripts IUCr
    27228 (3beta,5alphaO[C@H]5[C@@ 207.35 228597 http://scripts IUCr
    27229 (13aS)-10-HydO=C4N3[C@H]( 208.85 21174903 http://scripts IUCr
    27230 Dimethyl (2aSO=C(OC)[C@@] 209.85 21187730 http://scripts IUCr
    27231 10-[2-(4-AcetyClc1ccc(cc1) 212.85 21131814 http://scripts IUCr
    27232 (3alpha)-3-HyO=C(O)/C(=C 218.35 21181941 http://scripts IUCr
    27233 (1R,2S)-2-(2, O(c1c(OC)ccc 217.35 24731413 http://scripts IUCr
    27234 2-(3,4-DimethO=C1c3c(OC(= 217.35 8197619 http://scripts IUCr
    27235 Methyl (4S)-5-[O-][N+](=O) 217.35 21178307 http://scripts IUCr
    27236 (1S,5S,6S)-1'- O=C(N5C(=O)[ 218.85 21174611 http://scripts IUCr
    27237 Dimethyl (1R, O=C(OC)C5=C( 219.35 21187748 http://scripts IUCr
    27238 3-[(E)-(5-Ethy N(=N/c1nnc(s1 220.85 21185549 http://scripts IUCr
    27239 1-Benzyl-1H-be
    O=C(O)c3cccc 220.85 21132852 http://scripts IUCr
    27240 5-Methyl-1,3,n1nc(sc1C)N 224.85 60308 http://scripts IUCr
    27241 4-[(E)-(3,5-D Brc1cc(c(O)c( 228.35 13001610 http://scripts IUCr
    27242 5,10-DihydroxO=C1c4cccc(O 230.85 4444948 http://scripts IUCr
    27243 1,1'-(1E,3E,5EO=[N+]([O-])c 240.35 4832494 http://scripts IUCr
    27244 1-[(5R)-5-(3,4 O=C(N4N=C(c1 242.35 24740651 http://scripts IUCr
    27245 N'-{(E)-[4-(D O=C(NN=Cc1cc 253.85 5262910 http://scripts IUCr
    27246 Methyl [(1R,2 O=C(OC)[C@H] 264.35 21174506 http://scripts IUCr
    27247 (1'S,3aR,4R,6' O=C4OC[C@]5 296.85 24731298 http://scripts IUCr
    27248 (2s,4R,5S)-4,5FC([N+]([O-] 100.4 24728401 http://scripts IUCr
    27249 Dimethyl (2R,2O=C(OC)[C@@ 100 21186212 http://scripts IUCr
    27250 (1R,2S)-2-(2, O(c1c(OC)ccc 105 24731368 http://scripts IUCr
    27251 (1R,4S,5S,8S, O=C2[C@@H]3 108.5 21187796 http://scripts IUCr
    27252 (2S,3aS,6aS)- O=C(OCC)[C@ 109 4514937 http://scripts IUCr
    27253 2,2'-{(1S,2S)- N(=C/c1cccc 118 21186187 http://scripts IUCr
    27254 Ethyl 1-(2,4- O=C(OCC)c2nn( 124 10619037 http://scripts IUCr
    27255 cis-1,4-DiethyC#C[C@]1(O) 125 21173809 http://scripts IUCr
    27256 (3aS,5aR,8R,8O=C(O)C[C@] 127 21186763 http://scripts IUCr
    27257 6-(2-Methoxy-O=C(OC)COC(= 130 21132122 http://scripts IUCr
    27258 (1-Hydroxy-5,O=C(c1ccc2c( 132 21137071 http://script IUCr
    27259 (3beta,4beta, O=C1CC[C@@H 136 24728865 http://scripts IUCr
    27260 (1R,5S,6s)-6- O=C(O)[C@@] 137.25 21174652 http://scripts IUCr
    27261 7-BromoquinolBrc1c(O)c2ncc 139.5 340390 http://scripts IUCr
    27262 (1S,2R,8S)-14 O=C4O[C@@]2 142.5 391181 http://scripts IUCr
    27263 (1R,4R)-1,4-D C1#C[C@](O)( 144 21186616 http://scripts IUCr
    27264 2-[(E)-2-(3,4 O=C(Oc1c(ccc 148 21183281 http://scripts IUCr
    27265 4-[(E)-(3-Nitr [O-][N+](=O)c 148.5 10773514 http://scripts IUCr
    27266 2,10-Dichloro Clc2ccc1OP(=S 149 21138163 http://scripts IUCr
    27267 (2R)-2-(Diphe O=C1CCCC[C@H 150 21187203 http://scripts IUCr
    27268 (1R,2R,3S,4S)-O=C(O)[C@@H 150.5 10043582 http://scripts IUCr
    27269 (1S,4S)-CyclodC1#C[C@@H]( 154.5 21186615 http://scripts IUCr
    27270 (3alpha,4alphO=C1CC[C@@ 158 21186509 http://scripts IUCr
    27271 2-({[2-(Dimet [O-]c1ccc(cc1 158.5 24728815 http://scripts IUCr
    27272 (1R,2R,3S,4S)-O=C(O)[C@H] 160.5 10063530 http://scripts IUCr
    27273 Hexaethyl [(3 O=P(OCC)(OCC) 164.5 9138434 http://scripts IUCr
    27274 N-[(4-ChloropClc3ccc(NC(=S 165 1126950 http://scripts IUCr
    27275 N,N'-(4-AminoO=S(=O)(Nc2cc 165 21138697 http://scripts IUCr
    27276 (2S)-2-[(S)-( Clc1ccc(c(Cl 172 24731584 http://scripts IUCr
    27277 12,12,14,14-TeO1c4c(c2c(O[S 173 8773392 http://scripts IUCr
    27278 (1R,2R,11S,15O=C(O[C@]51 183.5 24729349 http://scripts IUCr
    27279 (1R,2R,3R,4S)-O=C(O)[C@@H 185 16737315 http://scripts IUCr
    27280 (2E)-1-(2,4-D [O-][N+](=O)c 186.5 7842794 http://scripts IUCr
    27281 (3S,4R)-3-Phe O=C5N([C@@H] 194 9190816 http://scripts IUCr
    27282 P-(2-Amino-1HO=P(N(C)C)(N 199.5 21130557 http://scripts IUCr
    27283 N-Carbamoyl-O=C(N[C@@H] 207 2095571 http://scripts IUCr
    27284 (3beta,4alphaO=C2[C@]1(C 221 21186687 http://scripts IUCr
    27285 5,7-Dihydrox O=C1c3c(O)c( 225 4478521 http://scripts IUCr
    27286 (3alpha,4betaO=C2[C@]1(C 233 9284696 http://scripts IUCr
    27287 5-Amino-2,4-diN#Cc4c(nc(c2 236 21137072 http://script IUCr
    27288 2-Hydroxy-5-{(O=S(=O)(Nc1nc 249 10605946 http://scripts IUCr
    27289 2-Amino-1,3-tO=C1N=C(SC1 250 10702 http://scripts IUCr
    27290 2-Ethyl-3-hyd O=C2C=CN(N1 258.5 4417265 http://scripts IUCr
    27291 (1S,8S)-13-Br Brc1cccc5c1[ 259.6 21187778 http://scripts IUCr
    27292 3,3-DimethylpN#CCC(C)(C)C 29.7 232142 http://scripts IUCr
    27293 (1R,2R,3S,6S, O[C@H]3[C@@ 306 24729257 http://scripts IUCr
    27294 1-(4-ChlorophO=C(c1ccc(Cl) 35.5 21278 http://scripts IUCr
    27295 Methyl hydroxO=C(OC)[C@@ 41.5 21174555 http://scripts IUCr
    27296 4-Chloro-N-meClc1ccc(N([N+ 45.5 24729278 http://script IUCr
    27297 4-Methylbenze
    O=S(=O)(C#N)c 48 79343 http://scripts IUCr
    27298 [4-(TrifluoromFC(F)(F)c1ccc 48.5 67895 http://scripts IUCr
    27299 (1R,3R,4R,6S)-N#C[C@@H]1C 54.5 21187141 http://scripts IUCr
    27300 4-[(4-Ethoxyp O=C2C=C(c1c( 562 671227 http://scripts IUCr x Likely Kelvin temperature.
    27301 (1R,3aR,5aS,8O=C1C[C@H]3 58 21186805 http://scripts IUCr
    27302 (2-Formyl-1H-O=C(OCc1c(C= 60 8710472 http://scripts IUCr
    27303 (1S,2R,9S,10S C21=C[C@@H] 71.4 21186240 http://scripts IUCr
    27304 2-[2-(2-ChloroClc1cc(Cl)cc 71.5 21187494 http://scripts IUCr
    27305 (2R,4S)-4-Iod O=S(=O)(c1ccc 74 24731279 http://scripts IUCr
    27306 (2E)-3-[(E)-(3 O=C(C(=C(/N= 76.5 21187437 http://scripts IUCr
    27307 (1R,4R,6R,8R)-Fc1c(F)c(F)c 83 21187614 http://scripts IUCr
    27308 2-(4-Bromophe
    Brc2ccc(C(=O 89.5 21186009 http://scripts IUCr
    27309 (2E)-3-(2,3-D O=C(c1ccc(OC 99.5 4729729 http://scripts IUCr
    27310 (1R,4S)-1,4-DiC1#C[C@@](O 100 21186510 http://scripts IUCr
    27311 (1R,4S)-1,4-DiC1#C[C@@](O 100 21186510 http://scripts IUCr
    http://dx.doi
    .org/10.1080
    O=C(\C=C\c2 /106293607
    ccc1c(cccc1)
    27312 (-)-levonorgesO=C4\C=C3/[ 236 12560 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    O=C(\C=C\c2
    c2)\C=C\c2cc
    27313 (1E,4E)-1,5-D ccc1c(cccc1)
    c1c(cccc1)c2
    O=C(\C=C\c2 114 4523376 http://www.nCanadian Jourx clearly out of range MJM
    c2)\C=C\c2cc
    27314 (1E,4E)-1,5-D ccc1c(cccc1)
    c1c(cccc1)c2
    O=C(\C=C\c2 243.5 4523376 http://dx.doi Tetrahedron
    c2)\C=C\c2cc
    27315 (1E,4E)-1,5-D ccc1c(cccc1)
    c1c(cccc1)c2 245 4523376 http://appf Patent
    c2)\C=C\c2cc
    27316 (1E,4E)-1,5-D c1c(cccc1)c2 242 4523376 http://pubs.a Journal of the American Chemical Society
    27317 (2E)-1-(2-Hyd OC1=C(C=CC= 87.75 553827 http://www.scEuropean Journal of Pharmaceutical Sciences
    27318 (2E)-1-(2-Hyd OC1=C(C=CC= 89 553827 http://www.jsChemical & Pharmaceutical Bulletin
    27319 (2E)-1-(2-Hyd OC1=C(C=CC= 82 553827 http://tinyur Tetrahedron
    27320 (2E)-1-(2-Hyd OC1=C(C=CC= 83.5 553827 http://online Journal of Pharmacy and Pharmacology
    27321 (2E)-1-(2-Hyd OC1=C(C=CC= 83 553827 http://tinyurl Biological & Pharmaceutical Bulletin;
    27322 (2E)-1-(2-Hyd OC1=C(C=CC= 83.5 553827 http://tinyur Tetrahedron
    27323 (2E)-1-(2-Hyd OC1=C(C=CC= 83.5 553827 http://pubs.a Journal of Medicinal Chemistry
    27324 (2E)-1-(2-Hyd OC1=C(C=CC= 87 553827 http://tinyur Bulletin of the Chemical Society of Japan
    27325 (2E)-1-(2-Hyd OC1=C(C=CC= 90.5 553827 http://tinyur Bulletin of the Chemical Society of Japan
    27326 (2E)-1-(2-Hyd OC1=C(C=CC= 87.5 553827 http://tinyur Tetrahedron
    27327 (2E)-1-(3-Hyd OC1=CC=CC(=C 188 7730515 http://tinyurl Tetrahedron Letters
    27328 (2E)-1-(4-Hyd OC1=CC=C(C=C 190 4511547 http://tinyur European Journal of Medicinal Chemistry
    27329 (2E)-1-(4-Hyd OC1=CC=C(C=C 169 4511547 http://tinyur Bioorganic and Medicinal Chemistry
    27330 (2E)-1-(4-Hyd OC1=CC=C(C=C 182 4511547 http://www.jsChemical and Pharmaceutical Bulletin
    27331 (2E)-1-(4-Hyd OC1=CC=C(C=C 186.5 4511547 http://pubs.a Organic Letters
    27332 (2E)-1-(4-Hyd OC1=CC=C(C=C 184.5 4511547 http://tinyur Patent: US2006/142303 A1
    27333 (2E)-1-(4-Hyd OC1=CC=C(C=C 182 4511547 Indian Journal of Chemistry; Section B: Organic Chemistry Including M
    27334 (2E)-1-(4-Hyd OC1=CC=C(C=C 188.8 4511547 http://pubs.a Journal of Medicinal Chemistry
    27335 (2E)-1-(4-Hyd OC1=CC=C(C=C 181 4511547 http://pubs.a Journal of Medicinal Chemistry
    27336 (2E)-1-(4-Hyd OC1=CC=C(C=C 189 4511547 http://tinyurl Biological & Pharmaceutical Bulletin
    27337 (2E)-1,3-Bis- COC1=CC=C(C= 95 4526784 http://www.beBeilstein Journal of Organic Chemistry
    27338 (2E)-1,3-Bis- COC1=CC=C(C= 103.5 4526784 http://www.scTetrahedron
    27339 (2E)-1,3-Bis- COC1=CC=C(C= 99 4526784 http://www.scBioorganic and Medicinal Chemistry
    27340 (2E)-1,3-Bis- COC1=CC=C(C= 101 4526784 http://www.scBioorganic and Medicinal Chemistry
    27341 (2E)-1,3-Bis- COC1=CC=C(C= 95 4526784 http://www.scJournal of Organometallic Chemistry
    27342 (2E)-1,3-Bis- COC1=CC=C(C= 89.5 4526784 http://pubs.a Organic Letters
    27343 (2E)-1,3-Bis- COC1=CC=C(C= 102.5 4526784 http://www.scPhytochemistry (Elsevier)
    27344 (2E)-1,3-Bis- COC1=CC=C(C= 99 4526784 http://www.nCanadian Journal of Chemistry
    27345 (2E)-1,3-Bis- COC1=CC=C(C= 100.5 4526784 http://pubs.a Journal of the American Chemical Society
    27346 (2E)-1,3-Diph C1(=CC=CC=C1 163.5 553346 http://pubs.a Journal of Mex out of range
    27347 (2E)-1,3-Diph C1(=CC=CC=C1 57 553346 http://tinyur Journal of Fluorine Chemistry
    27348 (2E)-1,3-Diph C1(=CC=CC=C1 53.5 553346 http://online European Journal of Organic Chemistry
    27349 (2E)-1,3-Diph C1(=CC=CC=C1 57 553346 http://tinyur European Journal of Medicinal Chemistry
    27350 (2E)-1,3-Diph C1(=CC=CC=C1 57 553346 http://tinyur Ultrasonics Sonochemistry
    27351 (2E)-1,3-Diph C1(=CC=CC=C1 55 553346 http://tinyur Electrochimica Acta
    27352 (2E)-1,3-Diph C1(=CC=CC=C1 56.5 553346 http://tinyur Journal of Fluorine Chemistry
    27353 (2E)-1,3-Diph C1(=CC=CC=C1 56 553346 http://online European Journal of Organic Chemistry
    27354 (2E)-1,3-Diph C1(=CC=CC=C1 55.5 553346 http://online Chemistry--A European Journal
    27355 (2E)-1,3-Diph C1(=CC=CC=C1 56.5 553346 http://tinyur Journal of Organometallic Chemistry
    27356 (2E)-3-(3,4-D OC1=C(C=CC(= 212.5 4976780 http://www.scBioorganic & Medicinal Chemistry Letters
    27357 (2E)-3-(3,4-D OC1=C(C=CC(= 200 4976780 http://pubs.a Journal of Medicinal Chemistry
    27358 (2E)-3-(3,4-D OC1=C(C=CC(= 203.5 4976780 http://online Journal of Pharmacy and Pharmacology
    27359 (2E)-3-(3,4-D OC1=C(C=CC(= 203 4976780 http://pubs.a Journal of Medicinal Chemistry
    27360 (2E)-3-(3,4-D OC1=C(C=CC(= 204.5 4976780 http://pubs.a Journal of the American Chemical Society
    27361 (2E)-3-(4-Chl ClC1=CC=C(C= 87 4462926 http://tinyur Bioorganic and Medicinal Chemistry
    27362 (2E)-3-(4-Chl ClC1=CC=C(C= 125.5 4462926 http://pubs.a Journal of Medicinal Chemistry
    27363 (2E)-3-(4-Chl ClC1=CC=C(C= 130 4462926 http://tinyur Journal of Organometallic Chemistry
    27364 (2E)-3-(4-Hyd OC1=C(C=C(C= 129 4767768 http://tinyur European Journal of Medicinal Chemistry
    27365 (2E)-3-(4-Hyd OC1=C(C=C(C= 126.5 4767768 http://pubs.a Journal of Medicinal Chemistry
    27366 (2E)-3-(4-Hyd OC1=C(C=C(C= 129 4767768 http://pubs.a Journal of the American Chemical Society
    27367 (2E)-3-(4-Hyd OC1=C(C=C(C= 128 4767768 http://pubs.r Journal of the Chemical Society
    27368 (2E)-3-(4-Hyd OC1=CC=C(C= 187.5 4445524 http://www.scBioorganic & Medicinal Chemistry Letters
    27369 (2E)-3-(4-Hyd OC1=CC=C(C= 185 4445524 Molecular Crystals and Liquid Crystals Science and Technology; Sectio
    27370 (2E)-3-(4-Hyd OC1=CC=C(C= 180.5 4445524 http://pubs.a Journal of Medicinal Chemistry
    27371 (2E)-3-(4-Hyd OC1=CC=C(C= 179 4445524 http://www.spPharmaceutical Research
    27372 (2E)-3-(4-Hyd OC1=CC=C(C= 184 4445524 10.1248/bpb. Biological & Pharmaceutical Bulletin
    27373 (2E)-3-(4-Hyd OC1=CC=C(C= 183.5 4445524 http://pubs.a Journal of the American Chemical Society
    27374 (2E)-3-(4-Hyd OC1=CC=C(C= 184 4445524 J. Gen. Chem. USSR (Engl. Transl.)
    27375 (2E)-3-(4-Nit [N+](=O)([O- 158.5 4526395 http://www.scJournal of Fluorine Chemistry
    27376 (2E)-3-(4-Nit [N+](=O)([O- 160.5 4526395 http://www.scBioorganic and Medicinal Chemistry
    27377 (2E)-3-(4-Nit [N+](=O)([O- 164 4526395 http://www.spMedicinal Chemistry Research
    27378 (2E)-3-(4-Nit [N+](=O)([O- 160 4526395 http://www.scJournal of Molecular Catalysis B: Enzymatic
    27379 (2E)-3-(4-Nit [N+](=O)([O- 167 4526395 http://online Chemistry--A European Journal
    27380 (2E)-3-(4-Nit [N+](=O)([O- 156 4526395 http://www.scBioorganic and Medicinal Chemistry
    27381 (2E)-3-(4-Nit [N+](=O)([O- 163.75 4526395 http://pubs.a Journal of Organic Chemistry
    27382 (2E)-3-(4-Nit [N+](=O)([O- 159.5 4526395 http://pubs.a Journal of the American Chemical Society
    27383 (2E)-3-(4-Nit [N+](=O)([O- 164.3 4526395 http://pubs.a Journal of the American Chemical Society
    27384 (2E)-3-Benzo[ O1C2=C(OC1)C 118 4510679 http://tinyur Journal of Molecular Catalysis B: Enzymatic
    27385 (2E)-3-Benzo[ O1C2=C(OC1)C 116 4510679 http://tinyur Bioorganic & Medicinal Chemistry Letters
    27386 (2E)-3-Benzo[ O1C2=C(OC1)C 108 4510679 http://pubs.a Journal of Organic Chemistry
    27387 (2E)-3-Benzo[ O1C2=C(OC1)C 109.5 4510679 http://online Journal of Heterocyclic Chemistry
    27388 (2E)-3-Benzo[ O1C2=C(OC1)C 122 4510679 Chem.Abstr.
    27389 (2E)-3-Benzo[ O1C2=C(OC1)C 120.5 4510679 http://tinyur Agricultural and Biological Chemistry
    27390 (2E)-3-Benzo[ O1C2=C(OC1)C 121 4510679 http://tinyurl Bulletin of the Chemical Society of Japan
    27391 (2E)-3-Benzo[ O1C2=C(OC1)C 122 4510679 Journal fuer Praktische Chemie (Leipzig)
    27392 (2E)-3-Benzo[ O1C2=C(OC1)C 128 4510679 Annales de Chimie (Cachan; France
    27393 (2R,3S,4R,5S,6C(C)(=O)O[C 129.5 0 Journal of Carbohydrate Chemistry
    C[C@@H]
    27394 (2S)-1-amino- (CN)O 21.5 5641722 http://www.mMerck Millipore
    C[C@@H]
    27395 (2S)-1-amino- (CN)O 22.5 5641722 http://synqueSynquest Labs
    C[C@@H]
    27396 (2S)-1-amino- (CN)O 25 5641722 http://www.aAlfa Aesar
    27397 (E)-2-(2-Fluor FC1=C(C=CC=C 212.5 0 http://www.arArkivoc
    27398 (E)-2-(4-Fluor FC1=CC=C(C=C 242.5 0 http://www.arArkivoc
    27399 (E)-2-(4-nitro [N+](=O)([O- 227.5 0 http://www.arArkivoc
    27400 (E)-2-phenyl-3C1(=CC=CC=C1 198.5 0 http://www.arArkivoc
    27401 (E)-2-phenyl-3C1(=CC=CC=C1 185 0 http://www.arArkivoc
    27402 (E)-2-phenyl-3C1(=CC=CC=C1 215.5 0 http://www.arArkivoc
    27403 1-adamantylaC1C2CC3CC1CC
    C1=CC=C2C( 180 2045 http://chems EPISuite-ChemSpider
    27404 1-butene =C1)C(=O)C3
    C=CCC -185.35 7556 http://jcp.ai Yamamuro O; Matsuo T; Takeda K; Kanaya T; Kawaguchi T; Kaji K Jour
    =C(C2=O)C(=
    27405 1-Chloroanth CC=C3)Cl 159 6453 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    27406 1-decene C=CCCCCCCCC -66.15 12809 http://webbo NIST Web Book
    27407 1-heptanol CCCCCCCO -33.2 7837 http://www.hCRC Handbook of Chemistry and Physics
    27408 1-heptene C=CCCCCC -120.15 11121 http://webbo NIST Web Book
    27409 1-hexanol CCCCCCO -47.15 7812 http://webbo NIST Web Book
    27410 1-hexene C=CCCCC -140.15 11109 http://webbo NIST Web Book
    27411 1-hydroxyadaOC13CC2CC(CC 289.95 57726 http://dx.doi Arora M; Steele WV Journal of Chemical Thermodynamics; 10(4); 403
    27412 1-hydroxyadaOC13CC2CC(CC 279.75 57726 http://dx.doi Charapennikau MB; Blokhin AV; Kabo AG; Kabo GJ Journal of Chemica
    27413 1-hydroxyadaOC13CC2CC(CC 281 57726 .org/10.1080
    http://pubs.a Pradhan PP; Bobbitt JM; Bailey WF Journal of Organic Chemistry; 74(2
    /106293607
    27414 1-methoxy-2,3Clc1ccc(OC)c(C 70 37440 http://dx.doi
    01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    Clc1ccc(OC)c
    27415 1-Methoxy-2,3(Cl)c1Cl 70 .org/10.1080
    37440 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    /106293607
    27416 1-methoxy-2,3Clc1c(OC)cc(Cl 88 13060 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    Clc1c(OC)cc(
    27417 1-Methoxy-2,3Cl)c(Cl)c1Cl 88 13060 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    27418 1-methylcycl CC1=CCCCC1 -120.45 11086 http://webbo
    http://dx.doi NIST Web Book
    27419 1-methylfluorc32c(c1cccc(c 85 14844 .org/10.1080
    http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    /106293607
    CC1=C2CC3=
    27420 1-methylfluorc32c(c1cccc(c 85 14844 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    C1=CC=C2C(
    CC=CC=C3C2
    27421 1-Methylfluor=C1)C=CC=C
    =CC=C1 85 14844 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    2[N+](=O)
    27422 1-Nitronaphth[O-] 62 6588 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    27423 1-nonanol CCCCCCCCCO -4 8574 http://www.z Zenitech
    27424 1-nonene C=CCCCCCCC -83.15 29025 http://webbo NIST Web Book
    27425 1-octadecyla CCCCCCCCCCC 52.9 15016 http://chems EPISuite-ChemSpider
    27426 1-octene C=CCCCCCC -102.15 7833 http://webbo NIST Web Book
    27427 1-pentene CCCC=C -162.12 7713 http://www.hCRC Handbook
    27428 1-propene C=CC -185.15 7954 http://pubs.a Streng AG Journal of Chemical and Engineering Data; 16(3); 357-359 (
    27429 1,2-Bis(tert-b C(C)(C)(C)OC 37.5 0 http://www.beBeilstein Journal of Organic Chemistry
    27430 1,2-Bis(tert-b C(C)(C)(C)OC 56 0 http://www.beBeilstein Journal of Organic Chemistry
    27431 1,2-Bis(tert-b C(C)(C)(C)OC 56 0 http://www.beBeilstein Journal of Organic Chemistry
    27432 1,2-Bis(tert-b C(C)(C)(C)OC 50.5 0 http://www.beBeilstein Journal of Organic Chemistry
    27433 1,2-Bis(tert-b C(C)(C)(C)OC 50 0 http://www.beBeilstein Journal of Organic Chemistry
    27434 1,2-Bis(tert-b C(C)(C)(C)OC 74.5 0 http://www.beBeilstein Journal of Organic Chemistry
    27435 1,2-Bis(tert-b C(C)(C)(C)OC 73.5 0 http://www.beBeilstein Journal of Organic Chemistry
    27436 1,2-Bis(tert-b C(C)(C)(C)OC 51.5 0 http://www.beBeilstein Journal of Organic Chemistry
    27437 1,2-butene oxO1C(CC)C1 -130 7546 http://dx.doi
    http://www.gGuideChem
    27438 1,2-butene oxO1C(CC)C1 -129.5 7546 .org/10.1080
    http://www.chSIDS
    /106293607
    C1=CC=C(C=
    27439 1,2-diphenylec1ccc(cc1)CCc 51.5 7364 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    C1)CCC2=CC
    27440 1,2-Diphenyle=CC=C2 51.5 7364 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    27441 1,2,3-triazole c1cnn[nH]1 24 60839 http://dx.doi
    http://tinyur Sigma-Aldrich
    27442 1,2,3-trichlo Clc1cccc(Cl)c1 53 13864445 .org/10.1080
    http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    /106293607
    27443 1,2,3-trichlo Clc1cccc(Cl)c1 53 13864445 01430124
    http://dx.doi RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    C1=CC(=C(C(
    27444 1,2,3-Trichlo =C1)Cl)Cl)Cl 53 13864445 .org/10.1080
    http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    /106293607
    27445 1,2,3,4-tetra Clc2c1ccccc1c( 198 27793 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    Clc2c1ccccc1
    27446 1,2,3,4-Tetra c(Cl)c(Cl)c2Cl 198 27793 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    27447 1,2,3,5-tetra Clc1cc(Cl)c(Cl) 55 21106571 .org/10.1080
    http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    /106293607
    27448 1,2,3,5-tetra C1=C(C=C(C(
    Clc1cc(Cl)c(Cl) 51.5 21106571 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    =C1Cl)Cl)Cl)C
    27449 1,2,3,5-Tetra l 51.5 21106571 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    27450 1,2,4-triazole n1cnnc1 120 8900 http://dx.doi
    http://www.aAlfa Aesar
    27451 1,2,4-tribrom Brc1cc(Br)c(Br 43 11507 .org/10.1080
    http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    /106293607
    27452 1,2,4-tribrom Brc1cc(Br)c(Br 44 11507 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    C1=CC(=C(C=
    27453 1,2,4-Tribro C1Br)Br)Br 44 11507 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    27454 1,2,4,5-tetra Brc1c(Br)cc(Br 182 11974 .org/10.1080
    http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    /106293607
    27455 1,2,4,5-tetra Brc1c(Br)cc(Br 182 11974 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    C1=C(C(=CC(
    =C1Br)Br)Br)
    27456 1,2,4,5-Tetr Br 182 11974 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    27457 1,2,4,5-tetra c1c(c(cc(c1Cl)C 139 21106163 http://www.aSepassi
    http://dx.doi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    27458 1,2,4,5-tetra c1c(c(cc(c1Cl)C 139 .org/10.1080
    21106163 http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    /106293607
    27459 1,2,4,5-tetra C1=C(C(=CC(
    c1c(c(cc(c1Cl)C 139 21106163 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    =C1Cl)Cl)Cl)C
    C1=CC=C2C(
    27460 1,2,4,5-Tetra =C1)C=CC3=
    l 139 21106163 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    CC1=CC(=C(C
    27461 1,2,4,5-Tetra CC4=C(C=CC
    =C1C)C)C 79 6999 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    5=CC=CC=C5
    27462 1,2,5,6-Diben 4)C=C32 266 5678 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    27463 1,3-Bis(4-hyd OC1=CC=C(C= 205.5 4578417 http://www.scBioorganic and Medicinal Chemistry Letters
    27464 1,3-Bis(4-hyd OC1=CC=C(C= 197 4578417 http://www.spMedicinal Chemistry Research
    27465 1,3-Bis(4-hyd OC1=CC=C(C= 197 4578417 http://tinyur Tetrahedron Letters
    27466 1,3-Bis(4-hyd OC1=CC=C(C= 238.5 4578417 http://tinyur Patent: WO2007/114532 A1
    27467 1,3-Bis(4-hyd OC1=CC=C(C= 198.5 4578417 http://pubs.a Organic Letters
    27468 1,3-Bis(4-hyd OC1=CC=C(C= 190.5 4578417 Medicinal Chemistry Research
    27469 1,3-Bis(4-hyd OC1=CC=C(C= 202 4578417 http://tinyurl Biological & Pharmaceutical Bulletin
    27470 1,3-Bis(4-hyd OC1=CC=C(C= 207.5 4578417 http://tinyur Phytochemistry (Elsevier)
    27471 1,3-Bis(4-hyd OC1=CC=C(C= 205 4578417 Chem.Abstr.
    27472 1,3-Bis(4-hyd OC1=CC=C(C= 203.75 4578417 http://dx.doi
    http://pubs.a Journal of the American Chemical Society
    27473 1,3,5-tribrom Brc1cc(Br)cc(B 124 11776 .org/10.1080
    http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    /106293607
    27474 1,3,5-tribrom Brc1cc(Br)cc(B 122 11776 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    C1=C(C=C(C=
    27475 1,3,5-Tribro C1Br)Br)Br 122 11776 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    27476 1,3,5-trichlo Clc1cc(Cl)cc(C 65 7662 .org/10.1080
    http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    /106293607
    27477 1,3,5-trichlo Clc1cc(Cl)cc(C 64 7662 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    C1=C(C=C(C=
    27478 1,3,5-Trichlo C1Cl)Cl)Cl 64 7662 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    27479 1,4-dibromobBrc1ccc(Br)cc 87 13868640 .org/10.1080
    http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    /106293607
    27480 1,4-dibromobBrc1ccc(Br)cc 88 13868640 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    C1=CC(=CC=
    27481 1,4-DibromobC1Br)Br 88 13868640 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    27482 1,4-dichlorob Clc1ccc(Cl)cc1 53 13866817 http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    27483 1,4-dichlorob Clc1ccc(Cl)cc1 53 13866817 http://dx.doi
    http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    27484 1,4-dichlorob Clc1ccc(Cl)cc1 53 13866817 .org/10.1080
    http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    /106293607
    27485 1,4-dichlorob Clc1ccc(Cl)cc1 55 13866817 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    C1=CC(=CC=
    27486 1,4-Dichlorob C1Cl)Cl 55 13866817 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    27487 11a-hydroxy- CC(=O)[C@@] 205.5 10308524 http://zheng Shaanxi Zhengbang International Trade Co
    C[C@]12CC[
    27488 12-(Phenylthi C@H]3[C@H
    C1(=CC=CC=C 91 0 http://www.arArkivoc
    27489 12-(Trimethyl ]C[Si](C1=C4C 159 0 http://www.arArkivoc
    ([C@@H]1C
    27490 12-Butyl-9,10 C[C@]12CCC
    C(CCC)C1=C4
    C[C@]2(C)O) 91 0 http://www.arArkivoc
    27491 12-Butyl-9,9- CCC4=CC(=O
    (=O)C=C1CC[
    C(CCC)C1=C4C 87 0 http://www.ar
    http://dx.doi Arkivoc
    )C=C[C@]34
    C@@H]3[C
    27492 17-alpha-Meth@@H]2CC[C
    C 165 6061 .org/10.1080
    http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    /106293607
    @]4([C@H]3
    27493 17-methyltestO=C4\C=C3/[ 164 5788 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    CC[C@]4(C)
    27494 17a-MethyltesO)C 163 5788 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    27495 2-(4-hydroxypOc2ccc(/N=N/ 206 10644751 http://www.aAlfa Aesar
    27496 2-(trifluoromeFC(F)(F)c1ccc -30 6656 http://www.f Fluoryx
    27497 2-(trifluoromeFC(F)(F)c1ccc -29 6656 http://tinyur Sigma-Aldrich
    27498 2-acetylphenoO=C(CO)c1ccc 28 61765 http://webbo NIST Web Boox clearly out of range JCB
    27499 2-acetylphenoO=C(CO)c1ccc 4.5 61765 http://www. Alfa Aesar
    27500 2-acetylphenoO=C(CO)c1ccc 5 61765 http://www.c ChemBlink
    C1=CC=C(C(=
    27501 2-AminobenzoiC1)C(=O)O)N 144 222 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    27502 2-Benzyl-3-(2 C(C1=CC=CC= 70.5 0 http://www.beBeilstein Journal of Organic Chemistry
    27503 2-Benzyl-3-cy C(C1=CC=CC= 110.5 0 http://www.beBeilstein Journal of Organic Chemistry
    http://dx.doi
    .org/10.1080
    /106293607
    C1=CC=C(C(=
    27504 2-bromobenzoi
    O=C(O)c1cccc 149 6674 http://dx.doi
    01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    C1)C(=O)O)B
    27505 2-Bromobenzoi
    r 149 6674 .org/10.1080
    http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    /106293607
    27506 2-chloro-1-phClc2ccccc2NS( 125 220844 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    27507 2-Chloro-12-pClC2=CC=C1O 185 0 http://www.arArkivoc
    27508 2-chloro-5-ni O=Cc1cc(ccc1C 71 65763 http://www.aAlfa Aesar
    27509 2-chloro-5-nitO=C(O)c1cc(cc 166.5 16359 http://chems EPISuite-ChemSpider
    C1=CC=C(C(=
    27510 2-ChlorobenzoC1)C(=O)O)Cl 140 8071 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    27511 2-chloroethanClCCO 159.5 21106015 http://www.c Chemical Boo x clearly out of range JCB
    27512 2-chloroethanClCCO
    CCC1=CC2=C -67 21106015 http://fscima Fisher
    (C=C1)C(=O)
    27513 2-chloroethanClCCO -67.5 21106015 http://webbo NIST Web Book
    C3=CC=CC=C
    27514 2-Ethylanthra 3C2=O 109 6514 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    27515 2-ethylhexanoO=C(O)C(CC)C -59 8373 http://www.aAlfa Aesar
    27516 2-ethylnaphthCCc1ccc2cccc 34.85 13063 http://webbo NIST Web Boox clearly out of range JCB
    27517 2-ethylnaphthCCc1ccc2cccc -7.45 13063 http://webbo NIST Web Book
    27518 2-ethylnaphthCCc1ccc2cccc -7.35 13063 http://webbo NIST Web Book
    27519 2-fluoro-4-chlClc1cc(F)c(NC 155 745600 http://www.c ChemKoo
    27520 2-fluoro-4-chlClc1cc(F)c(NC 157 745600 http://www.chChemNet
    27521 2-iodoacetamC(C(=O)N)I 93.5 3596 http://www.aAlfa Aesar
    27522 2-iodophenol Ic1ccccc1O 43 10328 http://books Merck Index
    27523 2-iodophenol Ic1ccccc1O 38.5 10328 http://www.siSigma-Aldrich
    27524 2-methoxy-1- O=Cc1c2c(ccc 84 71672 http://www.aAlfa Aesar
    CC1=C(C=C(C
    27525 2-methoxy-4-[Oc1ccc(cc1OC
    =C1[N+](=O) 140 21361761 http://useful ONSchallenge
    27526 2-methoxybenz [O-])[N+]
    O=C(O)c1cccc 101 10892 http://chems EPISuite-ChemSpider
    (=O)
    27527 2-Methyl-3,5-d[O-])C(=O)O 206 89258 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    27528 2-methyl-4-ni[O-][N+](=O)c 252 12236 http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    27529 2-methylbenzn2c1ccccc1nc 176.5 11489 http://chems EPISuite-ChemSpider
    27530 2-methylbenzoO=C(O)c1cccc 103.7 8070 http://chems EPISuite-ChemSpider
    CC1=CC=CC=
    27531 2-Methylbenzo C1=CC=C(C(=
    C1C(=O)O 108 8070 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    C1)C(=O)O)
    27532 2-Nitrobenzoic[N+](=O)[O-] 146 10616 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    27533 2-nitrophenolO=N(=O)c1ccc 44.8 13837787 http://www.aCRC Handbook of Chemistry and Physics
    27534 2-nitrophenolO=N(=O)c1ccc 44.5 13837787 http://books Merck Index
    27535 2-nitrophenolO=N(=O)c1ccc 44 13837787 http://www.siSigma-Aldrich
    27536 2-oxopentaned
    O=C(O)C(=O)C 115.5 50 http://chems EPISuite-ChemSpider
    27537 2-phenylbutyriO=C(O)C(c1cc 38 6745 http://chems EPISuite-ChemSpider
    27538 2-picolylamin n1ccccc1CN -20 18383 http://tinyur Acros
    27539 2-picolylamin n1ccccc1CN 20 18383 http://www.gGuideChem
    http://dx.doi
    27540 2-picolylamin C1=CC(=C(C=
    n1ccccc1CN 20 18383 .org/10.1080
    http://www. LookChem
    /106293607
    27541 2,2',5,5'-tetr C1Cl)C2=C(C
    Clc2ccc(Cl)cc2 87 34189 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    =CC(=C2)Cl)C
    27542 2,2',5,5'-Tetr l)Cl
    C1=CC=C2C= 87 34189 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    27543 2,3-benzanth C3C=C4C=CC
    c4c3cc2cc1ccc 341 6813 http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    =CC4=CC3=C
    27544 2,3-Benzanth C2=C1 341 6813 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    27545 2,3-benzofluoc1cccc4c1c2c(
    C1C2=CC=CC 208 8846 .org/10.1080
    http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    /106293607
    =C2C3=CC4=
    27546 2,3-benzofluoc1cccc4c1c2c( 210 8846 http://dx.doi
    01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    CC=CC=C4C=
    27547 2,3-BenzofluoC31 210 .org/10.1080
    8846 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    /106293607
    27548 2,3-dichloro- Clc2c(NS(=O)( 114 721017 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    27549 2,3-dichlorop Clc1c(O)cccc1 58 10857 http://www.aCRC Handbook of Chemistry and Physics
    27550 2,3-dichlorop Clc1c(O)cccc1 56 10857 http://www.siSigma-Aldrich
    27551 2,3-dichlorop Cl/C(=C)CCl 10 6317 http://www.c ChemBlink x mp same as flash pt
    27552 2,3-dimethylpCc1cccc(O)c1 72.5 13839151 http://www.aCRC Handbook of Chemistry and Physics
    27553 2,3-dimethylpCc1cccc(O)c1 71.5 13839151 http://www.siSigma-Aldrich
    Clc1ccc(OC)c
    27554 2,3,4-Trichlor (Cl)c1Cl 69 37440 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    27555 2,3,4-trichlor Clc1ccc([N+]([ 56 26691 .org/10.1080
    http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    /106293607
    27556 2,3,4-trichlor C1=CC(=C(C(
    Clc1ccc([N+]([ 55.5 26691 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    =C1[N+](=O)
    27557 2,3,4-Trichlo [O-])Cl)Cl)Cl 55.5 26691 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    Clc1c(OC)cc(
    27558 2,3,4,5-TetracC1=CC=C(C=
    Cl)c(Cl)c1Cl 84 13060 .org/10.1080
    http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    /106293607
    27559 2,3,4,5-tetrac C1)C2=CC(=C
    Clc1c(cc(Cl)c( 91 33457 http://dx.doi
    01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    (C(=C2Cl)Cl)C
    27560 2,3,4,5-Tetra l)Cl 91 33457 .org/10.1080
    http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    /106293607
    27561 2,3,5,6-tetra Clc1c([N+]([O-
    C1=C(C(=C(C( 99.5 21106573 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    27562 2,3,5,6-tetra =C1Cl)Cl)
    Clc1c([N+]([O- 100 8027 http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    [N+](=O)
    27563 2,3,5,6-Tetra [O-])Cl)Cl 99.5 21106573 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    27564 2,4-dichlorop Clc1cc(Cl)c(O) 45 8140 .org/10.1080
    http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    /106293607
    27565 2,4-dichlorop Clc1cc(Cl)c(O) 42.5 8140 http://dx.doi
    01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    C1=CC(=C(C=
    27566 2,4-Dichlorop C1Cl)Cl)O 42.5 .org/10.1080
    8140 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    /106293607
    27567 2,4,5-trichlor C1=CC=C(C=
    Clc2cc(c1ccccc 78 25605 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    C1)C2=CC(=C
    27568 2,4,5-Trichlor (C=C2Cl)Cl)Cl 78 25605 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    27569 2,4,5-trichlor Clc1cc(O)c(Cl) 69 7001 http://www.aCRC Handbook of Chemistry and Physics
    27570 2,4,5-trichlor Clc1cc(O)c(Cl) 67 7001 http://books Merck Index
    27571 2,4,5-trichlor Clc1cc(O)c(Cl) 65.5 7001 http://www.siSigma-Aldrich
    http://dx.doi
    27572 2,4,5-trichlor Clc1cc(O)c(Cl) 68 7001 .org/10.1080
    http://www.siSigma-Aldrich
    /106293607
    27573 2,4,5-trichlor Clc1cc(c(Cl)cc 82.4 21642 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    CC1=CC(=C(C
    27574 2,4,5-Trichlor =C1Cl)Cl)Cl 82.4 21642 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    27575 2,4,6-trichlor c1c(cc(c(c1Cl) 70 21106172 .org/10.1080
    http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    /106293607
    27576 2,4,6-trichlor c1c(cc(c(c1Cl) 65 21106172 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    27577 2,4,6-trichlor c1c(cc(c(c1Cl) 69 21106172 http://www.aCRC Handbook of Chemistry and Physics
    27578 2,4,6-trichlor c1c(cc(c(c1Cl) 69 21106172 http://books Merck Index
    27579 2,4,6-trichlor c1c(cc(c(c1Cl) 65 21106172 http://www.siSigma-Aldrich
    C1=C(C=C(C(
    27580 2,4,6-Trichlo =C1Cl)O)Cl)Cl 65 21106172 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    27581 2,4,6-trimeth C1=CC=C(C(=
    O=Cc1c(OC)cc 120 63211 .org/10.1080
    http://www.aAlfa Aesar
    /106293607
    27582 2,4'-DDT C1)C(C2=CC=
    Clc1ccccc1C(c2 74.2 12543 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    C(C=C2)Cl)C(
    27583 2,4'-DDT Cl)(Cl)Cl)Cl 75 12543 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    27584 2,5-dihydroxyO=C(O)c1cc(O 199.5 3350 .org/10.1080
    http://chems EPISuite-ChemSpider
    /106293607
    C1=CC(=C(C=
    27585 2,5-dihydroxyO=C(O)c1cc(O 205 3350 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    C1O)C(=O)O)
    27586 2,5-DihydroxyO 205 3350 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    27587 2,5-dimethylpCc1cc(O)c(C)c 74.8 13839128 http://www.aCRC Handbook of Chemistry and Physics
    27588 2,5-dimethylpCc1cc(O)c(C)c 76 13839128 http://www.siSigma-Aldrich
    27589 2,6-diaminopyc1cc(nc(c1)N) 121.5 8528 http://chems EPISuite-ChemSpider
    27590 2,6-dichlorob O=Cc1c(Cl)ccc 71.5 6481 http://chems EPISuite-ChemSpider
    27591 2,6-dichlorop Clc1cccc(Cl)c 68.5 6633 http://www.aCRC Handbook of Chemistry and Physics
    27592 2,6-dichlorop Clc1cccc(Cl)c 65 6633 http://books Merck Index
    27593 2,6-dichlorop Clc1cccc(Cl)c 65 6633 http://www.siSigma-Aldrich
    27594 2,6-dichlorophClc1cccc(Cl)c 159 73131 http://www.aAlfa Aesar
    27595 2,9,9-TrimethCC2=CC=C1OCC 199 0 http://www.arArkivoc
    27596 3-(2-FluorophFC1=C(C=CC= 191 0 http://www.arArkivoc
    27597 3-(2,2-DiphenC1(=CC=CC=C 147 0 http://www.beBeilstein Journal of Organic Chemistry
    27598 3-(3,4-Dihydr O1C=C(CCC1) 95.5 0 http://www.beBeilstein Journal of Organic Chemistry
    27599 3-(chloromethClCc1c(c(cc(c 69.5 73945 http://www.aAlfa Aesar
    27600 3-(chloromethClCc1c(c(cc(c 70.5 73945 http://www. TauChem
    27601 3-amino-1-phc1ccccc1CCC( -50 28910 http://www.c
    http://dx.doi Chemical Book
    27602 3-benzoylaminO=C(O)C(O)C( 170.5 2043006 .org/10.1080
    http://tinyur Sigma-Aldrich
    /106293607
    27603 3-bromobenzoiC1=CC(=CC(=
    O=C(O)c1cc(Br 156.5 10972 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    C1)Br)C(=O)
    27604 3-BromobenzoiO 157 10972 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    27605 3-chlorophenoOc1cc(Cl)ccc1 32.5 13875432 http://www.siSigma-Aldrich
    27606 3-cyanophenoN#Cc1cc(O)cc 79.5 12821 http://www.siSigma-Aldrich
    27607 3-indoleacryli O=C(O)\C=C\c 185 4524636 http://www.aAlfa Aesar
    27608 3-mercaptoproC(CS)C(=O)O 18 6267 http://chems EPISuite-ChemSpider
    27609 3-methoxy-1- OCCC(OC)C -85 16363 http://www.t Good Scents Company
    27610 3-methoxyaceCOc1cc(ccc1) -8 21111758 http://www.c Chemical Book
    COC1=CC=CC
    27611 3-Methoxybenz
    (=C1)C(=O)O 106 10977 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    CC1=CC(=CC
    27612 3-Methylbenzo
    =C1)C(=O)O 110 7140 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    27613 3-methylpent CC(CC)CC -110.2 7010 http://www.c Cheric
    27614 3-methylpent CC(CC)CC -118 7010 http://webbooNIST Web Book
    27615 3-methylpent CC(CC)CC -118 7010 http://pubs.a Smittenberg J Hoog H; Henkes RA Journal of the American Chemical S
    27616 3-nitroaniline C1=CC(=CC(=
    O=[N+]([O-])c 112.5 7145 http://www.siSigma-Aldrich
    C1)[N+](=O)
    27617 3-Nitrobenzoi [O-])C(=O)O 141 8183 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    27618 3-nitrophenolO=[N+]([O-])c 94 10664 http://www.siSigma-Aldrich
    27619 3-nitrophenolO=[N+]([O-])c 97 10664 http://www.siSigma-Aldrich
    27620 3-pentanol OC(CC)CC -8 10947 https://www.vVWR x out of range and 1- and 2-pentanol much
    27621 3-pentanol OC(CC)CC -75 10947 http://www.c ChemBlink
    27622 3-pentanol OC(CC)CC -69.15 10947 http://www.c KDB
    27623 3-phenylprop O=CCCc1ccccc 0 7421 http://www.c Acros x almost every vendor lists at -42 C
    27624 3,4-diaminopyC1=CC(=C(C=
    c1cncc(c1N)N 216.5 5705 http://tinyur Sigma-Aldrich
    C1C(=O)O)Cl)
    27625 3,4-DichlorobeCl 208 5612 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    27626 3,4-dichloron Clc1ccc(cc1Cl) 41 21106095 .org/10.1080
    http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    /106293607
    27627 3,4-dichloron C1=CC(=C(C=
    Clc1ccc(cc1Cl) 41.25 21106095 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    C1[N+](=O)
    27628 3,4-Dichloron [O-])Cl)Cl 41.3 21106095 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    27629 3,4-dichlorop Clc1ccc(O)cc1 68 6988 http://www.aCRC Handbook of Chemistry and Physics
    27630 3,4-dichlorop COC1=C(C=C
    Clc1ccc(O)cc1 66 6988 http://www.siSigma-Aldrich
    (C=C1)C(=O)
    27631 3,4-DimethoxyO)OC 181 6854 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    27632 3,4-methylendO=C(O)Cc1cc 128.5 68601 http://www.aAlfa Aesar
    27633 3,5-dimethox O=Cc1cc(OC)c 46.3 73763 http://chems EPISuite-ChemSpider
    27634 3,5-dimethyl Cc1cc(C=O)cc( 9 21168812 http://www.aAlfa Aesar
    27635 3,5-dimethylpCc1cc(O)cc(C) 63.4 13839110 http://www.aCRC Handbook of Chemistry and Physics
    27636 3,5-dimethylpCc1cc(O)cc(C) 62.5 13839110 http://www.siSigma-Aldrich
    27637 3,5-dimethylpCc1cc(O)cc(C) 65.5 13839110 http://www.siSigma-Aldrich
    27638 3β-Acetoxy-5,C(C)(=O)O[C 173 83823 http://tinyurl Steroids
    27639 3β-Acetoxy-5,C(C)(=O)O[C 168 83823 http://tinyur Bioorganic and Medicinal Chemistry
    27640 3β-Acetoxy-5,C(C)(=O)O[C 171.5 83823 http://www.spJournal of Chemical Crystallography
    27641 3β-Acetoxy-5,C(C)(=O)O[C 173 83823 http://pubs.a Journal of Organic Chemistry
    27642 3β-Acetoxy-5,C(C)(=O)O[C 159 83823 http://www.spChemistry of Natural Compounds
    27643 3β-Acetoxy-5,C(C)(=O)O[C 172 83823 http://www.spChemistry of Natural Compounds
    27644 3β-Acetoxy-5,C(C)(=O)O[C 170 83823 http://www.spPharmaceutical Chemistry Journal
    27645 3β-Acetoxy-5,C(C)(=O)O[C 176.7 83823 http://pubs.a Journal of the American Chemical Society
    27646 3β-Acetoxy-5,C(C)(=O)O[C 174 83823 http://online Helvetica Chimica Acta
    27647 3β-HydroxypreO[C@H]4CC[C 169 10193387 http://tinyur Steroids
    27648 4-(trifluorom FC(F)(F)c1ccc 1.5 61311 http://dx.doi
    http://www.aAlfa Aesar
    27649 4-acetamidobeO =C(Nc1ccc(c
    Oc1ccc(NC(C 260 18177 .org/10.1080
    http://chems EPISuite-ChemSpider
    /106293607
    )=O)cc1.CC(=
    27650 4-acetylamin CC(=O)Nc1ccc 170 1906 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    O)Nc1ccc(O)
    27651 4-Acetylamin cc1 170 14486718 http://dx.doi Abraham M.H.x a salt
    27652 4-aminoacetoO=C(C)c1ccc(N 105 7188 http://dx.doi
    http://www.siSigma-Aldrich
    27653 4-aminobenzoiO=C(O)c1ccc( 188.5 953 .org/10.1080
    http://chems EPISuite-ChemSpider
    /106293607
    27654 4-aminobenzoiO=C(O)c1ccc( 188.5 953 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    C1=CC(=CC=
    27655 4-Aminobenzoi
    C1C(=O)O)N 189 953 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    27656 4-aminophenylO=C(O)Cc1ccc 200 13876 http://chems EPISuite-ChemSpider
    27657 4-benzyltoluec1c(cccc1)Cc2 97.5 62501 http://nopr. Manih RM; Myr
    x clearly a liquid at rt http://usefulchem.wi
    27658 4-benzyltoluec1c(cccc1)Cc2 -30 62501 http://webbo NIST Web Boox freezes at -15C after 16 days http://usefu
    27659 4-benzyltoluec1c(cccc1)Cc2 4.58 62501 http://webbo NIST Web Book
    27660 4-benzyltoluec1c(cccc1)Cc2 5 62501 http://useful
    http://dx.doi UsefulChem
    C1=CC(=CC=
    27661 4-BromoanilinC1N)Br 66 7519 .org/10.1080
    http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    /106293607
    27662 4-bromobenzoi
    O=C(O)c1ccc(B 253 10980 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    C1=CC(=CC=
    27663 4-Bromobenzoi
    C1C(=O)O)Br 253 10980 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    27664 4-bromophenoOc1ccc(Br)cc1 62.5 13842573 http://dx.doi
    http://www.siSigma-Aldrich
    27665 4-bromophenyl
    Brc1ccc(cc1)C 116 67229 .org/10.1080
    http://chems EPISuite-ChemSpider
    /106293607
    27666 4-chloro-1-phClc2ccc(NS(=O 121.5 19639 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    27667 4-chloro-3-nitO=[N+]([O-])c 182.8 7044 http://chems
    http://dx.doi EPISuite-ChemSpider
    27668 4-chlorobenz c1cc(ccc1C=O) 46 21106019 .org/10.1016
    http://www.aAlfa Aesar
    http://dx.doi
    /j.tet.2013.0 Linuma M Various oxidative reactions with novel ion-supported Tetra
    27669 4-chlorobenz c1cc(ccc1C=O) 48.5 21106019 .org/10.1080
    2.017
    http://dx.doi (diacetoxyiodo)benzenes
    /106293607
    27670 4-chlorobipheClc2ccc(c1ccc 78 .org/10.1080
    15489 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    /106293607
    27671 4-chloronitro C1=CC(=CC=
    O=[N+]([O-])c 83.5 21106020 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    C1[N+](=O)
    27672 4-Chloronitro [O-])Cl 83.5 21106020 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    27673 4-chlorophenylClc1ccc(cc1)C 106.5 15093 http://chems EPISuite-ChemSpider
    27674 4-dimethylamO=C\C=C\c1cc 136 4447567 http://www.aAlfa Aesar
    27675 4-dimethylamO=Cc1ccc(N(C 74.5 7199 http://chems EPISuite-ChemSpider
    27676 4-fluorobenzoiO=C(O)c1ccc(F 185 9579 http://chems EPISuite-ChemSpider
    27677 4-fluorophenoFc1ccc(O)cc1 44.5 9350 http://www.siSigma-Aldrich
    27678 4-fluorophenoFc1ccc(O)cc1 46.5 9350 http://www.siSigma-Aldrich
    27679 4-hydroxy-3- O=Cc1ccc(O)c( 119 123379 http://chems EPISuite-ChemSpider
    27680 4-hydroxybenO=Cc1ccc(O)c 118 123 http://www.aAlfa Aesar
    27681 4-hydroxybenzc1cc(ccc1C(= 214.5 132 http://chems EPISuite-ChemSpider
    C1=CC(=CC=
    27682 4-HydroxybenzC1C(=O)O)O 216 132 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    27683 4-hydroxyphen
    O=C(O)Cc1ccc 152 124 http://chems EPISuite-ChemSpider
    27684 4-iodobenzoicO=C(O)c1ccc(I 270 11588 http://chems EPISuite-ChemSpider
    27685 4-isopropylphOc1ccc(cc1)C( 60 7185 http://www.siSigma-Aldrich
    27686 4-methoxybenz
    COc1ccc(cc1) 185 10181338 http://chems EPISuite-ChemSpider
    27687 4-methoxypheCOc1ccc(cc1) 55 8665 http://www.siSigma-Aldrich
    27688 4-methoxypheCOc1ccc(cc1) 56 8665 http://www.siSigma-Aldrich
    27689 4-methoxyphen
    O=C(O)Cc1ccc 87 7406 http://dx.doi
    http://chems EPISuite-ChemSpider
    27690 4-methylbenzoCc1ccc(cc1)C( 179.6 7190 .org/10.1080
    http://chems EPISuite-ChemSpider
    /106293607
    27691 4-methylbenzoCc1ccc(cc1)C( 181 7190 http://dx.doi
    01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    CC1=CC=C(C
    27692 4-Methylbenzo=C1)C(=O)O 181 7190 .org/10.1080
    http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    /106293607
    27693 4-nitro-1-phe O=S(=O)(Nc1cc 138.2 202019 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    27694 4-nitroaniline c1cc(ccc1N)N 147.5 13846959 http://www.siSigma-Aldrich
    27695 4-nitrobenzal O=[N+]([O-])c 105 526 http://www.aAlfa Aesar
    http://chemr
    s.wikispaces.
    com/CRSEXP
    27696 4-nitrobenzald[O-][N+](=O) 86 234490 011 chemrs
    27697 4-nitrobenzoicC1=CC(=CC=
    O=[N+]([O-])c 242 5882 http://chems EPISuite-ChemSpider
    C1C(=O)O)
    27698 4-Nitrobenzoic[N+](=O)[O-] 240 5882 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    27699 4-nitrophenolc1cc(ccc1[N+] 112.5 955 http://www.siSigma-Aldrich
    27700 4-nitrophenylaO=C(O)Cc1ccc( 154 4500 http://chems EPISuite-ChemSpider
    27701 4-nitrotoluen O=[N+]([O-])c 53 13863774 http://www.siSigma-Aldrich
    27702 4-phenylbutyriO=C(O)CCCc1c 52 4611 http://chems EPISuite-ChemSpider
    27703 4-phenylphenc1ccc(cc1)c2c 165 13846658 http://www.siSigma-Aldrich
    27704 4-picoline-N-o[O-][n+]1ccc( 185.5 13257 http://pubs.a Boekelheide V; Linn WJ Journal of the American Chemical Society; 76
    27705 4-picoline-N-o[O-][n+]1ccc( 184 13257 http://www.c
    http://dx.doi ChemBlink
    27706 4-tert-butylp CC(C)(C)c1ccc
    C1=CC(=CC= 98.5 13846663 .org/10.1080
    http://www.siSigma-Aldrich
    /106293607
    27707 4,4'-DDE C1C(=C(Cl)Cl)
    Clc2ccc(\C(=C( 89 2927 http://dx.doi
    01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    C2=CC=C(C=
    27708 4,4'-DDE C2)Cl)Cl
    C1=CC(=CC= 89 2927 .org/10.1080
    http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    /106293607
    27709 4,4'-DDT C1C(C2=CC=
    Clc1ccc(cc1)C( 110 2928 http://dx.doi
    01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    C(C=C2)Cl)C(
    27710 4,4'-DDT Cl)(Cl)Cl)Cl 110 .org/10.1080
    2928 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    /106293607
    27711 4,4'-dichlorobClc2ccc(c1ccc( 149 15474 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    CC1=C(C=C(C
    27712 5-Amino-o-cre=C1)N)O 161 16837 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    27713 5-butyl-5-ethyO=C1NC(=O)N 128.5 6229 .org/10.1080
    http://chems EPISuite-ChemSpider
    /106293607
    27714 5-fluorouracil c1c(c(=O)[nH] 283 3268 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    C1=C(C(=NC(
    27715 5-Fluorouracil=N1)O)O)F 283 3268 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    27716 6-aminocaproiO=C(O)CCCCC 205 548 .org/10.1080
    http://chems EPISuite-ChemSpider
    /106293607
    C1=C2C(=NC(
    27717 6-deoxyacyclon1cc2ncn(c2 188 49900 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    =N1)N)N(C=
    27718 6-DeoxyacycloC1=C2C(=NC(
    N2)COCCO 188 49900 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    =N1)N)N(C=
    27719 6-DeoxyacycloN2)COCCO 189 49900 .org/10.1080
    http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    /106293607
    C1=NC2=C(N
    27720 6-mercaptopuS=C2/N=C\Nc 314 580869 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    1)C(=S)N=CN
    27721 6-Mercaptopu2 314 580869 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    27722 8-bromooctanoBrCCCCCCCC( 38.5 477171 http://chems EPISuite-ChemSpider
    27723 9-fluorenone C1=CC=C2C(
    c1ccc2c(c1)-c 84 9824 http://dx.doi
    http://chems EPISuite-ChemSpider
    =C1)C3=CC=
    27724 9-fluorenone ClC1(Cl)
    CC=C3C2=O 83 9824 .org/10.1080
    http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    [C@]2(Cl)C(/ /106293607
    27725 9-methylanth CC1=C2C=CC
    Cc1c2ccccc2c
    Cl)=C(/Cl) 78 12524 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    =CC2=CC3=C
    27726 9-Methylanth [C@@]1(Cl)
    C=CC=C13
    [C@@H]1([C 78 12524 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    [C@@H]3[C
    @@H]
    27727 9,9-Dimethyl-CC2(CC1=CC4=
    @@H](Cl) 143 0 http://www.arArkivoc
    ([C@@H]
    [C@@H]
    27728 9,9-Dimethyl-CC2(CC1=CC5
    ([C@H] 191 0 http://www.arArkivoc
    (Cl)C[C@H]2
    27729 a-Chlordane, ([C@H]
    3 106 16736486 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    ([C@@H]1Cl
    27730 a-hexachloroc)Cl)Cl)Cl)Cl)Cl 159 10468511 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    27731 aceclofenac alCC(C(=O)OC)N 481 25999991 http://sphinx Bendale AR; Shah R; Narkhede SB; Jadhav AG; Vidyasagar G Internatio
    27732 aceclofenac leCC(C)CC(C(=O 505 25999992 http://sphinx Bendale AR; Shah R; Narkhede SB; Jadhav AG; Vidyasagar G Internatio
    27733 aceclofenac prCOC(=O)C1CCC 449 25999993 http://sphinx Bendale AR; Shah R; Narkhede SB; Jadhav AG; Vidyasagar G Internatio
    27734 aceclofenac vaCC(C)C(C(=O) 517 25999994 http://dx.doi
    http://sphinx Bendale AR; Shah R; Narkhede SB; Jadhav AG; Vidyasagar G Internatio
    27735 acenaphthenec1cc2cccc3c2c 94 6478 .org/10.1080
    http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    /106293607
    C1CC2=CC=C
    27736 acenaphthenec1cc2cccc3c2c 95 6478 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    C3=C2C1=CC
    27737 Acenaphthen =C3 95 6478 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    27738 acephate O=C(NP(=O)(O 88 1905 http://chems EPISuite-ChemSpider
    27739 acetaminopheCC(=O)Nc1ccc 170 1906 http://chems EPISuite-ChemSpider
    27740 acetanilide O=C(Nc1ccccc 114.3 880 http://chems
    http://dx.doi EPISuite-ChemSpider
    27741 acetanilide O=C(Nc1ccccc 114 880 .org/10.1080
    http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    /106293607
    27742 acetanilide O=C(Nc1ccccc 114 880 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    CC(=O)NC1=
    27743 Acetanilide CC=CC=C1 114 880 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    27744 acetic acid CC(=O)O 16.6 171 http://chems EPISuite-ChemSpider
    27745 acetonitrile CC#N -46.5 6102 http://www.aAlfa Aesar
    27746 acetonitrile CC#N -48 6102 http://www.c Chemical Book
    27747 acetonitrile CC#N -48 6102 http://www.s Sigma-Aldrich
    27748 acetonitrile CC#N -45 6102 http://en.wikiWikipedia
    27749 acetonitrile CC#N -48 6102 http://www.wo
    Wolfram Alpha
    27750 acetophenoneCC(=O)c1cccc 20 7132 http://dx.doi Bengston G; Panek D; Fritsch D Journal of Membrane Science; 293(1-2
    27751 acetophenoneCC(=O)c1cccc 20.5 7132 http://www.hCRC Handbook
    27752 acetophenoneCC(=O)c1cccc 19.6 7132 http://dx.do Ginzburg BM; Tuichiev Sh Russian Journal of Applied Chemistry; 82(7)
    27753 acetophenoneCC(=O)c1cccc 19 7132 http://msds. Oxford
    27754 acetophenoneCC(=O)c1cccc 19.5 7132 http://www.wWolfram Alpha
    27755 acetylsalicylic CC(=O)Oc1ccc 135 2157 http://dx.doi
    http://chems EPISuite-ChemSpider
    27756 acetylsalicylic CC(=O)Oc1ccc 135 2157 .org/10.1080
    http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    /106293607
    27757 acetylsalicylic CC(=O)Oc1ccc 135 2157 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    27758 acetylsalicylic CC(=O)Oc1ccc 135 2157 http://www.aCRC Handbook of Chemistry and Physics
    27759 acetylsalicylic CC(=O)Oc1ccc 135 2157 http://books Merck Index
    27760 acetylsalicylic CC(=O)OC1=
    CC(=O)Oc1ccc 135 2157 http://www.siSigma-Aldrich
    CC=CC=C1C(
    27761 Acetylsalicylic=O)O 135 2157 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    27762 Acid 9 (No na C1(CC(=C1)C( 70 0 .org/10.1080
    http://www.arArkivoc
    /106293607
    27763 acyclovir C1=NC2=C(N
    O=C2/N=C(\N 257 1945 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    1COCCO)NC(
    27764 Acyclovir =N)N=C2O 255 1945 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    27765 adamantane C1C2CC3CC1C 205.5 8883 http://pubs.a Lam K; Marko xI clearly out of range JCB
    27766 adamantane C1C2CC3CC1C 278.85 8883 http://webbo NIST Web Book
    27767 adamantane C1C2CC3CC1C 269 8883 http://webbo NIST Web Book
    27768 adamantane C1C2CC3CC1C 270.2 8883 http://pubs.a Schleyer PVR; Donaldson MM Journal of the American Chemical Socie
    27769 alanine CC(C(=O)O)N 292 582 http://chems EPISuite-ChemSpider
    27770 alanine C[C@@H](C(= 295 5735 http://www.aAlfa Aesar
    27771 alanine C[C@@H](C(= 292 5735 http://www.c ChemSpider
    27772 alanine C=CCOC1=C(
    C[C@@H](C(= 314.5 5735 http://www.s Sigma-Aldrich
    C=C(C=C1)CC
    27773 Alclofenac (=O)O)Cl 92 28714 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    27774 allyl bromide C=CCBr -119 7553 http://webbo
    http://dx.doi NIST Web Book
    27775 allyl bromide C=CCBr -119.4 7553 .org/10.1080
    http://webbo NIST Web Book
    /106293607
    27776 alpha-hexachlClC1C(Cl)C(Cl) 160 707 01430124
    http://dx.doi RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    27777 aminopyrene CC1=C(C(=O)
    c4cc2ccc1ccc( 116 14613 .org/10.1080
    http://chems EPISuite-ChemSpider
    /106293607
    27778 aminopyrine N(N1C)C2=C
    O=C2\C(=C(/N 107.75 5787 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    C=CC=C2)N(
    27779 Aminopyrine C)C 107.8 5787 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    27780 amobarbital O=C1NC(=O)NC 157 2079 http://chems EPISuite-ChemSpider
    27781 aniline c1ccc(cc1)N -6 5889 http://chems EPISuite-ChemSpider
    27782 aniline c1ccc(cc1)N -6.2 5889 http://www.chChemGuide
    27783 aniline c1ccc(cc1)N -6 5889 http://www.c Chemical Land
    27784 aniline c1ccc(cc1)N -6.2 5889 http://www.daInternet Encyclopedia of Science
    27785 aniline c1ccc(cc1)N -6 5889 http://msds.c Oxford
    27786 aniline c1ccc(cc1)N -6.3 5889 http://en.wikiWikipedia
    27787 anthracene c1ccc2cc3cccc 216 8111 http://dx.doi
    http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    27788 anthracene c1ccc2cc3cccc 216 8111 .org/10.1080
    http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    /106293607
    27789 anthracene C1=CC=C2C=
    c1ccc2cc3cccc 216.3 8111 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    C3C=CC=CC3
    27790 Anthracene =CC2=C1 216.3 8111 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    27791 antipyrine O=C2\C=C(/N( 68 2121 http://chems EPISuite-Chemx value clearly out of range JCB
    http://dx.doi
    27792 antipyrine O=C2\C=C(/N( 111 2121 .org/10.1080
    http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    /106293607
    27793 antipyrine O=C2\C=C(/N( 112.25 2121 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    27794 antipyrine CC1=CC(=O)
    O=C2\C=C(/N( 108.85 2121 http://webbooNIST Web Book
    N(N1C)C2=C
    27795 Antipyrine C=CC=C2 112.3 2121 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    27796 apocynin Oc1ccc(cc1OC 114.5 21106900 http://www.aAlfa Aesar
    27797 ascorbic acid C([C@@H]([C 168.5 10189562 http://chems EPISuite-ChemSpider
    27798 ascorbic acid C([C@@H]([C 191 10189562 http://www.aCRC Handbook of Chemistry and Physics
    27799 ascorbic acid C([C@@H]([C 191 10189562 http://www.siSigma-Aldrich
    27800 ascorbic acid C([C@@H]([C 192 10189562 http://www.siSigma-Aldrich
    27801 asparagine O=C(N)CC(N)C
    CC(C)NCC(CO 234.5 231 http://chems EPISuite-ChemSpider
    27802 aspartic acid C1=CC=C(C=
    C(C(C(=O)O)N 275 411 http://chems EPISuite-ChemSpider
    C1)CC(=O)N)
    27803 Atenolol O 146 2162 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    27804 atrazine Clc1nc(nc(n1) 175 2169 .org/10.1080
    http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    /106293607
    27805 atrazine CC/N=C/1\N
    Clc1nc(nc(n1) 177 2169 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    /C(=N/C(C)C)
    27806 Atrazine /NC(=N1)Cl 177 2169 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    27807 B-carotene CC2(C)CCCC(\ 183 4444129 http://www.aCRC Handbook of Chemistry and Physics
    27808 B-carotene CC2(C)CCCC(\
    C1C2C(C(C1C 183 4444129 http://books Merck Index
    27809 B-carotene l)Cl)C3(C(=C(
    CC2(C)CCCC(\ 180 4444129 http://www.siSigma-Aldrich
    C2(C3(Cl)Cl)C
    27810 b-Chlordane, l)Cl)Cl)Cl 104 21429023 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    27811 B,B-dimethylacO=C(O)\C=C(/ 69.5 10468 http://chems EPISuite-ChemSpider
    27812 barbital CCC1(C(=O)N 190 2206 http://dx.doi
    http://chems EPISuite-ChemSpider
    27813 barbital CCC1(C(=O)N 190 2206 .org/10.1080
    http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    /106293607
    27814 barbital CCC1(C(=O)N
    CCC1(C(=O)N 190 2206 http://dx.doi
    01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    C(=O)NC1=O
    27815 Barbital )CC 190 .org/10.1080
    2206 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    /106293607
    27816 barbituric aci O=C1NC(=O)N 248 5976 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    C1C(=O)NC(=
    27817 Barbituric aci O)NC1=O 248 5976 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    27818 benzalaniline c1ccc(cc1)/C= 51 10400 http://pubs.a Kuder JE; Gibson HW; Wychick D Journal of Organic Chemistry; 40(7);
    27819 benzalaniline c1ccc(cc1)/C= 49 10400 http://useful UsefulChem
    27820 benzalaniline c1ccc(cc1)/C= 46 10400 http://useful UsefulChem
    27821 benzaldehydec1ccc(cc1)C=O -26 235 http://chems EPISuite-Chemx repeating value clearly out of range cc
    27822 benzaldehydec1ccc(cc1)C=O -26.15 235 http://pubs.a Agell Sare Glax kelvin repeating value clearly out of range
    27823 benzaldehydec1ccc(cc1)C=O -56.5 235 http://reaxys Reaxys pending ILL
    27824 benzaldehydec1ccc(cc1)C=O -55.6 235 http://reaxys Reaxys pending ILL
    27825 benzaldehydec1ccc(cc1)C=O -56.9 235 http://reaxys Reaxys pending ILL
    27826 benzamide c1ccc(cc1)C(= 126.5 2241 http://www.siSigma-Aldrich
    27827 benzene c1ccccc1 5.51 236 http://www.alAlfa Aesar
    27828 benzene c1ccccc1 5.49 236 http://www.hCRC Handbook
    27829 benzene c1ccccc1 5.5 236 http://www.epEPA
    27830 benzene c1ccccc1 5.6 236 http://www.c NIOSH
    27831 benzene c1ccccc1
    C1=CC=C(C= 5.5 236 http://en.wik Wikipedia
    27832 benzil C1)C(=O)C(=
    c1ccc(cc1)C(= 95 8329 http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    O)C2=CC=CC
    27833 Benzil =C2 95 8329 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    27834 benzilic acid O=C(O)C(O)(c1 151 6220 http://www.c EPISuite-ChemSpider
    27835 benzilic acid O=C(O)C(O)(c1 148.85 6220 http://webbooNIST Web Book
    27836 benzilic acid O=C(O)C(O)(c1 149.85 6220 http://webbooNIST Web Book
    27837 benzimidazolec1ccc2c(c1)[n 170.5 5593 http://dx.doi
    http://chems EPISuite-ChemSpider
    27838 benzo(a)pyre c1ccc2c(c1)cc 179 2246 .org/10.1080
    http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    /106293607
    27839 benzo[a]pyre c1ccc2c(c1)cc 176 2246 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    C1=CC=C2C3
    =C4C(=CC2=
    C1)C=CC5=C
    4C(=CC=C5)C
    27840 Benzo[a]pyre =C3 176 2246 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    27841 benzocaine CCOC(=O)C1
    O=C(OCC)c1cc 92 13854242 http://chems EPISuite-ChemSpider
    =CC=C(C=C1)
    27842 Benzocaine, E N 90 13854242 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    27843 benzoic acid c1ccc(cc1)C(= 122.4 238 http://chems
    http://dx.doi EPISuite-ChemSpider
    27844 benzoic acid c1ccc(cc1)C(= 122 238 .org/10.1080
    http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    /106293607
    27845 benzoic acid c1ccc(cc1)C(= 122.5 238 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    27846 benzoic acid c1ccc(cc1)C(= 122.35 238 http://www.aCRC Handbook of Chemistry and Physics
    27847 benzoic acid c1ccc(cc1)C(= 122.4 238 http://books Merck Index
    27848 benzoic acid c1ccc(cc1)C(=
    C1=CC=C(C= 123 238 http://www.siSigma-Aldrich
    C1=CC=C(C=
    27849 Benzoic acid C1)C(C(=O)C
    C1)C(=O)O 122 238 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    2=CC=CC=C2
    27850 Benzoin )O 137 8093 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    27851 benzyl merca SCc1ccccc1 -29 13851383 http://www.c ChemBlink
    27852 benzyl merca SCc1ccccc1 -29.2 13851383 http://www.mMerck Chemicals
    27853 benzylamine c1ccc(cc1)CN 10 7223 http://chems EPISuite-ChemSpider
    27854 benzylamine c1ccc(cc1)CN -30 7223 http://www.chChemSynthesis
    27855 benzylamine c1ccc(cc1)CN -46 7223 http://msds.c Oxford
    27856 benzylamine c1ccc(cc1)CN -10 7223 http://www.pPharmacoAAPI
    27857 benzylamine c1ccc(cc1)CN 10 7223 http://tinyur Sigma-Aldrich
    27858 beta-alanine O=C(O)CCN 200 234 http://chems EPISuite-ChemSpider
    27859 beta-caroteneCC2(C)CCCC(\ 180 4444129 http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    C1=CC=C(C=
    C1=CC=C(C=
    27860 bibenzyl c1ccc(cc1)CCc
    C1)C2=CC=C( 52 7364 http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    C1)CCC2=CC
    27861 Bibenzyl C=C2)C(C3=C
    =CC=C2 52 7364 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    C=CC=C3)N4
    27862 Bifonazole C=CN=C4 142 2287 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    27863 biphenyl c1ccc(cc1)c2c 12 6828 http://dx.doi
    http://chems EPISuite-Chemx value clearly out of range JCB
    27864 biphenyl c1ccc(cc1)c2c 69 6828 .org/10.1080
    http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    /106293607
    27865 biphenyl c1ccc(cc1)c2c 70 6828 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    27866 biphenyl C1=CC=C(C=
    c1ccc(cc1)c2c 69.85 6828 http://webbooNIST Web Book
    C1)C2=CC=C
    27867 Biphenyl C=C2 69 6828 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    27868 boc-alanine O=C(OC(C)(C) 79.5 76745 http://www.aAlfa Aesar
    27869 boc-glycine O=C(OC(C)(C) 88.5 70660 http://www. Alfa Aesar
    27870 boc-glycine O=C(OC(C)(C) 87.5 70660 http://www. Sigma-Aldrich
    27871 boc-phenylalaO=C(OC(C)(C) 87 70249 http://www.aAlfa Aesar
    27872 boc-serine O=C(OC(C)(C) 90.5 89204 http://www.aAlfa Aesar
    27873 busulfan O=S(=O)(OCCC 115.5 2384 http://tinyur Sigma-Aldrich
    27874 butabarbital O=C1NC(=O)NC 166.5 2385 http://chems EPISuite-ChemSpider
    27875 butane CCCC -138.34 7555 http://pubs.a
    http://dx.doi Carruth GF; Kobayahsi R Journal of Chemical and Engineering Data; 18
    27876 butane CCCC -137.15 7555 .org/10.1080
    http://webbo NIST Web Book
    /106293607
    CCCCOC(=O)
    27877 butyl 4-aminoO=C(OCCCC)c1 58 2388 01430124
    C1=CC=C(C= http://dx.doi RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    27878 Butyl 4-aminoC1)N 58 2388 .org/10.1080
    http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    /106293607
    27879 butyl 4-hydro CCCCOC(=O)
    O=C(OCCCC)c1 69 6916 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    C1=CC=C(C=
    27880 Butyl 4-hydro C1)O 69 6916 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    27881 butyl butyrateO=C(OCCCC)C -92 7694 http://www.acAcros
    27882 butyl butyrateO=C(OCCCC)C -92 7694 http://www.c Chemical Book
    27883 butyl butyrateO=C(OCCCC)C -91.5 7694 http://www.hCRC Handbook
    27884 butyl butyrateO=C(OCCCC)C -91.5 7694 http://en.wik Wikipedia
    27885 butyl butyrateO=C(OCCCC)C -92 7694 https://fscim Fisher
    27886 butyl p-aminoO=C(OCCCC)c1 58 2388 http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    27887 butyl p-hydro O=C(OCCCC)c1 69 6916 http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    27888 butylparaben O=C(OCCCC)c1 68.5 6916 http://chems EPISuite-ChemSpider
    27889 butylparaben O=C(OCCCC)c1 68.5 6916 http://www.siSigma-Aldrich
    27890 butylparaben O=C(OCCCC)c1 69 6916 http://www.siSigma-Aldrich
    27891 butyric acid CCCC(=O)O -5.7 259 http://chems EPISuite-ChemSpider
    27892 caffeine Cn1cnc2c1c(= 238 2424 http://dx.doi
    http://chems EPISuite-ChemSpider
    27893 caffeine Cn1cnc2c1c(= 238 2424 .org/10.1080
    http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    /106293607
    27894 caffeine CN1C=NC2=
    Cn1cnc2c1c(= 235.25 2424 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    C1C(=O)N(C(
    27895 Caffeine =O)N2C)C 236 2424 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    27896 camphoric aciO=C(O)C1CCC( 187 20198 http://chems EPISuite-ChemSpider
    27897 carbamazepinc1ccc2c(c1)C 190.2 2457 http://chems EPISuite-ChemSpider
    27898 carbazepine c1ccc2c(c1)C 190.2 2457 http://www.aCRC Handbook of Chemistry and Physics
    27899 carbazepine c1ccc2c(c1)C 191.5 2457 http://dx.doi
    http://books Merck Index
    27900 carbazepine c1ccc2c(c1)C 191.5 2457 .org/10.1080
    http://www.siSigma-Aldrich
    /106293607
    27901 carbazole C1=CC=C2C(
    c1ccc2c(c1)c3 247 6593 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    =C1)C3=CC=
    27902 Carbazole CC=C3N2 247 6593 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    27903 carbon tetrachClC(Cl)(Cl)Cl -23 5730 http://www.kMerck Index
    27904 carbon tetrachClC(Cl)(Cl)Cl -23 5730 http://www.c NIOSH
    27905 carbon tetrachClC(Cl)(Cl)Cl -23 5730 http://msds.c Oxford
    27906 carbon tetrachClC(Cl)(Cl)Cl -23 5730 http://datash Santa Cruz Biotechnology
    27907 carbon tetrachClC(Cl)(Cl)Cl -22.92 5730 http://en.wik Wikipedia
    27908 celecoxib O=S(=O)(c3ccc 158 2562 http://chems EPISuite-ChemSpider
    27909 chloroacetic aClCC(O)=O 61.5 10772140 http://www.aAlfa Aesar
    27910 chloroform ClC(Cl)Cl -63.2 5977 http://dx.doi Archibald EH; McIntosh D Journal of the American Chemical Society; 2
    27911 chloroform ClC(Cl)Cl -63.5 5977 http://link.ai Bridgman PW Journal of Chemical Physics; 9(11); 794-797 (1941)
    27912 chloroform ClC(Cl)Cl -63.41 5977 http://www.hCRC Handbook
    27913 chloroform ClC(Cl)Cl -63.5 5977 http://www.cdNIOSH
    27914 chloroform ClC(Cl)Cl -63 5977 http://www.c NIOSH
    27915 chloroform ClC(Cl)Cl -63 5977 http://msds.c Oxford
    27916 chloroform ClC(Cl)Cl -63 5977 http://www.s Sigma-Aldrich
    27917 chloroquine Clc1cc2nccc( 193 2618 http://webbo NIST Web Boox too high - probably salt JCB
    27918 chloroquine Clc1cc2nccc( 289 2618 http://www.wo
    WolframAlfa x too high - probably salt JCB
    27919 chloroquine Clc1cc2nccc( 89.5 2618 http://www.i InChem
    27920 chloroquine Clc1cc2nccc( 89 2618 https://scifin Doklady
    27921 chloroquine Clc1cc2nccc( 89.5 2618 https://scifin Journal of the American Chemical Society
    27922 chloroquine Clc1cc2nccc( 88 2618 https://scifin patent DE 683692
    C[C@H]
    27923 chloroquine Clc1cc2nccc( 87 2618 https://scifin National Library of Medicine
    (CCCC(C)C)
    27924 chloroquine [C@H]1CC[C
    Clc1cc2nccc( 86.5 2618 https://scifin Drugs Synonyms and Properties
    @@H]2[C@
    27925 cholesterol C[C@H](CCCC 148.5 5775 http://www.aCRC Handbook of Chemistry and Physics
    @]1(CC[C@
    27926 cholesterol H]3[C@H]2C
    C[C@H](CCCC 148.5 5775 http://books Merck Index
    27927 cholesterol C=C4[C@@]
    C[C@H](CCCC 148 5775 http://www.siSigma-Aldrich
    3(CC[C@@H
    27928 Cholesterol ](C4)O)C)C 148 5775 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    27929 chrysene c1ccc2c(c1)cc 258 8817 http://dx.doi
    http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    27930 chrysene c1ccc2c(c1)cc
    C1=CC=C2C( 258 8817 .org/10.1080
    http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    /106293607
    27931 chrysene =C1)C=CC3=
    c1ccc2c(c1)cc 255 8817 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    C2C=CC4=CC
    27932 Chrysene =CC=C43 255 8817 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    27933 cinnamic acid O=C(O)\C=C\c 133 392447 http://chems EPISuite-ChemSpider
    27934 cis-2-penteneC(=C\CC)\C -151.41 4483638 http://webbo NIST Web Book
    27935 cis-decalin C1CC[C@H]2C -43 10179239 http://tinyur Sigma-Aldrich
    27936 citric acid an C(C(=O)O)C(C 153 305 http://chems EPISuite-ChemSpider
    27937 citric acid m C(C(=O)O)C(C 153 305 http://chems EPISuite-Chemx hydrate JCB
    27938 cocaine C1=CC2=C3C
    CN1[C@H]2CC 93.5 10194104 http://dx.doi
    http://pubs.a Lin R; Castells J; Rapoport H Journal of Organic Chemistry; 63(12); 406
    4=C1C=CC5=
    27939 coronene c1cc2ccc3ccc
    C4C6=C(C=C 438 8761 .org/10.1080
    http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    /106293607
    27940 coronene 5)C=CC7=C6
    c1cc2ccc3ccc 440 8761 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    C3=C(C=C2)C
    27941 Coronene =C7 438 8761 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    C[C@]12CCC
    27942 cortexolone O=C4\C=C2/[
    (=O)C=C1CC[ 208 389582 http://dx.doi
    http://www.siSigma-Aldrich
    27943 cortisone C@@H]3[C
    O=C(CO)[C@@ 222 193441 .org/10.1080
    http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    @@H]2C(=O /106293607
    27944 cortisone O=C(CO)[C@@
    )C[C@]4([C 225.5 193441 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    27945 cortisone @H]3CC[C@
    O=C(CO)[C@@ 225.5 193441 http://www.siSigma-Aldrich
    @]4(C(=O)C
    27946 Cortisone O)O)C 225 193441 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    27947 crotonaldehy O=C/C=C/C -76.5 394562 http://chems EPISuite-ChemSpider
    27948 crotonic acid O=C(O)/C=C/C 72 552744 http://chems EPISuite-ChemSpider
    27949 cyclobutane C1CCC1 -90.67 8894 http://www.c Cheric
    27950 cyclobutanecaC1(CCC1)C(=O -1 18370 http://www.hCRC Handbook of Chemistry and Physics
    27951 cyclobutanecaC1(CCC1)C(=O -2.5 18370 http://www.kKangpu
    27952 cyclobutanecaC1(CCC1)C(=O -7.1 18370 http://webbo NIST Web Book
    27953 cyclobutanecaC1(CCC1)C(=O -7.5 18370 http://tinyurl Sigma-Aldrich
    27954 cyclobutanon C1(CCC1)=O -52 13840 http://online Arndt; R; Günthard HHs; Gäumann T Helvetica Chimica Acta; 41(7); 22
    27955 cyclobutylamiC1(CCC1)N -4 68166 http://tinyur Michemical
    27956 cyclobutylme C1(CCC1)C -161.51 11232 http://pubs.a Lemaire HP; Livingston RL Journal of the American Chemical Society; 7
    27957 cyclohexane C1CCCCC1 6.45 7787 http://webbo NIST Web Book
    27958 cyclohexanec O=CC1CCCCC1 34.5 15443 http://www.aAlfa Aesar
    27959 cyclohexanecaO=C(O)C1CCC 31.5 7135 http://chems EPISuite-ChemSpider
    27960 cyclohexanecaC1(CCCCC1)C( 30 7135 http://www.t GoodScents
    27961 cyclohexaneprO=C(O)CCC1C 16 62903 http://chems EPISuite-ChemSpider
    27962 cyclohexanol C1(CCCCC1)O 25.93 7678 http://www.hCRC Handbook of Chemistry and Physics
    27963 cyclohexanonC1CCC(=O)CC -47 7679 http://www.acAcros x clearly out of range JCB
    27964 cyclohexanonC1CCC(=O)CC -47 7679 http://www.s Sigma-Aldrichx clearly out of range JCB
    27965 cyclohexanonC1CCC(=O)CC -47 7679 http://www.wWolfram Alphx clearly out of range JCB
    27966 cyclohexanonC1CCC(=O)CC -26 7679 http://www.aAlfa Aesar
    27967 cyclohexanonC1CCC(=O)CC -32 7679 http://msds.c Oxford
    27968 cyclohexanonC1(CCCCC1)= -29.05 7679 http://pubs.a Conn JB; Kistiakowsky GB; Smith EA Journal of the American Chemica
    27969 cyclohexanonC1(CCCCC1)= -27.9 7679 http://www.hCRC Handbook of Chemistry and Physics
    27970 cyclohexylamiNC1CCCCC1 -17.7 7677 http://chems EPISuite-ChemSpider
    27971 cyclopentane C1CCCC1 -93.95 8896 http://webbo NIST Web Book
    27972 cyclopentanecC1(CCCC1)C(= 4 17789 http://www.c ChemBlink
    27973 cyclopentanecC1(CCCC1)C(= 3.5 17789 http://pubs.a Payne GB; Smith CW Journal of Organic Chemistry; 22(12); 1680-1682
    27974 cyclopentanolC1(CCCC1)O -17.5 7026 http://www.hCRC Handbook of Chemistry and Physics
    27975 cyclopentanolC1(CCCC1)O -16.25 7026 http://pubs.a Parks GS; Kennedy WD; Gates RR; Mosley JR; Moore GE; Renquist ML
    27976 cyclopentanolC1(CCCC1)O -20 7026 http://pubs.a White AH; Bishop WS Journal of the American Chemical Society; 62(1
    27977 cyclopentano C1(CCCC1)=O -51.9 8141 http://www.hCRC Handbook of Chemistry and Physics
    27978 cyclopentylamC1(CCCC1)N -85.7 2803 http://tinyur Labruyère-Verhavert ML; Bulletin des Sociétés Chimiques Belges; 60(
    27979 cyclopropane C1CC1 -127.15 6111 http://webbooNIST Web Book
    27980 cyclopropane C1CC1 -127.56 6111 http://pubs.a Ruehrwein RA; Powell TM Journal of the American Chemical Society;
    27981 cyclopropanecC1(CC1)C(=O) 18 14890 http://www.c ChemBlink
    27982 cyclopropanecC1(CC1)C(=O) 15.5 14890 http://www.c ChemicalBook
    27983 cyclopropanecC1(CC1)C(=O) 18.5 14890 http://www.c Chemyq
    27984 cyclopropanecC1(CC1)C(=O) 16.75 14890 http://online Subbotin OA; Kozmin AS; Grishin YuK; Sergeyev NM; Bolesov IG Organ
    27985 cyclopropylamC1(CC1)N -50 63025 http://www.c ChemBlink
    27986 cyclopropylamC1(CC1)N -35.39 63025 http://www.hCRC Handbook of Chemistry and Physics
    27987 cyclopropylm C1(CC1)C -177.16 11167 http://pubs.a Gragson JT; Greenlee KW; Derfer JM; Boord CE Journal of the America
    27988 cyclopropylm C1(CC1)C -177.25 11167 http://webbo NIST Web Book
    27989 cyproheptadi c43\C(=C1/CC 111.5 2810 http://webbo NIST Web Book
    27990 D-galactose O=C[C@H](O) 167 2301265 http://www.drDrugLead
    27991 D-mannitol C([C@H]([C@ 189.5 6015 http://chems
    http://pubs.a EPISuite-ChemSpider
    27992 D-p-hydroxyphO=C(O)CNc1cc 246 60494 cs.org/doi/a
    http://chems EPISuite-ChemSpider
    bs/10.1021/
    27993 danazol C#C[C@]5(O) 225 26436 ci700096r Wang JM; Hou TJ and Xu XJ. J. Chem. Inf. Model. 2009 49 (3) [Lit]
    27994 DCC N(=C=N\C1CC 34.5 10408 http://www. Alfa Aesar
    27995 DCC N(=C=N\C1CC 34.5 10408 http://www.c Chemical Book
    27996 DCC N(=C=N\C1CC 35.5 10408 http://www.mMerck Chemicals
    27997 DCC N(=C=N\C1CC 35.75 10408 http://www. Sigma-Aldrich
    27998 DCC N(=C=N\C1CC 36 10408 http://www.wo
    Wolfram Alpha
    27999 DDT Clc1ccc(cc1)C( 109 2928 http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    28000 DDT Clc1ccc(cc1)C( 109 2928 http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    28001 DDT Clc1ccc(cc1)C( 108.75 2928 http://pmep.cCornell
    28002 DDT Clc1ccc(cc1)C( 108.3 2928 http://www.c NIOSH
    28003 DDT Clc1ccc(cc1)C( 108.5 2928 http://msds. Oxford
    28004 DDT Clc1ccc(cc1)C( 108.75 2928 http://www.t PiedPiper
    28005 DDT Clc1ccc(cc1)C( 108.75 2928 http://www.wh
    http://dx.doi WHO
    C1(=C(C(=C(C
    28006 decachlorobipClc1c(c(Cl)c(Cl
    (=C1Cl)Cl)Cl) 306 15484 .org/10.1080
    http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    /106293607
    Cl)Cl)C2=C(C(
    28007 decachlorobipClc1c(c(Cl)c(Cl 306 15484 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    =C(C(=C2Cl)C
    28008 decachlorobipl)Cl)Cl)Cl 306 15484 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    C[C@]12CC[
    28009 decane CCCCCCCCCC
    C@H]3[C@H -29.85 14840 http://webbo NIST Web Book
    ]
    28010 decanoic acid O=C(O)CCCCC 31 2863 http://msds.c
    http://dx.doi Oxford
    ([C@@H]1C
    28011 deoxycorticosO=C4\C=C2/[
    C[C@@H]2C 142 5932 .org/10.1080
    http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    /106293607
    (=O)CO)CCC4
    28012 deoxycorticosO=C4\C=C2/[ 141.5 5932 01430124
    =CC(=O)CC[C http://dx.doi RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    28013 Deoxycorticos@]34C 142 5932 .org/10.1080
    http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    /106293607
    28014 dextromorphaO(c1ccc3c(c1 110 13109865 01430124
    http://dx.doi RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    28015 diazepam CN1c2ccc(cc2
    CN1C(=O)CN 132 2908 .org/10.1080
    http://chems EPISuite-ChemSpider
    /106293607
    28016 diazepam =C(C2=C1C=
    CN1c2ccc(cc2 130 2908 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    CC(=C2)Cl)C3
    C1=CC=C2C(
    28017 Diazepam =CC=CC=C3
    =C1)C=CC3= 130 2908 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    CC4=C(C=CC
    28018 dibenz[a,h]anc1ccc2c(c1)cc 270 5678 http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    5=CC=CC=C5
    28019 Dibenz[ah]ant4)C=C32 269 5678 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28020 dibenzalacetoO=C(\C=C\c1c 113 555548 http://www.t Tokyo Chemical Industry UK Ltd
    28021 dibenzalacetoO=C(\C=C\c1c 110.5 555548 http://www.oOrganic Synthesis
    28022 dibenzalacetoO=C(\C=C\c1c 111 555548 http://dx.doi
    http://pubs.a Journal of Chemical Education
    28023 dibenzalacetoO=C(\C=C\c1c 103.5 555548 .org/10.1080
    http://useful UsefulChem
    /106293607
    28024 dibenzo[a,h]ac1ccc2c(c1)cc 266.5 5678 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    28025 dibenzofuran C1=CC=C2C(
    o2c1ccccc1c3 82 551 http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    =C1)C3=CC=
    28026 Dibenzofuran CC=C3O2 82 551 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28027 dibucaine O=C(c1c2cccc 64.5 2917 http://books Analytical Profiles of Drug Substances. Volume 12
    28028 dichloroaceticClC(Cl)C(O)=O 10 10771217 http://www.acAcros
    28029 dichloroaceticClC(Cl)C(O)=O 10 10771217 http://www.aAlfa Aesar
    28030 dichloroaceticClC(Cl)C(O)=O 10 10771217 http://www.c ChemExper
    28031 dichloroaceticClC(Cl)C(O)=O 10 10771217 http://www.c Chemical Land
    28032 dichloroaceticClC(Cl)C(O)=O 13.5 10771217 http://www.epEPA
    28033 dichloroaceticClC(Cl)C(O)=O 11 10771217 http://www.kKnovel
    28034 dichloroaceticClC(Cl)C(O)=O 10 10771217 http://www.l LookChem
    28035 dichloroaceticClC(Cl)C(O)=O 13.5 10771217 http://www.c NIOSH
    28036 dichloroaceticClC(Cl)C(O)=O 10 10771217 http://www.s Sigma-Aldrich
    28037 dichloroaceticClC(Cl)C(O)=O -4 10771217 http://dx.doi
    http://ull.ch University of Akron
    28038 dichloroaceticClC(Cl)C(O)=O
    C1=CC=C(C(= 9.8 10771217 .org/10.1080
    http://www4.MPBio
    /106293607
    28039 diclofenac C1)CC(=O)O)
    c1ccc(c(c1)CC 157 2925 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    NC2=C(C=CC
    28040 Diclofenac =C2Cl)Cl 157 2925 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    C1C2C3C(C1
    28041 dieldrin ClC5(Cl)[C@]
    C4C2O4)C5( 175 10292746 .org/10.1080
    http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    /106293607
    28042 dieldrin C(=C(C3(C5(C
    Cl\C1=C(/Cl)C 175.5 2940 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    l)Cl)Cl)Cl)Cl)C
    28043 Dieldrin l 175 2940 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28044 diflunisal O=C(O)c1cc(cc 215.5 2951 http://chems EPISuite-ChemSpider
    28045 diflunisal O=C(O)c1cc(cc 210.5 2951 http://books Merck Index
    28046 dimethyl fumaO=C(OC)\C=C\ 103.5 553171 http://chems EPISuite-ChemSpider
    CC1=NC=C(N
    28047 dimetridazoleO=[N+]([O-])c 140 2980 http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    1C)[N+](=O)
    28048 Dimetridazole[O-] 140 2980 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28049 diphenylaceticO=C(O)C(c1ccc 147 8030 http://chems
    http://dx.doi EPISuite-ChemSpider
    28050 diphenylaminc1ccc(cc1)Nc2 52 11003 .org/10.1080
    http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    /106293607
    C1=CC=C(C=
    28051 diphenylaminc1ccc(cc1)Nc2 53.5 11003 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    C1)NC2=CC=
    28052 DiphenylaminCC=C2 53 11003 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28053 diphenyletha c1(ccccc1)C(c 25 11424 http://www.aSepassi K; Ya x value out of range of many other sources
    28054 diphenylmethc1c(cccc1)Cc2 90.5 7299 http://dx.doi
    http://nopr. Manih RM; Myrboh B Indian Journal of Chemistry; 48B(1),146-151 (20
    28055 diuron Clc1ccc(NC(=O 159 3008 .org/10.1080
    http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    /106293607
    28056 diuron CN(C)C(=O)N
    Clc1ccc(NC(=O 158.5 3008 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    C1=CC(=C(C=
    28057 Diuron C1)Cl)Cl 159 3008 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28058 E-crotononitriN#C/C=C/C -51.5 553494 https://scifin PhysProp
    28059 eflucimibe O=C(Nc1c(c(c -144.25 7980500 http://www.s Rodier E; Lochard H; Sauceau M; Letourneau J; Freiss B; Fages J. A thr
    28060 EGCG O=C(O[C@@H]2 141 58575 http://www.s Korul’kina LM; Shul’ts EE; Zhusupova GE; Abilov ZA; Erzhanov KB; Cha
    28061 EGCG O=C(O[C@@H]2 218 58575 http://www.kMerck
    http://dx.doi Index
    C1C2C3C(C1
    28062 ellagic acid O=C1Oc3c2c4c
    C4C2O4)C5( 450 4445149 .org/10.1080
    http://www.aAlfa Aesar
    /106293607
    28063 endrin C(=C(C3(C5(C
    Cl\C1=C(/Cl)C 210 2940 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    l)Cl)Cl)Cl)Cl)C
    28064 Endrin l
    C[C@]12CC[ 210 2940 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    C@H]3[C@H
    28065 epichlorohydrClCC1CO1 -57.1 13837112 .org/10.1080
    http://www.wWDTrade
    ] /106293607
    28066 estradiol C[C@]12CC[C
    ([C@@H]1C 176 5554 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    28067 estradiol C[C@@H]2O
    C[C@]12CC[C 178 5554 http://www.siSigma-Aldrich
    )CCC4=C3C=
    28068 Estradiol CC(=C4)O 176 5554 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28069 estriol Oc1cc3c(cc1 281 5553 http://www.siSigma-Aldrich
    http://dx.doi
    28070 estrone O=C4[C@]3(C 259 5660 .org/10.1080
    http://www.siSigma-Aldrich
    /106293607
    28071 ethacrynic aciClc1c(C(=O)\C 121 3163 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    28072 ethane CC -172.15 6084 http://pubs.a Streng AG Joux clearly out of range JCB
    28073 ethane CC -183.33 6084 http://pubs.a Burnett LJ; Muller BH Journal of Chemical and Engineering Data 15(1)
    28074 ethane CC -182.78 6084 http://jcp.ai Givens FL; McCormick WD Journal of Chemical Physics; 67(3); 1150-1
    28075 ethane CC -183.28 6084 http://pubs.a Witt RK; Kemp JD Journal of the American Chemical Society; 59(2); 27
    28076 ethane CC -182.85 6084 http://www.c Cheric
    28077 ethanol CCO -114.14 682 http://www.hCRC Handbook
    28078 ethanol CCO -114.4 682 http://books Merck Index
    28079 ethanol CCO -114 682 http://msds.c Oxford
    28080 ethanol CCO -114 682 http://www.s Sigma-Aldrich
    28081 ethanol CCO -114.3 682 http://en.wikiWikipedia
    28082 Ethyl (1R,2R,3C(C)(C)(C)OC 129.5 0 http://www.beBeilstein Journal of Organic Chemistry
    28083 Ethyl (1R,2S,3N([C@H]1[C@@ 120.5 0 http://www.beBeilstein Journal of Organic Chemistry
    28084 Ethyl (1R,2S, C(C)(=O)[C@H 109.5 0 http://www.beBeilstein Journal of Organic Chemistry
    28085 Ethyl (1S,2R,3C(C)(C)(C)O 141.5 0 http://www.beBeilstein Journal of Organic Chemistry
    28086 Ethyl (1S,2R,3C(C)(C)(C)OC 166.5 0 http://dx.doi
    http://www.beBeilstein Journal of Organic Chemistry
    28087 Ethyl (1S,2S,3 C(C)(C)(C)O 144.5 0 .org/10.1080
    http://www.beBeilstein Journal of Organic Chemistry
    /106293607
    CCOC(=O)C1
    28088 ethyl 4-aminoO=C(OCC)c1cc 89 13854242 http://dx.doi
    01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    =CC=C(C=C1)
    28089 Ethyl 4-aminoN 89 .org/10.1080
    13854242 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    /106293607
    28090 ethyl 4-hydro CCOC(=O)C1
    O=C(OCC)c1cc 117 13846749 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    =CC=C(C=C1)
    28091 Ethyl 4-hydro O 116 13846749 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28092 ethyl maltol O=C\1C(/O)=C 162 19804 http://www.aAlfa Aesar
    28093 ethyl p-aminoO=C(OCC)c1cc 89 13854242 http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    28094 ethyl p-hydro O=C(OCC)c1cc 116 8127 http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    28095 ethylene C=C -169.2 6085 http://www.joOka T; Sato S Bulletin of the Chemical Society of Japan; 42(2); 582 (19
    28096 ethylene C=C -169.35 6085 http://dx.doi
    http://pubs.a Streng AG Journal of Chemical and Engineering Data; 16(3); 357-359 (
    28097 ethylparaben O=C(OCC)c1cc
    C1=CC=C(C= 115.5 8127 .org/10.1080
    http://www.siSigma-Aldrich
    /106293607
    28098 fenbufen C1)C2=CC=C(
    O=C(O)CCC(=O 186 3218 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    C=C2)C(=O)C
    28099 Fenbufen CC(=O)O 186 3218 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28100 fenchlorphos Clc1cc(OP(=S)
    COP(=S) 35 8939 .org/10.1080
    http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    C1=CC=C(C= /106293607
    28101 fenchlorphos (OC)OC1=CC(
    Clc1cc(OP(=S)
    C1)C2=NC(=C 35 8939 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    =C(C=C1Cl)Cl
    28102 Fenchlorphos (S2)CC(=O)O)
    )Cl 38 8939 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    C3=CC=C(C=
    28103 Fentiazac C3)Cl 161 26854 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28104 fenuron O=C(Nc1ccccc 134 7279 http://dx.doi
    http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    28105 fenuron O=C(Nc1ccccc 134 7279 .org/10.1080
    http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    /106293607
    28106 fenuron CN(C)C(=O)N
    O=C(Nc1ccccc 132 7279 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    C1=CC=C(C(=
    C1=CC=CC=C
    28107 Fenuron C1)C(=O)O)N
    1 132 7279 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    C2=CC=CC(=
    28108 Flufenamic AcC2)C(F)(F)F 125 3254 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28109 fluoranthene c1ccc-2c(c1)-
    C1=CC=C2C( 108 8800 .org/10.1080
    http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    /106293607
    28110 fluoranthene =C1)C3=CC=
    c1ccc-2c(c1)- 108.5 8800 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    CC4=C3C2=C
    28111 Fluoranthene C=C4 108 8800 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28112 fluorene c1ccc-2c(c1)C 112 6592 .org/10.1080
    http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    /106293607
    28113 fluorene C1C2=CC=CC
    c1ccc-2c(c1)C 116 6592 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    =C2C3=CC=C
    28114 Fluorene C1=CC(=CC=
    C=C31 116 6592 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    C1[N+](=O)
    28115 fluorodifen [O-][N+](=O)c
    [O-])OC2=C( 94 25404 .org/10.1080
    http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    /106293607
    28116 fluorodifen C=C(C=C2)C(
    [O-][N+](=O)c 90 25404 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    F)(F)F)[N+]
    28117 Fluorodifen (=O)[O-] 90 25404 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28118 fluoromethanCF -143.3 11148 http://www.hCRC Handbook
    28119 fluoromethanCF -141.85 11148 http://www.c
    http://dx.doi KDB
    28120 flurbiprofen Fc2cc(ccc2c1c 111 3277 .org/10.1080
    http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    /106293607
    28121 flurbiprofen Fc2cc(ccc2c1c 114.7 3277 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    28122 flurbiprofen Fc2cc(ccc2c1c
    CC(C1=CC(=C 110.5 3277 http://books Merck Index
    28123 flurbiprofen (C=C1)C2=CC
    Fc2cc(ccc2c1c 111 3277 http://www.siSigma-Aldrich
    =CC=C2)F)C(
    28124 Flurbiprofen =O)O 114 3277 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28125 formic acid C(=O)O 8.3 278 http://dx.doi
    http://chems EPISuite-ChemSpider
    28126 formic acid C(=O)O 8.32 278 .org/10.1080
    http://pubs.a Kohler F; Atrops H; Kalali H; Libermann E; Wilhelm E; Ratkovics F; Sala
    /106293607
    28127 fumaric acid C(=C/C(=O)O) 299.5 10197150 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    C(=C/C(=O)O
    28128 Fumaric Acid )\C(=O)O 287 10197150 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28129 furfuraldehydc1cc(oc1)C=O -36.5 13863629 http://chems EPISuite-ChemSpider
    28130 furfurylamineo1c(ccc1)CN -70 3320 http://www.aAlfa Aesar
    28131 furoic acid OC(=O)c1ccco 133.5 10251740 http://chems
    http://dx.doi EPISuite-ChemSpider
    28132 furosemide O=S(=O)(N)c1c 295 3322 .org/10.1080
    http://chems EPISuite-Chemx only one value here while many cluster ar
    /106293607
    28133 furosemide O=S(=O)(N)c1c 331 3322 01430124 RAEVSKY OA; Px out of range
    28134 furosemide O=S(=O)(N)c1c 220 3322 http://www.c ConvaChem x only one value here while many cluster ar
    28135 furosemide O=S(=O)(N)c1c 220 3322 http://tinyur Sigma-Aldrichx only one value here while many cluster ar
    28136 furosemide O=S(=O)(N)c1c 206 3322 http://www.c CasLab
    28137 furosemide O=S(=O)(N)c1c 208 3322 http://dx.doi Crystal Growth and Design
    28138 furosemide O=S(=O)(N)c1c 204 3322 http://www.elElephantCare
    C1=COC(=C1
    28139 furosemide )CNC2=CC(=
    O=S(=O)(N)c1c 204.5 3322 http://dx.doi Shin S; Kim J International Journal of Pharmaceutics; 251(1-2); 79-84
    28140 furosemide C(C=C2C(=O)
    O=S(=O)(N)c1c 206 3322 http://tinyur Sigma-Aldrich
    O)S(=O)
    28141 Furosemide (=O)N)Cl 206 3322 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28142 gamma-valeroCC1CCC(=O)O -31 7633 http://us.ch Chemical Book
    28143 gentisic acid C1=CC(=C(C=
    O=C(O)c1cc(O 205 3350 http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    C1O)C(=O)O)
    28144 Gentisic acid O 205 3350 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28145 glucose C([C@@H]1[C 150.5 71358 http://www.aAlfa Aesar
    28146 glucose C([C@@H]1[C 146 71358 http://www.hCRC Handbook
    28147 glucose C([C@@H]1[C 146 71358 http://www.inINCHEM
    28148 glucose C([C@@H]1[C 146.85 71358 http://webbo NIST Web Book
    28149 glucose C([C@@H]1[C 146 71358 http://www.wWolfram Alpha
    28150 glycine C(C(=O)O)N 262 730 http://chems EPISuite-ChemSpider
    28151 glyoxal O=C1c3c(O[C
    C(=O)C=O 15 7572 http://dx.doi
    http://whqlib WHO
    @]12[C@@
    28152 glyoxylic acid H]
    C(=O)C(=O)O 98 740 .org/10.1080
    http://babel. Proceedings and Transactions of the Royal Society of Canada
    /106293607
    28153 griseofulvin (CC(=O)CC2O
    O=C1c3c(O[C@ 220 5145918 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    C)C)c(Cl)c(OC
    28154 Griseofulvin )cc3OC 220 5145918 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28155 haloperidol c1cc(ccc1C(=O 151.5 3438 http://dx.doi
    http://chems EPISuite-ChemSpider
    28156 heptachlor ClC1/C=C\C2C3(
    C1=CC(C2C1 95 3463 .org/10.1080
    http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    /106293607
    28157 heptachlor C3(C(=C(C2(C
    ClC1/C=C\C2C3( 95.5 3463 http://dx.doi
    01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    3(Cl)Cl)Cl)Cl)
    28158 Heptachlor Cl)Cl)Cl
    C12C(C(C3C1 95 3463 .org/10.1080
    http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    /106293607
    O3)Cl)C4(C(=
    28159 heptachlor epCl\C1=C(/Cl)C 160 13328 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    C(C2(C4(Cl)Cl
    28160 Heptachlor ep)Cl)Cl)Cl)Cl 160 13328 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28161 heptane CCCCCCC -90.59 8560 http://dx.doi
    http://webbo NIST Web Book
    28162 hesperetin O=C2c3c(O[C@ 227.5 65234 .org/10.1080
    http://chems EPISuite-ChemSpider
    /106293607
    C1(=C(C(=C(C
    28163 hexabromobeBrc1c(Br)c(Br) 306 6639 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    (=C1Br)Br)Br)
    28164 HexabromobeBr)Br)Br 306 6639 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28165 hexachlorobe c1(c(c(c(c(c1Cl 230 8067 http://www.aSepassi
    http://dx.doi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    28166 hexachlorobe c1(c(c(c(c(c1Cl 230 .org/10.1080
    8067 http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    /106293607
    28167 hexachlorobe C1(=C(C(=C(C
    c1(c(c(c(c(c1Cl 229 8067 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    (=C1Cl)Cl)Cl)
    28168 HexachlorobeCl)Cl)Cl 230 8067 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28169 hexachloroet ClC(Cl)(Cl)C(Cl 187 5979 .org/10.1080
    http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    /106293607
    28170 hexachloroet ClC(Cl)(Cl)C(Cl 192.5 5979 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    C(C(Cl)(Cl)Cl)
    28171 Hexachloroet (Cl)(Cl)Cl 192 5979 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28172 hexamethylbec1(c(c(c(c(c1C 164 6642 .org/10.1080
    http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    /106293607
    CC1=C(C(=C(
    28173 hexamethylbec1(c(c(c(c(c1C 167.5 6642 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    C(=C1C)C)C)C
    28174 Hexamethylbe)C 167 6642 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28175 hexanaldehydO=CCCCCC -56 5949 http://chems EPISuite-ChemSpider
    28176 hexane C[C@]12CCC
    CCCCCC -95.15 7767 http://webbo NIST Web Book
    (=O)C=C1CC[
    28177 hexanoic acid CCCCCC(=O)O
    C@@H]3[C -3 8552 http://chems
    http://dx.doi EPISuite-ChemSpider
    28178 hexanoic acid @@H]2[C@
    C(CCCCC)(=O) -1.9 8552 .org/10.1080
    http://pubs.r Bica K; Shamshina J; Hough WL; MacFarlane DR; Rogers RD Chemical
    H] /106293607
    28179 hydrocortisonO=C4\C=C2/[
    (C[C@]4([C 218 5551 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    @H]3CC[C@
    28180 hydrocortisonO=C4\C=C2/[ 212.5 5551 http://www.siSigma-Aldrich
    @]4(C(=O)C
    28181 HydrocortisonO)O)C)O 218 5551 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28182 hydroquinonec1cc(ccc1O)O 172.3 764 http://chems EPISuite-ChemSpider
    28183 ibuprofen CC(C)Cc1ccc(c 76 3544 http://dx.doi
    http://chems EPISuite-ChemSpider
    28184 ibuprofen CC(C)Cc1ccc(c 76 3544 .org/10.1080
    http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    /106293607
    28185 ibuprofen CC(C)CC1=CC
    CC(C)Cc1ccc(c 76 3544 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    =C(C=C1)C(C)
    28186 Ibuprofen C(=O)O 76 3544 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28187 ifosfamide O=P1(OCCCN1 45.5 3562 http://www.gPatent
    28188 ifosfamide O=P1(OCCCN1 48 3562 http://www.gPatent
    http://dx.doi
    28189 imidacloprid [O-][N+](=O) 140.1 77934 .org/10.1080
    http://msds.c Oxford University
    /106293607
    C1=CC=C2C(
    28190 indole-3-acetiO=C(O)Cc2c1c 168.5 780 http://dx.doi
    01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    =C1)C(=CN2)
    CC1=C(C2=C(
    28191 Indole-3-acetiN1C(=O)C3=
    CC(=O)O 168.5 780 .org/10.1080
    http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    /106293607
    CC=C(C=C3)C
    CCOC(=O)CC
    28192 indomethacinCc1c(c2cc(ccc 159 3584 http://dx.doi
    01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    l)C=CC(=C2)
    1=C(N(C2=C1
    28193 IndomethacinOC)CC(=O)O
    C=C(C=C2)O 159 3584 .org/10.1080
    http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    /106293607
    28194 indomethacin C)C(=O)C3=C
    Clc1ccc(cc1)C 96 25923 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    C=C(C=C3)Cl)
    28195 IndomethacinC 96 25923 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28196 ipronidazole CC(C)C1=NC
    [O-][N+](=O)c 61 25097 http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    =C(N1C)[N+]
    28197 Ipronidazole (=O)[O-] 61 25097 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28198 isazophos Clc1nc(OP(=S 25 35885 http://dx.doi
    http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    28199 isoniazid O=C(NN)c1ccn 171.4 3635 .org/10.1080
    http://chems EPISuite-ChemSpider
    /106293607
    28200 isosorbide din[O-][N+](=O) 70 6619 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    28201 isovaleric acidO=C(O)CC(C)C -29.3 10001 http://chems EPISuite-ChemSpider
    28202 ketoprofen CC(c1cccc(c1) 94 3693 http://chems EPISuite-ChemSpider
    28203 ketoprofen CC(c1cccc(c1) 94 3693 http://dx.doi
    http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    28204 ketoprofen CC(c1cccc(c1)
    CC(C1=CC(=C 94 3693 .org/10.1080
    http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    CC[C@]12CC /106293607
    28205 ketoprofen C=C1)C(=O)C
    CC(c1cccc(c1)
    [C@H]3[C@ 93 3693 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    2=CC=CC=C2
    28206 Ketoprofen H])C(=O)O 93 3693 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    ([C@@H]1C
    28207 L-histidine C[C@]2(C#C)
    O=C(O)[C@@H 287 6038 http://chems EPISuite-ChemSpider
    28208 lamivudine O)CCC4=CC(
    O=C1/N=C(/N 161 54812 http://books Merck Index
    =O)CC[C@H]
    28209 Levonorgestre34 236 12560 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28210 lidocaine CC[C@H]
    O=C(Nc1c(ccc 68.5 3548 http://books
    http://dx.doi Merck Index
    (C)C(=O)O[C
    28211 lindane Cl[C@H]1[C@H
    @H]1C[C@H 113 10481896 .org/10.1080
    http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    /106293607
    28212 lindane ]ClC1C(Cl)C(Cl) 114 707 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    (C=C2[C@H]
    C1(C(C(C(C(C
    28213 lindane Cl[C@H]1[C@H
    1[C@H] 112.5 10481896 http://www.liLindane Education and Research Network
    1Cl)Cl)Cl)Cl)C
    28214 Lindane ([C@H]
    l)Cl 114 707 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    (C=C2)C)CC[
    28215 linoleic acid O=C(O)CCCCC
    C@@H]3C[C -8.5 4445609 .org/10.1080
    http://chems EPISuite-ChemSpider
    /106293607
    28216 lovastatin @H]
    O=C(O[C@@H] 174.5 48085 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    (CC(=O)O3)O
    28217 Lovastatin )C 175 48085 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28218 lutein CC1=C(C(C[C@ 196 4444655 http://www.aCRC Handbook of Chemistry and Physics
    28219 lutein CC1=C(C(C[C@ 183 4444655 http://books Merck Index
    28220 lutein CC1=C(C(C[C@ 190 4444655 http://books Merck Index
    28221 luteolin O=C\1c3c(O/C( 329.5 4444102 http://chems EPISuite-ChemSpider
    28222 m-bromobenzo
    O=C(O)c1cc(Br 157 10972 http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    28223 maleic acid O=C(O)\C=C/C 287 392248 http://www.c EPISuite-Chemx clearly out of range JCB
    28224 maleic acid O=C(O)\C=C/C 131.85 392248 http://webbo NIST Web Book
    28225 maleic acid O=C(O)\C=C/C 138 392248 http://msds.c Oxford
    28226 mandelic acidO=C(O)C(O)c1 134 1253 http://chems EPISuite-ChemSpider
    28227 meloxicam Cc1cnc(s1)NC 254 10442740 http://chems EPISuite-ChemSpider
    28228 mephenytoin O=C2N(C(=O)N
    C[C@]12CCC 135 3920 http://www.c EPISuite-ChemSpider
    28229 mephenytoin (=O)C[C@@
    O=C2N(C(=O)N 135.5 3920 http://www.uUSbiological
    H]1CC[C@@
    28230 meso-2,3-butaH]3[C@@H]
    O[C@@H](C)[ 34.5 190756 http://webbo NIST Web Book
    28231 meso-2,3-buta2CC[C@]4([C
    O[C@@H](C)[ 33 190756 http://dx.doi
    http://tinyurl Sigma-Aldrich
    @H]3CC[C@
    28232 Mestanolone CC1=C(C(=CC
    ]4(C)O)C 192 10187 .org/10.1080
    http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    /106293607
    28233 metalaxyl =C1)C)N(C(C)
    O=C(N(c1c(cc 72 38839 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    CC1=C(C(=CC
    C(=O)OC)C(=
    28234 Metalaxyl =C1)C)N(C(C)
    O)COC 72 38839 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    C(=O)OC)C(=
    28235 Metalaxyl O)COC 72 38839 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28236 methacrylic acCC(=C)C(=O)O 16 3951 http://chems EPISuite-ChemSpider
    28237 methadone O=C(C(c1cccc 98.85 559067 http://pubs.a Journal of Organic Chemistry
    28238 methadone O=C(C(c1cccc 101.5 559067 http://pubs.a Journal of the American Chemical Society
    28239 methane C
    CC12CCC3C( -187.45 291 http://pubs.a Streng AG Joux Clearly out of Range - EC
    28240 methane C1CCC2(C)O)
    C -182.55 291 http://webbooNIST Web Book
    CCC4=CC(=O
    28241 Methanedien )C=CC34C 163 23089209 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28242 methanol CO -98 864 http://www.aAlfa Aesar
    28243 methanol CO -98 864 http://www.c Chemical Book
    28244 methanol CO -97.53 864 http://www.hCRC Handbook
    28245 methanol CO -98 864 http://msds.c Oxford
    28246 methanol CO -98 864 http://tinyur Sigma-Aldrich
    28247 metharbital O=C1N(C(=O)N 150.5 3957 http://chems EPISuite-ChemSpider
    28248 methimazole Cn1cc[nH]c1= 146 1131173 http://www.hCRC Handbook
    28249 methimazole Cn1cc[nH]c1= 147 1131173 http://www.kMerck Index
    28250 methimazole Cn1cc[nH]c1= 145.5 1131173 http://www.siSigma-Aldrich
    28251 methimazole Cn1cc[nH]c1= 146 1131173 http://en.wik Wikipedia
    28252 methimazole Cn1cc[nH]c1= 145.5 1131173 http://www.wWolfram Alpha
    28253 methoxyaceticO=C(O)COC 7.7 11750 http://dx.doi
    http://chems EPISuite-ChemSpider
    28254 methyl 3,3-di O=C(OC)\C=C( -41 12958 .org/10.1080
    http://www.c Chemical Book
    /106293607
    28255 methyl 4-ami O=C(OC)c1ccc 114 11585 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    28256 methyl 4-ami COC(=O)C1=
    O=C(OC)c1ccc 110.5 11585 http://dx.doi
    http://www.siSigma-Aldrich
    CC=C(C=C1)
    28257 Methyl 4-ami N 114 11585 .org/10.1080
    http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    /106293607
    28258 methyl 4-hyd COC(=O)C1=
    COC(=O)c1ccc 131 7176 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    CC=C(C=C1)
    28259 Methyl 4-hyd O 131 7176 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28260 methyl p-ami O=C(OC)c1ccc 114 11585 http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    28261 methyl p-hyd COC(=O)c1ccc 131 7176 http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    28262 MethylhydrazN(N)C -80 5837 http://pubs.a Industrial Engineering Chemistry
    28263 methylparabeCOC(=O)c1ccc 131 7176 http://chems EPISuite-ChemSpider
    28264 methyltestostO=C4\C=C3/[ 163 5788 http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    28265 metolachlor CCc1cccc(c1N( 25 4025 http://www.aSepassi
    http://dx.doi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    28266 metoxuron Clc1cc(ccc1O 127 27749 .org/10.1080
    http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    /106293607
    28267 metoxuron Clc1cc(ccc1O
    Clc1cc(ccc1O 126.5 27749 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    C)NC(=O)N(C
    28268 Metoxuron )C 127 27749 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28269 metronidazol [O-][N+](=O) 160 4029 http://www.aSepassi
    http://dx.doi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    28270 mirex ClC53C1(Cl)C4( 485 16054 .org/10.1080
    http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    /106293607
    28271 mirex ClC53C1(Cl)C4( 485 16054 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    C12(C3(C4(C
    5(C3(C(C1(C5
    (C2(C4(Cl)Cl)
    Cl)Cl)Cl)
    (Cl)Cl)Cl)Cl)Cl
    28272 Mirex )Cl)Cl 485 16054 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28273 monuron Clc1ccc(NC(=O 172 8470 .org/10.1080
    http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    /106293607
    28274 monuron CN(C)C(=O)N
    Clc1ccc(NC(=O 174.5 8470 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    C1=CC=C(C=
    28275 Monuron C1)Cl 174 8470 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28276 N-(4-DimethylN(=C/c1ccc(N( 99 204209 http://pubs.a Journal of Organic Chemistry
    28277 N-(4-DimethylN(=C/c1ccc(N( 100 204209 http://www.joJournal of the Chemical Society of Japan
    28278 N-(4-methoxyb
    COc1ccc(cc1) 65 89076 http://tinyur Sigma-Aldrich
    28279 N-(4-methoxyb
    COc1ccc(cc1) 61 89076 http://useful UsefulChem
    28280 N-(4-methoxyb
    COc1ccc(cc1) 62.3 89076 http://www.scTetrahedron Letters
    28281 n-[(e)-(4-chl Clc2ccc(/C=N/
    O=C(NC/1=N 63.05 208587 http://www.scTetrahedron Letters
    28282 n-[(e)-(4-chl /C(=O)c2ncn(
    Clc2ccc(/C=N/ 76 208587 http://pubs.a Journal of the American Chemical Society
    c2N\1)COCC
    28283 N-AcetylacycloO)C 217 2363519 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28284 n-butyl 4-ami O=C(OCCCC)c1 57.5 2388 http://www.siSigma-Aldrich
    28285 n-butyl 4-ami O=C3N(C(=O
    O=C(OCCCC)c1 57.5 2388 http://www.siSigma-Aldrich
    28286 N-Cbz-L-proli )CCC3N2C(=
    O=C(O)[C@H]2
    O=C2c1ccccc 77 92134 http://chems EPISuite-ChemSpider
    O)c1ccccc1C
    28287 N-Methylthal 1C(=O)N2C3
    2=O)C 159 91432 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    C(=O)N(C(=O
    28288 N-Propylthali )CC3)CCC 136 8101973 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    C[C@]12CC[
    CC(C)
    28289 N,N-dimethyl-CN(C)c1ccc(cc
    CC(=O)NC1=
    C@H]3[C@H 96 204209 http://useful UsefulChem
    (C)NCC(COC1
    NC2=C(C(=N
    ]=CC=CC2=C1
    28290 N,N'-[(E)-etheO=C(Nc1ccc(cc 219 4644802 http://tinyur Patent
    1)O)N=CN2C
    ([C@@H]1C
    28291 N,O-DiacetylacC[C@@H]
    OCCOC(=O)C
    C[C@@H]2O 204 567612 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    ([C@@H]
    28292 Nadolol )CCC4=CC(=
    (C2)O)O)O 124 35815 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    O)CC[C@H]3
    28293 Nandrolone 4 C1=CC=C2C= 112 9520 .org/10.1080
    http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    /106293607
    28294 naphthacene C3C=C4C=CC
    c4c3cc2cc1ccc 357 6813 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    =CC4=CC3=C
    28295 Naphthacene C2=C1 357 6813 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28296 naphthalene c1ccc2ccccc2c 80 906 http://dx.doi
    http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    28297 naphthalene c1ccc2ccccc2c 80 906 .org/10.1080
    http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    /106293607
    28298 naphthalene c1ccc2ccccc2c 82 906 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    C1=CC=C2C=
    28299 Naphthalene CC=CC2=C1 82 906 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28300 naproxen C[C@@H](c1cc 153 137720 http://chems
    http://dx.doi EPISuite-ChemSpider
    28301 naproxen C[C@@H](c1cc
    CC(C1=CC2= 153 137720 .org/10.1080
    http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    /106293607
    28302 naproxen C(C=C1)C=C(
    O=C(O)C(c1ccc 155 1262 01430124
    C=C2)OC)C(= http://dx.doi RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    28303 Naproxen O)O 155 1262 .org/10.1080
    http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    /106293607
    28304 naproxol OCC(c1ccc2c
    OCC(c1ccc2c(c 87 30797 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    (c1)ccc(OC)c
    28305 Naproxol O=C(OCC(c1c
    2)C 87 30797 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    cc2c(c1)ccc(
    28306 Naproxol acetOC)c2)C)C 61 9509356 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28307 nicotinic acid c1cc(cnc1)C(= 236.6 913 .org/10.1080
    http://chems EPISuite-ChemSpider
    /106293607
    28308 nicotinic acid CC1=C(C(C(=
    c1cc(cnc1)C(= 236.6 913 http://dx.doi
    01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    C1=CC(=CN=
    C(N1)C)C(=O
    28309 Nicotinic acid C1)C(=O)O
    )OC)C2=CC= 236.6 913 .org/10.1080
    http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    /106293607
    28310 nifedipine CC=C2[N+]
    O=C(OC)\C1=C 173 4330 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    C1=CC(=CC(=
    (=O)
    28311 Nifedipine C1)NC2=C(C=
    [O-])C(=O)OC 173 4330 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    CC=N2)C(=O)
    28312 Niflumic Acid O)C(F)(F)F 204 4333 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28313 nimesulide [O-][N+](=O)c 143.75 4339 http://chems EPISuite-ChemSpider
    28314 nitrilotrimeth O=P(O)(O)CN( -14 15833 http://www.chSIDS x aqueous solution
    28315 nitrilotrimeth O=P(O)(O)CN( 200 15833 http://www.hHERA
    28316 nitrilotrimeth O=P(O)(O)CN(
    C1C(=O)NC(= 225 15833 http://www.hHERA
    28317 nitrilotrimeth O)N1/N=C/C
    O=P(O)(O)CN(
    O=C(OCCOC 215 15833 http://tinyur Sigma-Aldrich
    2=CC=C(O2)
    28318 Nitrofurantoi n1c2N\C(=N/
    [N+](=O)[O-] 268 5036498 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    C(=O)c2nc1)
    28319 O-AcetylacycloN)C 242 2280639 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28320 o-bromobenzoi
    O=C(O)c1cccc 146 6674 http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    28321 o-chloroanilinNc1ccccc1Cl -14 13854248 http://chems EPISuite-ChemSpider
    28322 o-vanillin Oc1c(cccc1OC
    C1(=C(C(=C(C 44.5 21105848 http://chems EPISuite-ChemSpider
    28323 o,p'-DDT (=C1Cl)Cl)Cl)
    Clc1ccccc1C(c2 75 12543 http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    Cl)Cl)C(=C(Cl)
    28324 OctachlorostyCl)Cl 95 31717 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28325 octane CCCCCCCC -56.85 349 http://webbo NIST Web Book
    28326 octanoic acid CCCCCCCC(=O 16.3 370 http://chems EPISuite-ChemSpider
    28327 octanoic acid C(CCCCCCC)(= 15.85 370 http://pubs.r Bond AD New Journal of Chemistry; 28; 104-114 (2004)
    28328 octylamine NCCCCCCCC 0 7851 http://chems EPISuite-ChemSpider
    28329 OSM-S-01 Cc1ccc(C)n1c1 48.5 2397725 http://malari OSDD
    28330 OSM-S-02 Cc1cc(C=O)c(C 117.5 827223 http://malari OSDD
    28331 OSM-S-03 CCOC(=O)c1cc( 64.5 26285324 http://malari OSDD
    28332 OSM-S-05 Cc1cc(c(C)n1c 177.5 1817204 http://malari OSDD
    28333 OSM-S-10 Cc1cc(/C=C\2/ 277.5 1033652 http://malari OSDD
    28334 OSM-S-19 Cc1cc(c(C)n1c 194 28296454 http://malari OSDD
    28335 OSM-S-24 Cc1c(cnn1c1c 167.5 128103 http://malari OSDD
    28336 OSM-S-25 Cc1ccc(C)n1c1 49.5 59889 http://malari OSDD
    28337 OSM-S-26 Cc1ccc(cc1)n1 45.5 1468275 http://malari OSDD
    28338 OSM-S-27 Cc1ccc(C)n1c1 71.5 2018770 http://malari OSDD
    28339 OSM-S-28 Cc1cc(C=O)c(C 88.5 59886 http://malari OSDD
    28340 OSM-S-29 Cc1ccc(cc1)n1 109.5 714789 http://malari OSDD
    28341 OSM-S-30 CCOC(=O)c1cc( 61 27420182 http://malari OSDD
    28342 OSM-S-32 CCOC(=O)c1cc( 67.5 26282671 http://malari OSDD
    28343 OSM-S-34 Cc1cc(C=O)c(C 86 2061700 http://malari OSDD
    28344 OSM-S-36 Cc1cc(C=O)c(C) 95.5 28296457 http://malari OSDD
    28345 OSM-S-40 CCOC(=O)c1ccc 60.5 611947 http://malari OSDD
    28346 OSM-S-42 Cc1cc(/C=C\2/ 182.5 28296461 http://malari OSDD
    28347 OSM-S-43 Cc1cc(/C=C\2/ 73 28296462 http://malari OSDD
    28348 OSM-S-44 Cc1cc(C=O)c( 62.5 846831 http://malari OSDD
    28349 OSM-S-45 O=C1N=C(N(C( 310 28296463 http://malari OSDD
    28350 OSM-S-46 CCOC(=O)c1cc 113 523156 http://malari OSDD
    28351 OSM-S-47 c1ccc(cc1)/N= 175.5 1065422 http://malari OSDD
    28352 OSM-S-49 O=C1N=C(N(C( 237.5 28296464 http://malari OSDD
    28353 OSM-S-50 O=C1N=C(N(C( 257 28296465 http://malari OSDD
    28354 OSM-S-51 Cc1cc(/C=C\2 277 28296466 http://malari OSDD
    28355 OSM-S-52 Cc1cc(/C=C\2/ 226.5 28296467 http://malari OSDD
    28356 OSM-S-53 CC(=NC(=Nc1c 166.5 746274 http://malari OSDD
    28357 OSM-S-54 Cc1cc(/C=C\2/ 71.5 28296468 http://malari OSDD
    28358 OSM-S-55 c1ccc(cc1)/C= 260.5 1069675 http://malari OSDD
    28359 OSM-S-57 O=C(OCC(N)= 154 28296469 http://malari
    http://pubs.a OSDD
    28360 oxolinic acid O=C1c3c(N(\C 315 4467 cs.org/doi/a
    http://chems EPISuite-ChemSpider
    bs/10.1021/
    28361 oxprenolol O(c1ccccc1OC 111.85 4470 ci700096r Wang JM; Hou TJ and Xu XJ. J. Chem. Inf. Model. 2009 49 (3) [Lit]
    28362 p-aminobenzoiO=C(O)c1ccc( 189 953 http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    28363 p-aminobenzoiO=C(O)c1ccc( 189 953 http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    28364 p-anisaldehydCOc1ccc(C=O) 1 21105937 http://www.aAlfa Aesar
    28365 p-bromobenzoi
    O=C(O)c1ccc(B 252 10980 http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    28366 p-cresol Cc1ccc(O)cc1 21 13839082 http://www.f Fisher
    28367 p-cresol Cc1ccc(O)cc1 34 13839082 http://msds.c Oxford
    28368 p-cresol Cc1ccc(O)cc1 33 13839082 http://www. Sigma-Aldrich
    28369 p-cresol Cc1ccc(O)cc1 33 13839082 http://www.wo
    Wolfram Alpha
    28370 p-cresol Cc1ccc(O)cc1 35 13839082 https://fscim Fisher
    28371 p-tolualdehydO=Cc1ccc(C)c -6 13865424 http://chems EPISuite-ChemSpider
    28372 p-toluenesulfoCc1ccc(cc1)S( 104.5 5876 http://chems EPISuite-ChemSpider
    28373 p-toluenesulf O=S(=O)(c1ccc 112.5 142204 http://www.aAlfa Aesar
    28374 p-toluic acid Cc1ccc(cc1)C( 180 7190 http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    28375 paclitaxel CC1=C2[C@@] 216.5 10368587 http://dx.doi Singla AK; Garg A; Aggarwal D International Journal of Pharmaceutics;
    28376 paracetamol CC(=O)Nc1ccc 170 1906 http://www.aCRC Handbook of Chemistry and Physics
    28377 paracetamol CC(=O)Nc1ccc
    C1=CC(=C(C= 169.75 1906 http://books Merck Index
    28378 paracetamol C1Cl)C2=CC(
    CC(=O)Nc1ccc
    C1=CC(=C(C= 163 1906 http://www.siSigma-Aldrich
    =C(C=C2Cl)Cl
    28379 PCB-101 C1C2=C(C(=C
    )Cl)Cl 77 34668 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    C1=CC(=C(C=
    (C=C2)Cl)Cl)C
    28380 PCB-105 C1C2=CC(=C(
    l)Cl)Cl 117 33282 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    C=C2Cl)Cl)Cl)
    28381 PCB-118 Clc2ccc(c1cc(
    Cl)Cl 110 32952 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    Cl)c(Cl)cc1Cl)
    28382 PCB-138 c(Cl)c2Cl 79 33984 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28383 PCB-15 C1=CC(=CC=
    Clc2ccc(c1ccc( 149 15474 http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    C1=C(C(=CC(
    C1C2=CC=C(
    28384 PCB-15 =C1Cl)Cl)Cl)C
    C=C2)Cl)Cl 149 15474 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    2=CC(=C(C=C
    28385 PCB-153 Clc1c(c(Cl)cc(
    2Cl)Cl)Cl 103 33983 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    C1=C(C(=CC(
    O)c1O)c2c(Cl
    28386 PCB-155 =C1Cl)Cl)Cl)C
    )cc(Cl)cc2Cl 113 2338566 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    Clc1c(cc(Cl)c(
    2=CC(=C(C(=
    28387 PCB-180 Cl)c1Cl)c2cc(
    C2Cl)Cl)Cl)Cl 112 33985 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    Cl)c(Cl)c(Cl)c
    28388 PCB-194 C1=CC(=CC=
    2Cl 157 34192 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    C1C2=C(C=C(
    28389 PCB-28 C=C2)Cl)Cl)Cl 58 21924 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28390 PCB-29 Clc2cc(c1ccccc 76 25605 http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    28391 PCB-3 C1=CC=C(C=
    Clc2ccccc2c1c 78 218253 http://www.aSepassi K; Ya x all other sources point to 30-34 - EC
    C1)C2=CC=C(
    28392 PCB-3 Clc2ccc(Cl)cc
    C=C2)Cl 78 15489 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    2c1ccc(Cl)cc
    28393 PCB-31 1 65 26011 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28394 PCB-52 Clc2ccc(Cl)cc2 87 34189 http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    28395 PCB-61 C1=CC=C(C(=
    Clc1c(cc(Cl)c( 91 33457 http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    C1)C2=CC=C(
    28396 PCB-8 C=C2)Cl)Cl 44 33934 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28397 pentachlorob Clc1cc(Cl)c(Cl) 86 21106570 http://dx.doi
    http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    28398 pentachlorob Clc1cc(Cl)c(Cl) 86 21106570 .org/10.1080
    http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    /106293607
    28399 pentachlorob C1=C(C(=C(C(
    Clc1cc(Cl)c(Cl) 85 21106570 http://dx.doi
    01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    =C1Cl)Cl)Cl)C
    28400 Pentachlorob C1(=C(C(=C(C
    l)Cl 85 .org/10.1080
    21106570 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    /106293607
    (=C1Cl)Cl)Cl)
    28401 pentachloroniClc1c(c(Cl)c(C 144 6464 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    Cl)Cl)[N+]
    28402 Pentachloroni(=O)[O-] 144 6464 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28403 pentachlorop Clc1c(O)c(Cl)c 174 967 .org/10.1080
    http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    /106293607
    28404 pentachlorop Clc1c(O)c(Cl)c 189.5 967 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    28405 pentachlorop C1(=C(C(=C(C
    Clc1c(O)c(Cl)c 172.5 967 http://www.siSigma-Aldrich
    http://dx.doi
    (=C1Cl)Cl)Cl)
    28406 Pentachlorop Cl)Cl)O 189.5 967 .org/10.1080
    http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    /106293607
    28407 pentachlorotoClc1c(c(Cl)c(Cl 224.8 12838 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    Clc1c(c(Cl)c(
    28408 PentachlorotoCl)c(Cl)c1Cl)C 224.8 12838 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28409 pentane CCCCC -129.73 7712 http://pubs.a Carruth GF; Kobayahsi R Journal of Chemical and Engineering Data; 18
    28410 pentanoic aci O=C(O)CCCC -34 7701 http://chems EPISuite-ChemSpider
    28411 pentanoic aci C(CCCC)(=O)O -33.95 7701 http://dx.doi DellaGatta G; Jozwiak M; Ferloni P Journal of Chemical Thermodynam
    28412 pentanoic aci C(CCCC)(=O)O -33.66 7701 .org/10.1080
    http://jcp.ai McDougall LA; Kilpatrick JE Journal of Chemical Physics; 42(7); 2307-2
    /106293607
    28413 pentazocin N1=N\C=C/C= 146 10606460 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    C\1=C\N=N/
    28414 Pentazocin N=N\N=C1 146 10606460 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28415 pentobarbital O=C1NC(=O)NC 129.5 4575 http://chems EPISuite-ChemSpider
    http://dx.doi
    C1=CC2=C3C
    28416 perylene c1cc2cccc3c2c
    (=C1)C4=CC= 277 8788 .org/10.1080
    http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    /106293607
    28417 perylene CC5=C4C(=C
    c1cc2cccc3c2c 278 8788 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    C=C5)C3=CC
    28418 Perylene =C2 278 8788 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28419 phenacetin O=C(Nc1ccc(O 137.5 4590 http://chems
    http://dx.doi EPISuite-ChemSpider
    28420 phenacetin O=C(Nc1ccc(O 135 4590 .org/10.1080
    http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    /106293607
    28421 phenacetin CCOC1=CC=C
    O=C(Nc1ccc(O 135 4590 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    (C=C1)NC(=O
    28422 Phenacetin )C 135 4590 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28423 phenanthracec1ccc2c(c1)cc 99 970 http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    28424 phenanthracec1ccc2c(c1)cc 99 970 http://dx.doi
    http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    28425 phenanthrenec1ccc2c(c1)cc 99.2 970 .org/10.1080
    http://chems EPISuite-ChemSpider
    /106293607
    C1=CC=C2C(
    28426 phenanthrenec1ccc2c(c1)cc 101 970 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    =C1)C=CC3=
    28427 PhenanthreneCC=CC=C32 101 970 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28428 phenanthreneO=Cc2cc3c(c1c 101.5 70806 http://www. Sigma-Aldrich
    28429 phenobarbitalO=C1NC(=O)NC 174 4599 http://dx.doi
    http://chems EPISuite-ChemSpider
    28430 phenobarbitalO=C1NC(=O)NC
    CCC1(C(=O)N 176 4599 .org/10.1080
    http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    /106293607
    C(=O)NC1=O
    28431 phenobarbitalCCC1(C(=NC(= 176 4599 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    )C2=CC=CC=
    28432 PhenobarbitalC2 176 4599 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28433 phenol c1ccc(cc1)O 41 971 .org/10.1080
    http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    /106293607
    28434 phenol c1ccc(cc1)O 41 971 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    28435 phenol c1ccc(cc1)O 41 971 http://www.siSigma-Aldrich
    C1=CC=C(C=
    28436 phenol C1=CC=C2C(
    C1)O 41 971 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    =C1)NC3=CC
    28437 Phenothazine =CC=C3S2 187 21106365 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28438 phenothiazinec1ccc2c(c1)Nc 183.5 21106365 http://www.aAlfa Aesar
    28439 phenothiazinec1ccc2c(c1)Nc 187.5 21106365 http://www.aCRC Handbook of Chemistry and Physics
    28440 phenothiazinec1ccc2c(c1)Nc 185.1 21106365 http://books Merck Index
    28441 phenothiazinec1ccc2c(c1)Nc 184.5 21106365 http://www.siSigma-Aldrich
    28442 phenothiazinec1ccc2c(c1)Nc 185 21106365 http://www.siSigma-Aldrich
    28443 phenyl benzoaO=C(Oc1ccccc 69 6901 http://www.siSigma-Aldrich
    28444 phenyl salicyl O=C(Oc1ccccc 130.5 8058 http://chems EPISuite-Chemx clearly out of range JCB
    28445 phenyl salicyl O=C(Oc1ccccc 42.2 8058 http://www.r RTC melting point standard
    28446 phenyl salicyl O=C(Oc1ccccc 42 8058 http://tinyur Sigma-Aldrich
    28447 phenylacetic aO=C(O)Cc1ccc 77.5 10181341 http://www.aAlfa Aesar
    28448 phenylacetic aO=C(O)Cc1ccc 76.7 10181341 http://chems EPISuite-ChemSpider
    28449 phenylacetic aO=C(O)Cc1ccc 77 10181341 http://www. Sigma-Aldrich
    CCCCC1C(=O
    28450 phenylacetic aO=C(O)Cc1ccc
    )N(N(C1=O)C 76 10181341 http://webbo NIST Web Book
    2=CC=CC=C2
    28451 phenylalaninec1ccc(cc1)CC( 186 969 http://chems EPISuite-ChemSpider
    )C3=CC=CC=
    28452 Phenylbutazo C3 107 4617 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28453 phenylpropyno C1CN(CCC1N
    O =C(C#Cc1ccc 136 62682 http://www.aAlfa Aesar
    2C3=CC=CC=
    28454 phthalic acid C3NC2=O)CC
    c1ccc(c(c1)C( 230 992 http://chems EPISuite-ChemSpider
    28455 pimozide CC(C4=CC=C(
    Fc1ccc(cc1)C 216 15520 http://chems EPISuite-ChemSpider
    C=C4)F)C5=C
    28456 Pimozide C=C(C=C5)F 216 15520 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28457 piperonal c1cc2c(cc1C= 37 13859497 http://dx.doi
    http://chems EPISuite-ChemSpider
    O=C\2c1c(cc
    28458 piroxicam C[C@]12C[C
    OC=2c1ccccc1
    cc1)S(=O) 199 10442653 .org/10.1080
    http://chems EPISuite-ChemSpider
    @@H] /106293607
    28459 piroxicam (=O)N(C/2=C
    O=C\2c1c(ccc 198 4444107 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    ([C@H]3[C@
    (\O)Nc3nccc
    28460 Piroxicam H]
    c3)C 198 4444107 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    ([C@@H]1C
    28461 prednisolone C[C@@]2(C(
    O=C\1\C=C/[ 240 5552 .org/10.1080
    http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    /106293607
    28462 prednisolone =O)CO)O)CC
    O=C\1\C=C/[ 240 5552 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    C4=CC(=O)C=
    28463 Prednisolone C[C@]34C)O 240 5552 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28464 prednisone O=C(CO)[C@@ 234 5656 http://www.aCRC Handbook of Chemistry and Physics
    28465 prednisone O=C(CO)[C@@ 234 5656 http://books Merck Index
    28466 prednisone O=C(CO)[C@@ 237 5656 http://www.siSigma-Aldrich
    28467 probarbital CCCN(CC1CC
    O=C1NC(=O)NC 203 6213 http://chems
    http://dx.doi EPISuite-ChemSpider
    1)C2=C(C=C(
    28468 profluralin C=C2[N+]
    [O-][N+](=O)c 32 30913 .org/10.1080
    http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    CC(=O) /106293607
    28469 profluralin (=O)[O-])C(F)
    [O-][N+](=O)c
    [C@H]1CC[C 32.5 30913 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    (F)F)[N+](=O)
    28470 Profluralin @@H]2[C@
    [O-] 32 30913 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    @]1(CC[C@
    28471 progesterone H]3[C@H]2C
    O=C4\C=C2/[ 131 5773 .org/10.1080
    http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    /106293607
    28472 progesterone CC4=CC(=O)
    O=C4\C=C2/[ 129.5 5773 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    CC[C@]34C)
    28473 Progesterone C 130 5773 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28474 propane CCC -187.65 6094 http://pubs.a
    http://dx.doi Streng AG Journal of Chemical and Engineering Data; 16(3); 357-359 (
    28475 propanoic aci CCC(=O)O -20.7 1005 .org/10.1080
    http://chems EPISuite-ChemSpider
    /106293607
    28476 propyl 4-hydr CCCOC(=O)C
    O=C(OCCC)c1c 96 6907 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    1=CC=C(C=C
    28477 Propyl 4-hydr 1)O 96 6907 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28478 propyl p-hydr O=C(OCCC)c1c 96 6907 http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    28479 propyl parabeO=C(OCCC)c1c 97 6907 http://www.aCRC Handbook of Chemistry and Physics
    28480 propyl parabeO=C(OCCC)c1c 96.5 6907 http://books Merck Index
    28481 propyl parabeO=C(OCCC)c1c 96 6907 http://www.siSigma-Aldrich
    28482 propyl parabeO=C(OCCC)c1c 96.5 6907 http://www.siSigma-Aldrich
    28483 Propylene C=CC -185.2 7954 http://www.jo
    http://dx.doi Oka T; Sato S Bulletin of the Chemical Society of Japan; 42(2); 582 (19
    28484 propylparabe O=C(OCCC)c1c 97 6907 .org/10.1080
    http://chems EPISuite-ChemSpider
    http://dx.doi
    /106293607
    28485 prostaglandinO=C1C[C@@H] 67 4444059 .org/10.1080
    01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    /106293607
    28486 prostaglandinO=C(O)CCC/C= 30 4510139 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    28487 PseudodiosgenO=C(OC[C@H] 105 9014352 http://tinyur Chemical & Pharmaceutical Bulletin
    28488 PseudodiosgenO=C(OC[C@H] 95 9014352 Justus Liebigs Annalen der Chemie
    28489 PseudodiosgenO=C(OC[C@H] 102 9014352 http://tinyurl N.V. Organon; Patent: DE957481
    28490 PseudodiosgenO=C(OC[C@H] 103 9014352 http://pubs.r Journal of the Chemical Society
    28491 PseudodiosgenO=C(OC[C@H] 100 9014352 http://pubs.a Journal of the American Chemical Society
    28492 PseudodiosgenO=C(OC[C@H] 100 9014352 http://pubs.a Journal of the American Chemical Society
    28493 PseudodiosgenO=C(OC[C@H] 99.5 9014352 http://pubs.a Journal of the American Chemical Society
    28494 PseudodiosgenO=C(OC[C@H] 101 9014352 http://pubs.a Journal of the American Chemical Society
    28495 pyrene c1cc2ccc3cccc 151.2 29153 http://chems EPISuite-ChemSpider
    28496 pyrene c1cc2ccc3cccc 156 29153 http://dx.doi
    http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    28497 pyrene c1cc2ccc3cccc
    C1=CC2=C3C 156 29153 .org/10.1080
    http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    /106293607
    28498 pyrene (=C1)C=CC4=
    c1cc2ccc3cccc 151 29153 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    CC=CC(=C43)
    28499 Pyrene C=C2 151 29153 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28500 pyruvic acid O=C(C(=O)O)C 11.5 1031 http://www.aAlfa Aesar
    28501 pyruvic acid O=C(C(=O)O)C 12 1031 http://www.bBedoukian Research
    28502 pyruvic acid O=C(C(=O)O)C 13.8 1031 http://www.hCRC Handbook
    28503 pyruvic acid O=C(C(=O)O)C 12 1031 http://msds.c Oxford
    28504 pyruvic acid O=C(C(=O)O)C 11.5 1031 http://www. Sigma-Aldrich
    28505 quinine COC1=CC2=C( 176 84989 http://www.mMerck Millipore
    28506 quinine COC1=CC2=C( 174 84989 http://synqueSynquest Labs
    28507 R,R-2,3-butanO[C@H](C)[C 16 196452 http://www.l LookChem
    28508 resorcinol di O=C(Oc2cccc( 116 60108 http://www.glGlobalChems
    28509 resveratrol Oc2cc(\C=C\c1
    O=C(OCSc2n 254 392875 http://chems EPISuite-ChemSpider
    28510 riboflavin cnc1c2ncn1C
    O=C2/N=C\1/N 280 1043 http://chems EPISuite-ChemSpider
    OC(=O)CCC)C
    28511 S6,9-Bis(buta CC 69 9726865 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28512 salicylaldehydO=Cc1ccccc1 -7 13863618 http://dx.doi
    http://chems EPISuite-ChemSpider
    28513 salicylamide O=C(c1ccccc1 142 4963 .org/10.1080
    http://chems EPISuite-ChemSpider
    /106293607
    28514 salicylamide O=C(c1ccccc1 142 4963 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    C1=CC=C(C(=
    28515 Salicylamide C1)C(=O)N)O 142 4963 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28516 salicylic acid c1ccc(c(c1)C( 158 331 http://dx.doi
    http://chems EPISuite-ChemSpider
    28517 salicylic acid c1ccc(c(c1)C( 158 331 .org/10.1080
    http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    /106293607
    28518 salicylic acid c1ccc(c(c1)C( 159 331 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    28519 salicylic acid c1ccc(c(c1)C( 159 331 http://www.c Chemical Land
    CCC(C)
    28520 salicylic acid c1ccc(c(c1)C( 158 331 http://sis.nlmChemIDplus
    (C)C(=O)O[C
    28521 salicylic acid c1ccc(c(c1)C(
    @H]1C[C@H 161 331 http://msds.c Oxford
    28522 salicylic acid ]c1ccc(c(c1)C( 159.5 331 http://www.wo
    Wolfram Alpha
    C1=CC=C(C(=
    (C=C2[C@H]
    28523 Salicylic acid 1[C@H]
    C1)C(=O)O)O 159 331 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    ([C@H]
    28524 salicylideneanOc1ccccc1C=N 51 10237273 http://www.scJournal of Molecular Structure
    (C=C2)C)CC[
    28525 salicylideneanOc1ccccc1C=N
    C@@H]3C[C 47.5 10237273 http://useful UsefulChem
    28526 scopolamine @H] OC[C@H](c1c 59 10194106 http://www.kMerck Index
    (CC(=O)O3)O
    28527 Simvastatin )C 136 49179 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28528 sinapic acid COc1cc(cc(c1 195 553361 http://www.aAlfa Aesar
    28529 sodium chlori [Na+].[Cl-] 804 5044 http://www.aAlfa
    http://dx.doi Aesar x salt and metal
    28530 succinic acid C(CC(=O)O)C( 188 .org/10.1080
    1078 http://chems EPISuite-ChemSpider
    CC(=O)NS(=O /106293607
    )
    28531 sulfacetamideO=S(=O)(c1cc 182 5129 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    (=O)C1=CC=C
    28532 Sulfacetamide(C=C1)N 182 5129 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28533 sulfadiazine O=S(=O)(Nc1n
    C1=CN=C(N= 255.5 5026 .org/10.1080
    http://chems EPISuite-ChemSpider
    /106293607
    28534 sulfadiazine C1)NS(=O)
    O=S(=O)(Nc1n 253.5 5026 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    (=O)C2=CC=C
    28535 Sulfadiazine (C=C2)N 259 5026 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    COC1=NC(=N
    28536 sulfadimethoxCOc1cc(nc(n1
    C(=C1)NS(=O 203.5 5132 .org/10.1080
    http://chems EPISuite-ChemSpider
    /106293607
    )
    28537 sulfadimethoxCOc1cc(nc(n1 204.5 5132 http://dx.doi
    01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    (=O)C2=CC=C
    28538 Sulfadimethox(C=C2)N)OC
    CC1=NC(=NC 204.5 5132 .org/10.1080
    http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    /106293607
    =C1)NS(=O)
    28539 sulfamerazineO=S(=O)(Nc1nc 235.3 5134 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    (=O)C2=CC=C
    28540 Sulfamerazine(C=C2)N 235 5134 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28541 sulfamerazineO=S(=O)(Nc1nc 235 5134 http://dx.doi
    http://www.f Patent 7,766,979
    28542 sulfamerazineO=S(=O)(Nc1nc
    CC1=CC(=NC 170 5134 .org/10.1080
    http://www.f Patent 7,766, x possibly for uncommon polymorph
    /106293607
    (=N1)NS(=O)
    28543 sulfamethazinO=S(=O)(Nc1nc 199.5 5136 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    (=O)C2=CC=C
    28544 Sulfamethazin(C=C2)N)C 196 5136 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28545 sulfamethoxazCC1=CC(=NO
    O=S(=O)(Nc1no 167 5138 .org/10.1080
    http://chems EPISuite-ChemSpider
    /106293607
    28546 sulfamethoxaz1)NS(=O)
    O=S(=O)(Nc1no 167.5 5138 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    (=O)C2=CC=C
    28547 Sulfamethoxa (C=C2)N 168 5138 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28548 sulfamethoxypCOC1=NN=C(
    O=S(=O)(Nc1n 182.5 5139 .org/10.1080
    http://chems EPISuite-ChemSpider
    /106293607
    28549 sulfamethoxypC=C1)NS(=O)
    O=S(=O)(Nc1n 182.5 5139 01430124
    http://dx.doi RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    (=O)C2=CC=C
    28550 Sulfamethoxyp(C=C2)N 182.5 5139 .org/10.1080
    http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    /106293607
    28551 sulfanilamide C1=CC(=CC=
    O=S(=O)(c1ccc 166.2 5142 01430124
    http://dx.doi RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    C1N)S(=O)
    28552 Sulfanilamide C1=CC=NC(=
    (=O)N 166.2 5142 .org/10.1080
    http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    /106293607
    28553 sulfapyridine C1)NS(=O)
    O=S(=O)(Nc1nc 192 5145 http://dx.doi
    01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    (=O)C2=CC=C
    28554 Sulfapyridine C1=CC(=CC=
    (C=C2)N 190 5145 .org/10.1080
    http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    /106293607
    28555 sulfathiazole C1N)S(=O)
    O=S(=O)(Nc1nc 202.5 5148 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    (=O)NC2=NC
    28556 Sulfathiazole =CS2 200 5148 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    CC1=CC(=NC
    28557 sulfisomidine (=N1)C)NS(=
    O=S(=O)(Nc1nc 243 5150 .org/10.1080
    http://chems EPISuite-ChemSpider
    /106293607
    28558 sulfisomidine O)
    O=S(=O)(Nc1nc 243 5150 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    (=O)C2=CC=C
    28559 Sulfisomidine (C=C2)N 243 5150 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    http://dx.doi
    28560 sulfisoxazole O=S(=O)(Nc1on
    CC1=C(ON=C 191 5151 .org/10.1080
    http://chems EPISuite-ChemSpider
    /106293607
    28561 sulfisoxazole 1C)NS(=O)
    CC\1=C(C2=C
    O=S(=O)(Nc1on 194 5151 01430124
    http://dx.doi RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    (=O)C2=CC=C
    (/C1=C\C3=C
    28562 Sulfisoxazole CC\1=C(C2=C
    (C=C2)N
    C=C(C=C3) 194 5151 .org/10.1080
    http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    (/C1=C\C3=C /106293607
    28563 sulindac [S+](C)
    O=S(c1ccc(cc1 183.5 1265915 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    C=C(C=C3)
    [O-])C=CC(=C
    28564 Sulindac [S+](C)
    2)F)CC(=O)O 183.5 1265915 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    [O-])C=CC(=C
    28565 Sulindac ethyl2)F)CC(=O)O 128 1265915 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28566 tartaric acid O=C(O)C(O)C( 147 852 http://chems EPISuite-ChemSpider
    28567 temazepam CN1c2ccc(cc2 120 5198 http://chems EPISuite-ChemSpider
    28568 temazepam CN1c2ccc(cc2 120 5198 http://books Merck Index
    28569 terbutryn CCNC1=NC(=
    S(c1nc(nc(n1) 105 12874 http://dx.doi
    http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    NC(=N1)SC)N
    C[C@]12CC[
    28570 Terbutryn C(C)(C)C
    C@H]3[C@H 105 12874 .org/10.1080
    http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    /106293607
    28571 terbutryne ]S(c1nc(nc(n1) 104.5 12874 01430124
    http://dx.doi RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    ([C@@H]1C
    28572 testosterone O=C4\C=C2/[
    C[C@@H]2O 155 5791 .org/10.1080
    http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    /106293607
    )CCC4=CC(=
    28573 testosterone O=C5\C=C4/
    O=C4\C=C2/[ 154 5791 http://dx.doi
    01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    O)CC[C@]34
    C(C3CCC2(C(
    28574 Testosterone CCC2OC(=O)
    C 154 .org/10.1080
    5791 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    C[C@]12CC[ /106293607
    c1ccccc1)C3
    28575 testosterone O=C5\C=C4/
    C[C@]12CC[
    O=C5\C=C4/C( 195 312539 http://dx.doi
    01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    C@H]3[C@H
    CC4)C)
    C(C3CCC2(C(
    C@H]3[C@H .org/10.1080
    28576 Testosterone ]CCC2OC(=O)
    (C)CC5
    ]([C@@H]1C 195 312539 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    /106293607
    28577 testosterone Cc1ccccc1)C
    ([C@@H]1C
    O=C5\C=C4/C(
    C[C@@H]2O 129 20608 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    3CC4)C)
    C[C@@H]2O
    28578 Testosterone )CCC4=CC(=
    (C)CC5
    C(=O)CCC4= 129 20608 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    O)CC[C@]34
    28579 Testosterone CC=CC=C4)C
    C 78 5791 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    CC5=CC(=O)
    28580 Testosterone CC[C@]35C 116.5 14062 .org/10.1080
    http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    /106293607
    28581 testosterone O=C5\C=C3/[ 116.5 14062 01430124
    http://dx.doi RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    28582 thalidomide c1ccc2c(c1)C
    C1CC(=O)NC( 270 5233 .org/10.1080
    http://chems EPISuite-ChemSpider
    /106293607
    28583 thalidomide =O)C1N2C(=
    c1ccc2c(c1)C 275 5233 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    O)C3=CC=CC
    28584 Thalidomide =C3C2=O 275 5233 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28585 theophylline Cn1c2c(c(=O) 272 2068 .org/10.1080
    http://www.aSepassi K; Yalkowsky SH; AAPS PharmSciTech; 7(1); E1-E8 (2006)
    /106293607
    28586 theophylline CN1C2=C(C(=
    Cn1c2c(c(=O) 274.5 2068 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    O)N(C1=O)C)
    28587 Theophylline N=CN2 274 2068 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28588 thianthrene C1=CC=C2C(
    S1c3c(Sc2c1cc 159.3 6842 http://chems
    http://dx.doi EPISuite-ChemSpider
    =C1)SC3=CC=
    28589 Thianthrene CC=C3S2 159 6842 .org/10.1080
    http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    /106293607
    28590 thiazafluron FC(F)
    FC(F)(F)c1nnc 136.5 30487 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    (F)c1nnc(s1)
    28591 Thiazafluron N(C(=O)NC)C 136.5 30487 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28592 thiophene c1ccsc1 -38 7739 http://www.aAcros
    28593 thiophene c1ccsc1 -38.21 7739 http://www.hCRC Handbook
    28594 thiophene c1ccsc1 -38.3 7739 http://dx.doi Fawcett FS; Rasmussen HE Journal of the American Chemical Society;
    28595 thiophene c1ccsc1
    C1=CC=C2C( -38 7739 http://www. Sigma-Aldrich
    28596 thiophene =C1)C(=O)C3
    c1ccsc1 -38.3 7739 Knovel
    =CC=CC=C3S
    28597 Thioxanthen- 2 211 9873 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28598 trans-1,4-cycl O=C(O)[C@H] 308 10466934 https://scifin Journal of the Indian Institute of Science
    28599 trans-1,4-cycl O=C(O)[C@H] 301 10466934 https://scifin patent
    28600 trans-1,4-cycl C1C2C(C(C1C
    O=C(O)[C@H] 312 10466934 https://scifin patent
    28601 trans-2-Aminol)Cl)C3(C(=C(
    N[C@@H]1C(C 155 0 http://www.ar
    http://dx.doi Arkivoc
    C2(C3(Cl)Cl)C
    28602 trans-Chlorda l)Cl)Cl)Cl 106 5772 .org/10.1080
    http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    /106293607
    28603 trans-gamma-C1C2C(C(C1Cl)C 106 21429023 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    C1=CC=C(C=
    28604 trans-stilbenec1ccc(cc1)/C= 125 553649 http://www.aSepassi K; Yalkowsky SH AAPS PharmSciTech; 7(1); E1-E8 (2006)
    C1)/C=C/C2= http://dx.doi
    28605 trans-StilbeneC1=CC=C(C=
    CC=CC=C2 125 .org/10.1080
    553649 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    /106293607
    C1)C2=NC3=
    28606 triamcinoloneO=C\1\C=C5/ 293 6196 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    C(N=C(N=C3
    28607 Triamterene N=C2N)N)N 306 5345 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    http://dx.doi
    CC1=NN=C2
    28608 triazolam Clc4ccccc4C/2
    N1C3=C(C=C( 224 5355 .org/10.1080
    http://www.aSepassi K; Yalkowsky SH AAPS PharmSciTech; 7(1); E1-E8 (2006)
    /106293607
    28609 triazolam C=C3)Cl)C(=
    Clc4ccccc4C/2 234 5355 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    NC2)C4=CC=
    28610 Triazolam CC=C4Cl 234 5355 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28611 trichloroaceticClC(Cl)(Cl)C(O 57.5 10772050 http://chems EPISuite-ChemSpider
    28612 trichloroacetyClC(Cl)(Cl)C(C -56.95 6180 http://webbooNIST Web Book
    28613 trichloroacetyClC(Cl)(Cl)C(C -57 6180 http://tinyur Sigma-Aldrich
    28614 triethylamine CCN(CC)CC -115 8158 http://www.aAlfa Aesar
    28615 triethylamine CCN(CC)CC -114.7 8158 http://www.hCRC Handbook
    28616 triethylamine CCN(CC)CC -115 8158 http://www.inINCHEM
    28617 triethylamine CCN(CC)CC -114.7 8158 http://en.wik Wikipedia
    28618 triethylamine CCN(CC)CC -115 8158 http://www.wo
    Wolfram Alpha
    28619 trihexyphenidOC(c1ccccc1) 115 5371 http://apps.wWHO
    28620 trimethoprim COc1cc(cc(c1 201 5376 http://chems
    http://dx.doi EPISuite-ChemSpider
    28621 triphenylene c1ccc2c(c1)c3
    C1=CC=C2C( 199 8816 .org/10.1080
    http://www.aSepassi K; Yalkowsky SH AAPS PharmSciTech; 7(1); E1-E8 (2006)
    /106293607
    28622 triphenylene =C1)C3=CC=
    c1ccc2c(c1)c3 196.5 8816 01430124 RAEVSKY OA; PERLOVICH GL and SCHAPER K-J. Physicochemical prope
    CC=C3C4=CC
    28623 Triphenylene =CC=C24 197 8816 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28624 Ugi product 1 O=C(CNC(=O)O 147 21106009 http://useful UsefulChem
    28625 Ugi product 1 CC(C)(C)NC(= 180 21106058 http://useful UsefulChem
    28626 Ugi product 1 CN(C)c1ccc(cc 194 21105842 http://useful UsefulChem
    28627 Ugi product 1 CC(C)(C)NC(=O 141 21105844 http://useful UsefulChem
    28628 Ugi product 1 COc1cc(cc(OC 138 21105845 http://useful UsefulChem
    28629 Ugi product 1 O=C(Cc1ccccc 185 21105594 http://useful EPISuite-ChemSpider
    28630 Ugi product 2 O=C(CNC(=O)O 203 21106059 http://useful UsefulChem
    28631 Ugi product 6 O=C(CNC(=O)O 177 10481870 http://useful UsefulChem
    28632 undecanoic acO=C(O)CCCCC 28.6 7888 http://chems EPISuite-ChemSpider
    28633 urea C(=O)(N)N 132.7 1143 http://chems EPISuite-ChemSpider
    28634 vanillin Oc1ccc(cc1OC 81.5 13860434 http://chems EPISuite-ChemSpider
    28635 veratraldehydCOc1cc(ccc1O 43 21106008 http://chems EPISuite-ChemSpider
    28636 warfarin CC(=O)CC(C\1 161 10442445 http://www.c EPISuite-ChemSpider
    28637 warfarin CC(=O)CC(C\1 163 10442445 http://www.c Chemical Book
    28638 warfarin CC(=O)CC(C\1 156 10442445 http://www.i INCHEM
    28639 warfarin CC(=O)CC(C\1 161 10442445 http://www.kKnovel
    28640 warfarin CC(=O)CC(C\1 161.5 10442445 http://msds.c Oxford
    28641 xanthene c1ccc2c(c1)Cc 100.5 6840 http://chems EPISuite-ChemSpider
    28642 xanthene c1ccc2c(c1)Cc 100.5 6840 http://www.aCRC Handbook of Chemistry and Physics
    28643 xanthene C1C2=CC=CC
    c1ccc2c(c1)Cc 101.5 6840 http://www.siSigma-Aldrich
    =C2OC3=CC=
    28644 Xanthene CC=C31 101 6840 http://dx.doi Abraham M.H. and Acree Jr. W.E. The solubility of liquid and solid com
    28645 Z-crotononitriN#C\C=C/C -72.6 558873 http://en.wik Bulletin des Societes Chimiques Belges
    donotusebecause
    clearly out of range JCB
    sign inversion JCB
    out of range and 1- and 2-pentanol much closer to lower values JCB
    repeating value clearly out of range cc
    probable outlier JCB
    clearly out of range JCB

    clearly out of range JCB


    clearly out of range JCB
    out of range - probably refers to aqueous solution JCB
    refers to aq. solution, not pure compound otherwise reported as needles JCB
    r U.; Luthman K.; Artursson P. Molecular Descriptors Influencing Melting Point and Their Role in Classification of Solid Drugs. J. Chem. Inf. Comput. Sci.; (Article); 2003; 43
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    r U.; Luthman K.; Artursson P. Molecular Descriptors Influencing Melting Point and Their Role in Classification of Solid Drugs. J. Chem. Inf. Comput. Sci.; (Article); 2003; 43
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    r U.; Luthman K.; Artursson P. Molecular Descriptors Influencing Melting Point and Their Role in Classification of Solid Drugs. J. Chem. Inf. Comput. Sci.; (Article); 2003; 43
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    r U.; Luthman K.; Artursson P. Molecular Descriptors Influencing Melting Point and Their Role in Classification of Solid Drugs. J. Chem. Inf. Comput. Sci.; (Article); 2003; 43
    r U.; Luthman K.; Artursson P. Molecular Descriptors Influencing Melting Point and Their Role in Classification of Solid Drugs. J. Chem. Inf. Comput. Sci.; (Article); 2003; 43
    r U.; Luthman K.; Artursson P. Molecular Descriptors Influencing Melting Point and Their Role in Classification of Solid Drugs. J. Chem. Inf. Comput. Sci.; (Article); 2003; 43
    r U.; Luthman K.; Artursson P. Molecular Descriptors Influencing Melting Point and Their Role in Classification of Solid Drugs. J. Chem. Inf. Comput. Sci.; (Article); 2003; 43
    r U.; Luthman K.; Artursson P. Molecular Descriptors Influencing Melting Point and Their Role in Classification of Solid Drugs. J. Chem. Inf. Comput. Sci.; (Article); 2003; 43
    r U.; Luthman K.; Artursson P. Molecular Descriptors Influencing Melting Point and Their Role in Classification of Solid Drugs. J. Chem. Inf. Comput. Sci.; (Article); 2003; 43
    r U.; Luthman K.; Artursson P. Molecular Descriptors Influencing Melting Point and Their Role in Classification of Solid Drugs. J. Chem. Inf. Comput. Sci.; (Article); 2003; 43
    r U.; Luthman K.; Artursson P. Molecular Descriptors Influencing Melting Point and Their Role in Classification of Solid Drugs. J. Chem. Inf. Comput. Sci.; (Article); 2003; 43
    r U.; Luthman K.; Artursson P. Molecular Descriptors Influencing Melting Point and Their Role in Classification of Solid Drugs. J. Chem. Inf. Comput. Sci.; (Article); 2003; 43
    r U.; Luthman K.; Artursson P. Molecular Descriptors Influencing Melting Point and Their Role in Classification of Solid Drugs. J. Chem. Inf. Comput. Sci.; (Article); 2003; 43
    r U.; Luthman K.; Artursson P. Molecular Descriptors Influencing Melting Point and Their Role in Classification of Solid Drugs. J. Chem. Inf. Comput. Sci.; (Article); 2003; 43
    r U.; Luthman K.; Artursson P. Molecular Descriptors Influencing Melting Point and Their Role in Classification of Solid Drugs. J. Chem. Inf. Comput. Sci.; (Article); 2003; 43
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    r U.; Luthman K.; Artursson P. Molecular Descriptors Influencing Melting Point and Their Role in Classification of Solid Drugs. J. Chem. Inf. Comput. Sci.; (Article); 2003; 43
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    r U.; Luthman K.; Artursson P. Molecular Descriptors Influencing Melting Point and Their Role in Classification of Solid Drugs. J. Chem. Inf. Comput. Sci.; (Article); 2003; 43
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    r U.; Luthman K.; Artursson P. Molecular Descriptors Influencing Melting Point and Their Role in Classification of Solid Drugs. J. Chem. Inf. Comput. Sci.; (Article); 2003; 43
    r U.; Luthman K.; Artursson P. Molecular Descriptors Influencing Melting Point and Their Role in Classification of Solid Drugs. J. Chem. Inf. Comput. Sci.; (Article); 2003; 43
    r U.; Luthman K.; Artursson P. Molecular Descriptors Influencing Melting Point and Their Role in Classification of Solid Drugs. J. Chem. Inf. Comput. Sci.; (Article); 2003; 43
    r U.; Luthman K.; Artursson P. Molecular Descriptors Influencing Melting Point and Their Role in Classification of Solid Drugs. J. Chem. Inf. Comput. Sci.; (Article); 2003; 43
    r U.; Luthman K.; Artursson P. Molecular Descriptors Influencing Melting Point and Their Role in Classification of Solid Drugs. J. Chem. Inf. Comput. Sci.; (Article); 2003; 43
    r U.; Luthman K.; Artursson P. Molecular Descriptors Influencing Melting Point and Their Role in Classification of Solid Drugs. J. Chem. Inf. Comput. Sci.; (Article); 2003; 43
    r U.; Luthman K.; Artursson P. Molecular Descriptors Influencing Melting Point and Their Role in Classification of Solid Drugs. J. Chem. Inf. Comput. Sci.; (Article); 2003; 43
    r U.; Luthman K.; Artursson P. Molecular Descriptors Influencing Melting Point and Their Role in Classification of Solid Drugs. J. Chem. Inf. Comput. Sci.; (Article); 2003; 43
    r U.; Luthman K.; Artursson P. Molecular Descriptors Influencing Melting Point and Their Role in Classification of Solid Drugs. J. Chem. Inf. Comput. Sci.; (Article); 2003; 43
    r U.; Luthman K.; Artursson P. Molecular Descriptors Influencing Melting Point and Their Role in Classification of Solid Drugs. J. Chem. Inf. Comput. Sci.; (Article); 2003; 43
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    r U.; Luthman K.; Artursson P. Molecular Descriptors Influencing Melting Point and Their Role in Classification of Solid Drugs. J. Chem. Inf. Comput. Sci.; (Article); 2003; 43
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    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-638
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-639
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-640
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-641
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-642
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-643
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-644
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-645
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-646
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-647
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-648
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-649
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-650
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-651
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-652
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-653
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-654
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-655
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-656
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-657
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-658
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-659
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-660
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-661
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-662
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-663
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-664
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-665
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-666
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-667
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-668
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-669
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-670
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-671
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-672
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-673
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-674
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-675
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-676
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-677
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-678
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-679
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-680
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-681
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-682
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-683
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-684
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-685
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-686
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-687
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-688
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-689
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-690
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-691
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-692
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-693
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-694
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-695
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-696
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-697

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-699
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-700
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-701
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-702
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-703
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-704
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-705
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-706
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-707
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-708
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-709
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-710
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-711
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-712
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-713
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-714
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-715
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-716
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-717
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-718
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-719
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-720
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-721
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-722
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-723
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-724
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-725
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-726
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-727
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-728
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-731
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-732
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-733
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-734
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-735
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-736

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-739
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-740
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-741
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-742
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-743
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-744
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-745
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-746
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-747

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-749
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-750
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-751
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-752
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-753
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-754
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-755
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-756
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-757
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-758
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-759
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-760
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-761
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-762
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-763
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-764
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-765
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-766
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-767
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-768
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-769
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-770
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-771

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-773
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-774

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-776
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-777
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-778
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-779
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-780
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-781
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-782
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-783
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-784
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-785
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-786
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-787
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-788
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-789
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-790
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-791
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-792
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-793
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-794
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-795
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-796
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-797
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-798
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-799
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-800
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-801
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-802
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-803
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-804
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-805
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-806
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-807
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-808
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-809
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-810
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-811
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-812
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-813
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-814
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-815
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-816
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-817
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-818
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-819
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-820
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-821
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-822
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-823
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-824
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    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-826

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-829
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-830
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-831
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-832
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-833
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-834
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-835
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-836
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-837
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-838
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-839
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-840
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-841
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-842
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-843
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-847
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-848
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-849
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-850
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-851
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-852
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-853
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-854
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-855
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-856
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-857
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-858
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-859
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-860
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-861
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-862
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-863
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-864
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-865
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-866
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-867
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-868
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-869
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-870
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-871
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-872
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-873
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-874
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-875
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-876
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-877
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-878
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-879
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-880
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-881
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-882
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-883
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-884
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-885
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-886
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-887
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-888
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-889
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-890
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-891
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-892
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-893
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-894
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-895
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-896
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-897
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-898
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-899
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-900
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-901
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-902
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-903
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-904
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-905
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-906
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-907
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-908
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-909
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-910
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-911
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-912
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-913
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-914
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-915
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-916
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-917
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-918
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-919
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-920
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-921
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-922
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-923
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-924
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-925
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-926
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-927
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-928
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-929
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-930
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-931
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-932
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-933
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-934
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-935
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-936
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-937
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-938
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-939
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-940
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-941
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-942
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-943
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-944
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-945
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-946
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-947
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-948
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-949
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-950
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-951
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-952
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-953
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-954

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-960

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-963
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-964
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-965
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-966
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-967
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-968
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-969
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-970
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-971
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-972
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-973
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-974
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-975
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-976
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-977
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-978
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-979
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-980
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-981
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-982
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-983
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-984
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-985
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-986
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-987
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-988
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-989
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-990
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-991
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-992
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-993
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-994
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-995
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-996
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-997
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-998
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-999
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1000
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1001
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1002
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1003
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1004
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1005
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1006
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1007
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1008
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1009
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1010
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1011
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1012
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1013
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1014
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1015
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1016
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1017
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1018
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1019
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1020
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1021
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1022
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1023
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1024
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1025
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1026
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1027
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1028
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1029
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1030
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1031
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1032
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1033
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1034
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1035
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1036
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1037
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1038
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1039
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1040
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1041
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1042
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1043
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1044
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1045
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1046
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1047
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1048
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1049
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1050
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1051
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1052
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1053
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1054
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1055
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1056
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1057
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1058
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1059
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1060
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1061
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1062
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1063
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1064
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1065
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1066
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1067
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1068
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1069
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1070
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1071
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1072
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1073
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1074
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1075
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1076
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1077
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1078
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1079
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1080
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1081
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1082
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1083
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1084
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1085
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1086
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1087
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1088
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1089
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1090
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1091
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1092
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1093
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1094
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1095
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1096
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1097
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1098
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1099
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1100
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1101
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1102
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1103
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1104
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1105
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1106
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1107
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1108
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1109
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1110
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1111
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1112
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1113
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1114
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1115
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1116
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1117
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1118
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1119
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1120
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1121
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1122
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1123
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1124
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1125
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1126
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1127
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1128
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1129
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1130
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1131
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1132
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1133
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1134
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1135
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1136
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1137
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1138
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1139
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1140
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1141
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1142
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1143
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1144
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1145
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1146
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1147
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1148
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1149
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1150
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1151
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1152
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1153
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1154
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1155
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1156
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1157
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1158
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1159
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1160
    metal and mixture - AL
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1162
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1163
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1164
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1165
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1166
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1167
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1168
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1169
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1170
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1171
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1172
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1173
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1174
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1175
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1176
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1177
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1178
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1179
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1180
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1181
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1182
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1183
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1184
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1185
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1186
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1187
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1188
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1189
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1190
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1191
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1192
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1193
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1194
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1195
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1196
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1197
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1198
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1199
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1200
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1201
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1202
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1203
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1204
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1205
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1206
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1207
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1208
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1209
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1210
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1211
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1212
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1213
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1214
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1215
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1216
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1217
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1218
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1219
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1220
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1221
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1222
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1223
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1224
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1225
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1226
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1227
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1228
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1229
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1230
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1231
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1232
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1233
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1234
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1235
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1236
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1237
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1238
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1239
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1240
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1241
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1242
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1243
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1244
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1245
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1246
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1247
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1248
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1249
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1250
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1251
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1252
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1253
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1254
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1255
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1256
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1257
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1258
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1259
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1260
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1261
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1262
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1263
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1264
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1265
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1266
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1267
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1268
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1269
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1270
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1271
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1272
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1273
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1274
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1275
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1276
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1277
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1278
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1279
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1280
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1281
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1282
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1283
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1284
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1285
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1286
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1287
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1288
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1289
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1290
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1291
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1292
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1293
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1294
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1295
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1296
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1297
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1298
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1299
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1300
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1301
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1302
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1303
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1304
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1305
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1306
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1307
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1308
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1309
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1310
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1311
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1312
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1313
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1314
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1315
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1316
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1317
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1318
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1319
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1320
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1321
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1322
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1323
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1324
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1325
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1328
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1329
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1330

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1333

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1337
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1338
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1339
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1340
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1341
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1342
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1343
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1344
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1345
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1346
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1347
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1348
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1349
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1350
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1351
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1352
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1353
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1354
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1355
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1356
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1357
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1358
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1359
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1360
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1361
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1362
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1363
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1364
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1365
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1366
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1367
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1368
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1369
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1370
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1371
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1372
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1374
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1375
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1376
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1377
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1378
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1379
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1380
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1381
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1382
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1383
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1384
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1385
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1386
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1387
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1388
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1389
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1390
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1391
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1392
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1393

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1395
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1396
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1397
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1398
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1399
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1400
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1401
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1402
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1403
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1404
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1405
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1406
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1407
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1408
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1409
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1410
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1411
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1412
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1413
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1414
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1415
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1416
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1417
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1418
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1419
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1420
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1421
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1422
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1423
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1424
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1425
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1426
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1427
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1428

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1431

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1433
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1434
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1435
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1436
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1437
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1438
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1439
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1440
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1441
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1442
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1443
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1444

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1446
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1447
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1448

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1450
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1451
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1452

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1454
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1455
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1456

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1458
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1459
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1460
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1461
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1462
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1463
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1464
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1465
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1466
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1467
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1468
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1469
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1470
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1471

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1476
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1477
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1478
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1479
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1480
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1481
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1482
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1483
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1484
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1485
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1486
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1487
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1488
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1489
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1490
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1491
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1492
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1493
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1494
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1495
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1496
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1497
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1498
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1499
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1500
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1501
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1502
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1503
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1504
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1505
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1506
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1507
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1508
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1509
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1510
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1511
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1512
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1513
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1514
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1515
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1516
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1517
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1518
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1519
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1520
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1521
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1522
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1523
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1524
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1525
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1526
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1527
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1528
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1529
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1530
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1531
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1532
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1533
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1534
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1535
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1536
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1537
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1538
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1539
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1540
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1541
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1542
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1543
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1544
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1545
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1546
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1547
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1548
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1549
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1550
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1551
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1552
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1553
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1554
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1555
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1556
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1557
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1558
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1559
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1560
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1561
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1562
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1563
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1564
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1565
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1566
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1567
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1568
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1569
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1570
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1571
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1572
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1573
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1574
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1575
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1576
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1577
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1578
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1579
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1580
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1581
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1582
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1583
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1584
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1585
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1586
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1587
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1588
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1589
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1590
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1591
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1592
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1593
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1594
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1595
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1596
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1597
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1598
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1599
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1600
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1601
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1602
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1603
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1604
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1605
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1606
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1607
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1608
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1609
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1610
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1611
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1612
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1613
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1614
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1615
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1616
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1617
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1618
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1619
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1620
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1621
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1622
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1623
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1624
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1625
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1626
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1627
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1628
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1629
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1630
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1631
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1632
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1633
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1634
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1635
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1636
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1637
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1638
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1639
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1640
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1641
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1642
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1643
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1644
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1645
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1646
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1647
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1648
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1649
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1650
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1651
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1652
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1653
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1654
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1655
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1656
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1657
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1658
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1659
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1660
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1661
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1662
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1663
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1664
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1665
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1666
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1667
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1668
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1669
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1670
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1671
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1672
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1673
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1674
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1675
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1676
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1677
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1678
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1679
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1680
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1681
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1682
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1683
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1684
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1685
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1686
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1687
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1688
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1689
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1690
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1691
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1692
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1693
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1694
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1695
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1696
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1697
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1698
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1699
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1700
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1701
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1702
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1703
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1704
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1705
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1706
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1707
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1708
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1709
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1710
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1711
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1712
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1713
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1714
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1715
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1716
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1717
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1718
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1719
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1720
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1721
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1722
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1723
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1724
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1725
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1726
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1727
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1728
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1729
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1730
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1731
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1732
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1733
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1734
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1735
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1736
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1737
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1738
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1739
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1740
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1741
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1742
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1743
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1744
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1745
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1746
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1747
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1748
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1749
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1750
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1751
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1752
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1753
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1754
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1755
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1756
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1757
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1758
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1759
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1760
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1761
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1762
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1763
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1764
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1765
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1766
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1767
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1768
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1769
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1770
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1771
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1772
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1773
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1774
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1775
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1776
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1777
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1778
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1779
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1780
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1781
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1782
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1783
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1784
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1785
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1786
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1787
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1788
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1789
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1790
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1791
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1792
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1793
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1794
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1795
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1796
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1797
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1798
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1799
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1800
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1801
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1802
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1803
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1804
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1805
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1806
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1807
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1808
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1809
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1810
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1811
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1812
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1813
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1814
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1815
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1816
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1817
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1818
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1819
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1820
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1821
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1822
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1823
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1824
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1825
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1826
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1827
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1828
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1829
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1830

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1832
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1833
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1834
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1835
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1836
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1837
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1838
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1839
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1840
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1841
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1842
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1843
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1844
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1845
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1846
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1847
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1848
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1849
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1850
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1851
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1852
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1853
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1854
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1855
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1856
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1857
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1858
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1859
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1860
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1861
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1862
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1863
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1864
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1865
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1866
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1867
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1868
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1869
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1870
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1871

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1874

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1876
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1877
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1878
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1879
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1880
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1881
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1882
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1883

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1885
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1886
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1887
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1888
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1889
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1890
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1891
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1892
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1893
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1894
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1895
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1896
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1897
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1898
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1899
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1900
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1901
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1902
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1903

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1905
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1906
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1907
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1908
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1909
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1910
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1911
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1912
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1913
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1914
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1915
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1916
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1917
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1918
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1919
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1920
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1921
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1922
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1923
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1924
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1925
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1926
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1927
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1928
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1929
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1930
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1931
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1932
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1933
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1934
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1935
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1936
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1937
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1938
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1939
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1940
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1941
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1942
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1943
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1944
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1945
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1946
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1947
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1948
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1949
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1950
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1951
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1952
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1953
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1954
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1955
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1956
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1957
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1958
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1959
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1960
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1961
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1962
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1963
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1964
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1965
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1966
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1967
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1968
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1969
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1970
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1971
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1972
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1973
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1974
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1975
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1976
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1977
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1978
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1979
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1980
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1981
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1982
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1983
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1984
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1985
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1986
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1987
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1988
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1989
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1990
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1991
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1992
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1993
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1994
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1995
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1996
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1997
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1998
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-1999
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2000
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2001
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2002
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2003
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2004
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2005
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2006
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2007
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2008
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2009
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2010
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2011
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2012
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2013
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2014
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2015
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2016
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2017
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2018
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2019
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2020
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2021
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2022
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2023
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2024
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2025
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2026
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2027
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2028
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2029
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2030
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2031
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2032
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2033
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2034
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2035
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2036
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2037
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2038
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2039
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2040
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2041
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2042
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2043
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2044
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2045
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2046
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2047
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2048
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2049
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2050
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2051
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2052
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2053
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2054
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2055
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2056
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2057
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2058
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2059
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2060
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2061
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2062
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2063
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2064
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2065
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2066
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2067
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2068
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2069
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2070
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2071
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2072
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2073
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2074
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2075
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2076
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2077
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2078
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2079
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2080
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2081
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2082
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2083
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2084
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2085
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2086
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2087
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2088
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2089
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2090
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2091
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2092
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2093
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2094
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2095
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2096
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2097
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2098
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2099
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2100
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2101
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2102
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2103
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2104
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2105
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2106
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2107
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2108
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2109
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2110
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2111
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2112
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2113
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2114
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2115
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2116
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2117
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2118
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2119
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2120
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2121
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2122
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2123
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2124
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2125
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2126
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2127
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2128

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2130
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2131
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2132
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2133
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2134
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2135
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2136
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2137
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2138
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2139
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2140
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2141
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2142
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2143
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2144
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2145
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2146
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2147
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2148
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2149
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2150
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2151
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2152
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2153
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2154
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2155
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2156
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2157
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2158
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2159
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2160
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2161
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2162
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2163
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2164
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2165
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2166
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2167
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2168
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2169
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2170
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2171
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2172
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2173
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2174
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2175
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2176
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2177
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2178
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2179
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2180
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2181
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2182
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2183
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2184
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2185
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2186
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2187
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2188
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2189
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2190
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2191
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2192
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2193
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2194
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2195
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2196
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2197
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2198
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2199
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2200
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2201
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2202
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2203
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2204
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2205
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2206
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2207
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2208
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2209
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2210
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2211
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2212
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2213
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2214
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2215
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2216
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2217
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2218
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2219
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2220
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2221
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2222
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2223
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2224
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2225
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2226
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2227
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2228
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2229
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2230
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2231
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2232
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2233
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2234
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2235
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2236
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2237
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2238
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2239
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2240
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2241
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2242
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2243
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2244
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2245
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2246
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2247
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2248
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2249
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2250
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2251
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2252
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2253
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2254
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2255
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2256
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2257
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2258
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2259
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2260
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2261
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2262
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2263
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2264
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2265
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2266
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2267
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2268
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2269
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2270
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2271
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2272
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2273
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2274
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2275
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2276
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2277
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2278
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2279
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2280
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2281
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2282
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2283
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2284
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2285
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2286
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2287
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2288
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2289
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2290
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2291
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2292
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2293
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2294
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2295
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2296
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2297
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2298
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2299
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2300
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2301
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2302
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2303
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2304
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2305
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2306
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2307
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2308
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2309
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2310
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2311
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2312
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2313
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2314
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2315
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2316
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2317
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2318
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2319
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2320
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2321
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2322
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2323
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2324
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2325
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2326
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2327
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2328
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2329
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2330
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2331
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2332
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2333
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2334
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2335
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2336
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2337
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2338
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2339
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2340
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2341
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2342
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2343
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2344
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2345
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2346
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2347
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2348
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2349

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2355
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2356
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2357
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2358
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2359
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2360
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2361
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2362
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2363
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2364
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2365
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2366
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2367
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2368

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2370
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2371
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2372
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2373
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2374
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2375
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2376
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2377
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2378
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2379
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2380
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2381
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2382
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2383
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2384
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2385
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2386
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2387
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2388
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2389
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2390
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2391
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2392
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2393
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2394
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2395
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2396
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2397
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2398
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2399
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2400
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2401
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2402
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2403
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2404
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2405
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2406
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2407
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2408
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2409
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2410
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2411
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2412
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2413
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2414
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2415
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2416
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2417
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2418
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2419
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2420
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2421
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2422
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2423
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2424
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2425
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2426
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2427
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2428
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2429
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2430
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2431
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2432
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2433
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2434
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2435
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2436
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2437
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2438
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2439
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2440
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2441
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2442
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2443
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2444
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2445
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2446

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2448
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2449
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2450
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2451
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2452
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2453
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2454
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2455
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2456
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2457
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2458
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2459
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2460
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2461
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2462
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2463
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2464
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2465
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2466
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2467
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2468
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2469
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2470
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2471
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2472
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2473
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2474
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2475
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2476
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2477
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2478
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2479
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2480
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2481
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2482
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2483
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2484
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2485
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2486
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2487
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2488
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2489
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2490
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2491
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2492
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2493
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2494
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2495
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2496
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2497
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2498
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2499
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2500
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2501
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2502
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2503
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2504
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2505

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2511
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2512
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2513
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2514
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2515
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2516
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2517
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2518
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2519
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2520
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2521
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2522
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2523
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2524
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2525
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2526
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2527
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2528
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2529
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2530
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2531
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2532
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2533
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2534
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2535
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2536
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2537
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2538
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2539
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2540
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2541
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2542
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2543
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2544
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2545
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2546
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2547
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2548
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2549
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2550
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2551
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2552
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2553
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2554
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2555
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2556
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2557
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2558
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2559
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2560
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2561
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2562
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2563
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2564
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2565
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2566
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2567
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2568
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2569
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2570
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2571
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2572
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2573
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2574
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2575
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2576
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2577
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2578
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2579
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2580
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2581
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2582
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2583
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2584
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2585
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2586
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2587
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2588
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2589
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2590
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2591
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2592
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2593
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2594
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2595
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2596
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2597
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2598
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2599
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2600
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2601
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2602
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2603
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2604
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2605
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2606
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2607
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2608
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2609
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2610
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2611
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2612
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2613
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2614
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2615
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2616
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2617
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2618
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2619
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2620
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2621
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2622
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2623
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2624

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2630
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2631
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2632
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2633
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2634
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2635
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2636
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2637
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2638
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2639
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2640
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2641
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2642
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2643
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2644
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2645
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2646
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2647
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2648
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2649
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2650
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2651
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2652
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2653
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2654
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2655
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2656

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2658
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2659
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2660
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2661
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2662
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2663
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2664
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2665
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2666
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2667
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2668
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2669
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2670
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2671
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2672
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2673
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2674

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2676

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2681
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2682
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2683

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2685
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2686

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2695

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2698
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2699

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2702

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2704
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2705
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2706
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2707
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2708
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2709

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2711

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2714
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2715
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2716
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2717
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2718
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2719
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2720
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2721
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2722
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2723
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2724
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2725
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2726
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2727
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2728
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2729
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2730
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2731
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2732
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2733
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2734
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2735
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2736
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2737
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2738
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2739
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2740
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2741
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2742
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2743
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2744
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2745
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2746
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2747
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2748
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2749
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2750
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2751
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2752
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2753
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2754
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2755
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2756
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2757
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2758
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2759
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2760
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2761
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2762
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2763
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2764
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2765
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2766
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2767
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2768
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2769

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2787
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2788
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2789
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2790
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2791
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2792
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2793
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2794
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2795
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2796
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2797
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2798
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2799
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2800
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2801
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2802
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2803
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2804
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2805
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2806
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2807
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2808
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2809
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2810
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2811
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2812
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2818
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2819
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2820
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2821
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2822
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2823
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2824
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2825
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2826
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2827
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2828
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2829
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2830
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2831
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2832
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2833
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2834
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2835
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2836
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2837
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2838
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2839
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2840
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2841
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2842
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2843
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2844
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2845
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2846
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2847
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2848
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2849
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2850
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2851
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2852
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2853
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2854
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2855
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2856
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2857
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2858
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2859
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2860
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2861
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2862
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2863
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2864
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2865
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2866
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2867
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2868
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2869
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2870
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2871
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2872
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2873
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2874
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2875
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2876
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2877
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2878
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2879
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2880
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2881
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2882
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2883
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2884
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2885
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2886
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2887
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2888
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2889
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2890
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2891
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2892
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2893
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2894
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2895
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2896
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2897
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2898
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2899
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2900
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2901
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2902
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2903
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2904
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2905
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2906
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2907
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2908
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2911
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2912
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2913
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2914
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2915
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2916

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2918
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2919
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2920
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2921
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2922
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2923
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2924
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2925
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2926
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2927
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2928
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2929
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2930
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2931
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2932
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2933
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2934
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2935
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2936
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2937

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2939
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2940

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2942
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2943
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2944
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2945
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2946
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2947
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2948

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2951
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2952
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2953
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2954
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2961
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2962
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2963
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2964
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2965
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2966
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2967
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2968
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2969
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2970
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2971
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2972
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2973
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2974
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2975
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2976
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2977
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2978
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2979
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2980
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2981

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2983
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2984
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2985
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2986
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2987
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2988
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2989
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2990
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2991
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2992

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2996
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2997

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-2999

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3001
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3002
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3006
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3007
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3008
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3009
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3010
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3011
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3012
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3013
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3014
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3015
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3016
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3017
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3018
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3019
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3020
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3021
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3022
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3023
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3024
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3025
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3026
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3027
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3028
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3029
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3030
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3031
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3032
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3033
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3034
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3035

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3037
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3038
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3039
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3040
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3041
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3042
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3043

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3045
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3046
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3047
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3048
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3049
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3050
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3051
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3052
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3054
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3055
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3056
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3057
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3058
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3059
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3060
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3061
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3062
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3063
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3064
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3065
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3066
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3067
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3068
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3069
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3070
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3071
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3072
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3073
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3074
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3075
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3076

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3078

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3084
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3085
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3086
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3087
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3088
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3089
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3090
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3091
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3092
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3093
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3094
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3095
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3096
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3097
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3098
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3099

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3101
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3102
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3103
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3104
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3105
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3106
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3107
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3108
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3109
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3110
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3111
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3112
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3113
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3114
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3115

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3117
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3118
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3119
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3120
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3121
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3122
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3123

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3125
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3126
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3127
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3128
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3129
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3130
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3131
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3132
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3133
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3134
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3135
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3136
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3137
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3138
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3139
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3140
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3141
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3142
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3143
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3144
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3145
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3146
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3147
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3148
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3150

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3152
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3153
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3154
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3155
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3156
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3157
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3158
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3159
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3160
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3161
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3162
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3163
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3164
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3165
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3166
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3167
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3168
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3169
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3170
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3171
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3172
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3173
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3174
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3175
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3176
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3177
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3178
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3179
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3180
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3181
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3182
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3183
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3184
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3185
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3186
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3187
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3188
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3189
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3190
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3191
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3192
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3193
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3194
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3195
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3196
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3197
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3198
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3199
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3200
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3201
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3202

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3205

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3209
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3210

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3212

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3214

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3217
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3218
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3219
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3220
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3221
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3222
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3223
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3224
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3225
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3226
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3227
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3228
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3229
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3230

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3233
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3234
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3235
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3236
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3237

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3239
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3240
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3241
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3242
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3243
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3244
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3245
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3246
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3247
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3248
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3249
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3250
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3251
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3252
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3253
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3254
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3255
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3256

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3258
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3259
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3260
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3261
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3262
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3263
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3264

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3266
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3267
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3268
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3269
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3270
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3271
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3272
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3273
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3274
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3275
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3276
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3277
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3278
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3279
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3280
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3281
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3282
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3283
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3284
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3285
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3286
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3287
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3288
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3289
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3290
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3291
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3292
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3293
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3294
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3295
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3296
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3297
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3298
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3299
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3300
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3301
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3302
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3303
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3304
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3305
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3306
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3307
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3308
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3309

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3311
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3312
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3313
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3314
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3315

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3317
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3318
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3319

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3321
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3322
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3323
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3324
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3325
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3326
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3327
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3328

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3330
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3331
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3332
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3333
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3334
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3335
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3336
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3337
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3338
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3339
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3340
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3341
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3342
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3343
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3344
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3345
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3346
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3347
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3348
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3349
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3350
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3351
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3352
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3353
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3354
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3355
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3356
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3357
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3358
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3359
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3360
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3361
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3362
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3363
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3364
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3365
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3366
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3367
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3368
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3369
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3370
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3371
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3372
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3373
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3374
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3375
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3376
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3377
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3378
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3379
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3380
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3381
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3382
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3383
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3384
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3385
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3386
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3387
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3388
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3389
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3390
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3391
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3392
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3393
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3394
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3395
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3396
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3397
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3398
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3399
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3400
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3401
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3402
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3403
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3404
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3405
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3406
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3407
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3408
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3409
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3410
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3411
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3412
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3413
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3414
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3415
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3416
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3417
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3418
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3419
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3420
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3421
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3422
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3423
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3424
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3425
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3426
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3427
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3428
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3429
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3430
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3431
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3432
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3433
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3434
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3435
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3436
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3437
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3438
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3439
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3440
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3441
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3442
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3443
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3444
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3445
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3446
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3447
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3448
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3449
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3450
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3451
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3452
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3453
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3454
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3455
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3456
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3457
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3458
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3459
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3460
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3461
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3462
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3463
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3464
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3465
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3466
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3467
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3468
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3469
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3470
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3471
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3472
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3473
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3474
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3475
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3476
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3477
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3478
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3479
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3480
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3481
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3482
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3483
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3484
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3485
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3486
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3487
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3488
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3489
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3490
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3491
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3492
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3493
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3494
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3495
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3496
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3497
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3498
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3499
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3500
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3501
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3502
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3503
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3504
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3505
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3506
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3507
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3508
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3509
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3510
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3511
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3512
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3513
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3514
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3515
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3516
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3517
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3518
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3519
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3520
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3521
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3522
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3523
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3524
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3525
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3526
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3527
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3528
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3529
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3530
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3531
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3532
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3533
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3534
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3535
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3536
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3537
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3538
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3539
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3540
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3541
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3542
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3543
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3544
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3545
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3546
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3547
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3548
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3549
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3550
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3551
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3552
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3553
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3554
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3555
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3556
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3557
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3558
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3559
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3560
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3561
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3562
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3563
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3564
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3565
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3566
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3567
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3568
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3569
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3570
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3571
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3572
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3573
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3574
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3575
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3576
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3577
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3578
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3579
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3580
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3581
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3582
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3583
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3584
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3585
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3586
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3587
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3588
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3589
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3590
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3591
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3592
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3593
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3594
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3595
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3596
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3597
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3598
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3599
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3600
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3601
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3602
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3603
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3604
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3605
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3606
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3607
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3608
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3609
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3610
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3611
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3612
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3613
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3614
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3615

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3617
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3618
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3619
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3620
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3621
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3622
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3623
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3624
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3625
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3626
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3627
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3628
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3629
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3630
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3631
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3632
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3633
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3634
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3635
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3636
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3637
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3638
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3639
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3640
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3641
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3642
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3643
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3644
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3645
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3646
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3647
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3648
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3649
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3650
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3651
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3652
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3653
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3654
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3655
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3656
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3657
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3658
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3659
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3660
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3661
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3662
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3663
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3664
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3665
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3666
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3667
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3668
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3669
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3670
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3671
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3672
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3673
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3674
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3675
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3676
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3677
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3678
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3679
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3680
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3681
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3682
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3683
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3684
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3685
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3686
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3687
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3688
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3689
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3690
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3691
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3692
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3693
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3694
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3695
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3696
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3697
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3698
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3699
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3700
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3701
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3702
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3703
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3704
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3705
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3706
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3707
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3708
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3709
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3710
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3711
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3712
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3713
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3714
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3715
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3716
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3717
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3718
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3719
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3720
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3721
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3722
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3723
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3724
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3725
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3726
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3727
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3728
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3729
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3730
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3731
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3732
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3733
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3734
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3735
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3736
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3737
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3738
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3739
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3740
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3741

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3743
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3744
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3745
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3746
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3747
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3748
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3749
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3750
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3751
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3752
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3753
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3754
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3755
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3756
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3757
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3758
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3759
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3760
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3761
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3762
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3763
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3764
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3765
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3766
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3767
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3768
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3769
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3770
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3771
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3772
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3773
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3774
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3775
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3776
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3777
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3778
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3779
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3780
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3781
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3782
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3783
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3784
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3785
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3786
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3787
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3788
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3789
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3790
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3791
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3792
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3793
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3794
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3795
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3796
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3797
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3798
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3799
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3800
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3801
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3802
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3803
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3804
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3805
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3806
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3807
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3808
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3809
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3810
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3811
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3812
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3813
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3814
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3815
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3816
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3817
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3818
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3819
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3820
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3821
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3822
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3823
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3824
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3825
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3826
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3827
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3828
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3829
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3830
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3831
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3832
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3833
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3834
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3835
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3836
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3837
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3838
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3839
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3840
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3841
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3842
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3843
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3844
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3845
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3846
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3847
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3848
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3849
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3850
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3851
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3852
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3853
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3854
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3855
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3856
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3857
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3858
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3859
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3860
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3861
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3862
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3863
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3864
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3865
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3866
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3867
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3868
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3869
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3870
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3871
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3872
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3873
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3874
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3875
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3876
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3877
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3878
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3879
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3880
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3881
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3882
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3883
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3884
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3885
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3886
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3887
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3888
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3889
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3890
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3891
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3892
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3893
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3894
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3895
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3896
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3897
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3898
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3899
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3900
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3901
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3902
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3903
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3904
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3905
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3906
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3907
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3908
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3909
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3910
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3911
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3912
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3913
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3914
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3915
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3916
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3917
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3918
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3919
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3920
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3921
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3922
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3923
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3924
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3925
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3926
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3927
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3928
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3929
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3930
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3931
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3932
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3933
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3934
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3935
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3936
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3937
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3938
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3939
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3940
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3941
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3942
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3943
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3944
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3945
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3946
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3947
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3948
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3949
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3950
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3951
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3952
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3953
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3954
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3955
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3956
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3957
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3958
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3959
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3960
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3961
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3962
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3963
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3964
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3965
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3966
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3967
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3968
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3969
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3970
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3971
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3972
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3973
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3974
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3975
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3976
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3977
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3978
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3979
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3980
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3981
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3982
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3983
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3984
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3985
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3986
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3987
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3988
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3989
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3990
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3991
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3992
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3993
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3994
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3995
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3996
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3997
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3998
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-3999
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4000
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4001
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4002
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4003
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4004
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4005
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4006
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4007
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4008
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4009
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4010
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4011
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4012
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4013
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4014
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4015
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4016
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4017
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4018
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4019
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4020
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4021
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4022
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4023
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4024
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4025
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4026
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4027
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4028
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4029
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4030
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4031
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4032
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4033
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4034
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4035
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4036
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4037
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4038
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4039
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4040
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4041
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4042
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4043
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4044
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4045
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4046
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4047
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4048
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4049
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4050
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4051
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4052
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4053
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4054
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4055
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4056
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4057
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4058
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4059
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4060
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4061
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4062
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4063
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4064
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4065
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4066
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4067
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4068
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4069
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4070
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4071
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4072
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4073
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4074
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4075
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4076
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4077
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4078
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4079
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4080
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4081
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4082
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4083
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4084
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4085
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4086
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4087
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4088
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4089
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4090
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4091
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4092
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4093
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4094
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4095
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4096
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4097
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4098
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4099
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4100
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4101
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4102
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4103
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4104
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4105
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4106
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4107
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4108
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4109
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4110
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4111
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4112
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4113
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4114
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4115
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4116
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4117
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4118
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4119
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4120
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4121
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4122
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4123
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4124
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4125
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4126
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4127
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4128
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4129
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4130
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4131
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4132
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4133
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4134
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4135
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4136
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4137
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4138
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4139
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4140
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4141
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4142
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4143
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4144
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4145
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4146
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4147
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4148
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4149
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4150
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4151
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4152
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4153
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4154
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4155
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4156
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4157
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4158
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4159
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4160
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4161
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4162
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4163
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4164
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4165
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4166
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4167
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4168
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4169
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4170
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4171
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4172
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4173
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4174
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4175
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4176
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4177
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4178
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4179
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4180
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4181
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4182
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4183
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4184
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4185
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4186
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4187
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4188
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4189
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4190
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4191
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4192
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4193
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4194
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4195
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4196
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4197
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4198
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4199
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4200
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4201
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4202
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4203
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4204
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4205
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4206
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4207
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4208
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4209
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4210
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4211

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4213
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4214
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4215
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4216
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4217
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4218
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4219
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4220
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4221
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4222
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4223
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4224
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4225
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4226
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4227
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4228
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4229
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4230
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4231
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4232
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4233
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4234
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4235
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4236
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4237
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4238
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4239

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4241
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4242
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4243
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4244
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4245
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4246

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4248
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4249
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4250
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4251
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4252
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4253
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4254
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4255
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4256
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4257
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4258
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4259
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4260
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4261
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4262
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4263
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4264
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4265
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4266
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4267
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4268
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4269
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4270
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4271
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4272
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4273
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4274
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4275
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4276
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4277
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4278
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4279
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4280
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4281
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4282
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4283
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4284
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4285
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4286
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4287
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4288
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4289
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4290
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4291
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4292
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4293
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4294
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4295
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4296
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4297
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4298
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4299
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4300
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4301
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4302
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4303
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4304
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4305
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4306
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4307
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4308
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4309
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4310
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4311
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4312
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4313
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4314
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4315
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4316
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4317
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4318
    clearly out of range JCB
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4320
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4321
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4322
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4323
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4324
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4325
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4326
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4327
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4328
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4329
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4330
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4331
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4332
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4333
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4334
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4335
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4336
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4337
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4338
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4339
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4340
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4341
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4342
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4343
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4344
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4345
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4346
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4347
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4348
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4349
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4350
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4351
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4352
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4353
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4354
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4355
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4356
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4357
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4358
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4359
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4360
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4361
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4362
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4363
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4364
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4365
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4366
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4367
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4368
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4369
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4370
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4371
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4372
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4373
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4374
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4375
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4376
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4377
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4378
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4379
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4380
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4381
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4382
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4383
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4384
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4385
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4386
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4387
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4388
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4389
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4390
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4391
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4392
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4393
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4394
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4395
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4396
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4397
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4398
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4399
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4400
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4401
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4402
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4403
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4404
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4405
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4406
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4407
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4408
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4409
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4410
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4411
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4412
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4413
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4414
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4415
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4416
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4417
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4418
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4419
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4420
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4421
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4422
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4423
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4424
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4425
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4426
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4427
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4428
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4429
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4430
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4431
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4432
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4433
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4434
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4435
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4436
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4437
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4438
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4439
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4440
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4441
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4442
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4443
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4444
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4445
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4446
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4447
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4448
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4449
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4450
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4451
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4452
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4453
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4454
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4455
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4456
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4457
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4458
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4459
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4460

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4462
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4463
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4464
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4465

    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4467
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4468
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4469
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4470
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4471
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4472
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4473
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4474
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4475
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4476
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4477
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4478
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4479
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4480
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4481
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4482
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4483
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4484
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4485
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4486
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4487
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4488
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4489
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4490
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4491
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4492
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4493
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4494
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4495
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4496
    stereochem undefined JCB
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4498
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4499
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4500
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4501
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4502
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4503
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4504
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4505
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4506
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4507
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4508
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4509
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4510
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4511
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4512
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4513
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4514
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4515
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4516
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4517
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4518
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4519
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4520
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4521
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4522
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4523
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4524
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4525
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4526
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4527
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4528
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4529
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4530
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4531
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4532
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4533
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4534
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4535
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4536
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4537
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4538
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4539
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4540
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4541
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4543
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4544
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4545
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4546
    clearly out of range JCB
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4548
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4549
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4550
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4551
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4552
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4553
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4554
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4555
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4556
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4557
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4558
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4559
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4560
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4561
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4562
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4563
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4564
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4565
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4566
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4567
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4568
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4569
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4570
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4571
    value clearly out of range JCB
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4573
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4574
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4575
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4576
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4577
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4578
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4579
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4580
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4581
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4582
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4583
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4584
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4585
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4586
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4587
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4588
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4589
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4590
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4591
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4592
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4593
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4594
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4595
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4596
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4597
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4598
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4599
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4600
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4601
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4602
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4603
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4604
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4605
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4606
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4607
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4608
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4609
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4610
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4611
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4612
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4613
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4614
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4615
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4616
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4617
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4618
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4619
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4620
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4621
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4622
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4623
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4624
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4625
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4626
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4627
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4628
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4629
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4630
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4631
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4632
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4633
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4634
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4635
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4636
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4637
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4638
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4639
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4640
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4641
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4642
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4643
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4644
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4645
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4646
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4647
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4648
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4649
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4650
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4651
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4652
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4653
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4654
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4655
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4656
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4657
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4658
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4659
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4660
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4661
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4662
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4663
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4664
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4665
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4666
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4667
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4668
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4669
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4670
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4671
    clearly out of range JCB
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4673
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4674
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4675
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4676
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4677
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4678
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4679
    Bender A. General melting point prediction based on a diverse compound dataset and artificial neural networks. J. Chem. Inf. Model.; 2005; 45(3); 581-4680
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    perties of Chemical Compounds; Vol. I; American Chemical Society; Washington; 1955.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. I; American Chemical Society; Washington; 1955.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    clearly out of range JCB
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    repeating value clearly out of range cc
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. I; American Chemical Society; Washington; 1955.
    perties of Chemical Compounds; Vol. I; American Chemical Society; Washington; 1955.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. I; American Chemical Society; Washington; 1955.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. I; American Chemical Society; Washington; 1955.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. I; American Chemical Society; Washington; 1955.
    perties of Chemical Compounds; Vol. I; American Chemical Society; Washington; 1955.
    perties of Chemical Compounds; Vol. I; American Chemical Society; Washington; 1955.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    perties of Chemical Compounds; Vol. I; American Chemical Society; Washington; 1955.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    hermodynamic Properties of Aliphatic Alcohols. (Supplement to Journal of Physical and Chemical Reference Data; Vol 2; No. 1.); American Chemical Society; Washington;
    hermodynamic Properties of Aliphatic Alcohols. (Supplement to Journal of Physical and Chemical Reference Data; Vol 2; No. 1.); American Chemical Society; Washington;
    hermodynamic Properties of Aliphatic Alcohols. (Supplement to Journal of Physical and Chemical Reference Data; Vol 2; No. 1.); American Chemical Society; Washington;
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    hermodynamic Properties of Aliphatic Alcohols. (Supplement to Journal of Physical and Chemical Reference Data; Vol 2; No. 1.); American Chemical Society; Washington;
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    hermodynamic Properties of Aliphatic Alcohols. (Supplement to Journal of Physical and Chemical Reference Data; Vol 2; No. 1.); American Chemical Society; Washington;
    hermodynamic Properties of Aliphatic Alcohols. (Supplement to Journal of Physical and Chemical Reference Data; Vol 2; No. 1.); American Chemical Society; Washington;
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
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    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    perties of Chemical Compounds; Vol. I; American Chemical Society; Washington; 1955.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. I; American Chemical Society; Washington; 1955.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. I; American Chemical Society; Washington; 1955.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. I; American Chemical Society; Washington; 1955.
    perties of Chemical Compounds; Vol. I; American Chemical Society; Washington; 1955.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. I; American Chemical Society; Washington; 1955.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. I; American Chemical Society; Washington; 1955.
    perties of Chemical Compounds; Vol. I; American Chemical Society; Washington; 1955.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. I; American Chemical Society; Washington; 1955.
    perties of Chemical Compounds; Vol. I; American Chemical Society; Washington; 1955.
    perties of Chemical Compounds; Vol. I; American Chemical Society; Washington; 1955.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    perties of Chemical Compounds; Vol. I; American Chemical Society; Washington; 1955.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. I; American Chemical Society; Washington; 1955.
    perties of Chemical Compounds; Vol. I; American Chemical Society; Washington; 1955.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    hermodynamic Properties of Aliphatic Alcohols. (Supplement to Journal of Physical and Chemical Reference Data; Vol 2; No. 1.); American Chemical Society; Washington;
    hermodynamic Properties of Aliphatic Alcohols. (Supplement to Journal of Physical and Chemical Reference Data; Vol 2; No. 1.); American Chemical Society; Washington;
    hermodynamic Properties of Aliphatic Alcohols. (Supplement to Journal of Physical and Chemical Reference Data; Vol 2; No. 1.); American Chemical Society; Washington;
    hermodynamic Properties of Aliphatic Alcohols. (Supplement to Journal of Physical and Chemical Reference Data; Vol 2; No. 1.); American Chemical Society; Washington;
    hermodynamic Properties of Aliphatic Alcohols. (Supplement to Journal of Physical and Chemical Reference Data; Vol 2; No. 1.); American Chemical Society; Washington;
    hermodynamic Properties of Aliphatic Alcohols. (Supplement to Journal of Physical and Chemical Reference Data; Vol 2; No. 1.); American Chemical Society; Washington;
    hermodynamic Properties of Aliphatic Alcohols. (Supplement to Journal of Physical and Chemical Reference Data; Vol 2; No. 1.); American Chemical Society; Washington;
    hermodynamic Properties of Aliphatic Alcohols. (Supplement to Journal of Physical and Chemical Reference Data; Vol 2; No. 1.); American Chemical Society; Washington;
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    hermodynamic Properties of Aliphatic Alcohols. (Supplement to Journal of Physical and Chemical Reference Data; Vol 2; No. 1.); American Chemical Society; Washington;
    hermodynamic Properties of Aliphatic Alcohols. (Supplement to Journal of Physical and Chemical Reference Data; Vol 2; No. 1.); American Chemical Society; Washington;
    hermodynamic Properties of Aliphatic Alcohols. (Supplement to Journal of Physical and Chemical Reference Data; Vol 2; No. 1.); American Chemical Society; Washington;
    hermodynamic Properties of Aliphatic Alcohols. (Supplement to Journal of Physical and Chemical Reference Data; Vol 2; No. 1.); American Chemical Society; Washington;
    hermodynamic Properties of Aliphatic Alcohols. (Supplement to Journal of Physical and Chemical Reference Data; Vol 2; No. 1.); American Chemical Society; Washington;
    hermodynamic Properties of Aliphatic Alcohols. (Supplement to Journal of Physical and Chemical Reference Data; Vol 2; No. 1.); American Chemical Society; Washington;
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    hermodynamic Properties of Aliphatic Alcohols. (Supplement to Journal of Physical and Chemical Reference Data; Vol 2; No. 1.); American Chemical Society; Washington;
    hermodynamic Properties of Aliphatic Alcohols. (Supplement to Journal of Physical and Chemical Reference Data; Vol 2; No. 1.); American Chemical Society; Washington;
    hermodynamic Properties of Aliphatic Alcohols. (Supplement to Journal of Physical and Chemical Reference Data; Vol 2; No. 1.); American Chemical Society; Washington;
    hermodynamic Properties of Aliphatic Alcohols. (Supplement to Journal of Physical and Chemical Reference Data; Vol 2; No. 1.); American Chemical Society; Washington;
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    hermodynamic Properties of Aliphatic Alcohols. (Supplement to Journal of Physical and Chemical Reference Data; Vol 2; No. 1.); American Chemical Society; Washington;
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    hermodynamic Properties of Aliphatic Alcohols. (Supplement to Journal of Physical and Chemical Reference Data; Vol 2; No. 1.); American Chemical Society; Washington;
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    hermodynamic Properties of Aliphatic Alcohols. (Supplement to Journal of Physical and Chemical Reference Data; Vol 2; No. 1.); American Chemical Society; Washington;
    hermodynamic Properties of Aliphatic Alcohols. (Supplement to Journal of Physical and Chemical Reference Data; Vol 2; No. 1.); American Chemical Society; Washington;
    hermodynamic Properties of Aliphatic Alcohols. (Supplement to Journal of Physical and Chemical Reference Data; Vol 2; No. 1.); American Chemical Society; Washington;
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    perties of Chemical Compounds; Vol. I; American Chemical Society; Washington; 1955.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    perties of Chemical Compounds; Vol. I; American Chemical Society; Washington; 1955.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. I; American Chemical Society; Washington; 1955.
    perties of Chemical Compounds; Vol. I; American Chemical Society; Washington; 1955.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. I; American Chemical Society; Washington; 1955.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    perties of Chemical Compounds; Vol. I; American Chemical Society; Washington; 1955.
    perties of Chemical Compounds; Vol. I; American Chemical Society; Washington; 1955.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    hermodynamic Properties of Aliphatic Alcohols. (Supplement to Journal of Physical and Chemical Reference Data; Vol 2; No. 1.); American Chemical Society; Washington;
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    hermodynamic Properties of Aliphatic Alcohols. (Supplement to Journal of Physical and Chemical Reference Data; Vol 2; No. 1.); American Chemical Society; Washington;
    hermodynamic Properties of Aliphatic Alcohols. (Supplement to Journal of Physical and Chemical Reference Data; Vol 2; No. 1.); American Chemical Society; Washington;
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. I; American Chemical Society; Washington; 1955.
    perties of Chemical Compounds; Vol. I; American Chemical Society; Washington; 1955.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. I; American Chemical Society; Washington; 1955.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. I; American Chemical Society; Washington; 1955.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. I; American Chemical Society; Washington; 1955.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    perties of Chemical Compounds; Vol. I; American Chemical Society; Washington; 1955.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. I; American Chemical Society; Washington; 1955.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. I; American Chemical Society; Washington; 1955.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. I; American Chemical Society; Washington; 1955.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    perties of Chemical Compounds; Vol. I; American Chemical Society; Washington; 1955.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    perties of Chemical Compounds; Vol. I; American Chemical Society; Washington; 1955.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    perties of Chemical Compounds; Vol. I; American Chemical Society; Washington; 1955.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    hermodynamic Properties of Aliphatic Alcohols. (Supplement to Journal of Physical and Chemical Reference Data; Vol 2; No. 1.); American Chemical Society; Washington;
    hermodynamic Properties of Aliphatic Alcohols. (Supplement to Journal of Physical and Chemical Reference Data; Vol 2; No. 1.); American Chemical Society; Washington;
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    hermodynamic Properties of Aliphatic Alcohols. (Supplement to Journal of Physical and Chemical Reference Data; Vol 2; No. 1.); American Chemical Society; Washington;
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. I; American Chemical Society; Washington; 1955.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. I; American Chemical Society; Washington; 1955.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. I; American Chemical Society; Washington; 1955.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. I; American Chemical Society; Washington; 1955.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    perties of Chemical Compounds; Vol. I; American Chemical Society; Washington; 1955.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    perties of Chemical Compounds; Vol. I; American Chemical Society; Washington; 1955.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    perties of Chemical Compounds; Vol. I; American Chemical Society; Washington; 1955.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    perties of Chemical Compounds; Vol. I; American Chemical Society; Washington; 1955.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. I; American Chemical Society; Washington; 1955.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    perties of Chemical Compounds; Vol. I; American Chemical Society; Washington; 1955.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    perties of Chemical Compounds; Vol. I; American Chemical Society; Washington; 1955.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. I; American Chemical Society; Washington; 1955.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    clearly out of range JCB
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    perties of Chemical Compounds; Vol. I; American Chemical Society; Washington; 1955.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. I; American Chemical Society; Washington; 1955.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    te. Research Project 44; Selected Values of Properties of Hydrocarbons and Related Compounds. Texas A & M University; College Station; TX; 1973.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    Aldrich Catalog-Handbook of Fine Chemicals; Milwaukee; WI; 1984.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    ndbuch der Organischen Chemie. Springer; Berlin; 1972.
    perties of Chemical Compounds; Vol. III; American Chemical Society; Washington; 1961.
    clearly out of range (7 NIST values) JCB
    aqueous solution JCB
    clearly out of range JCB

    other methyl and dimethylimidazole isomers all above rt so -60C value seems unlikely JCB

    clearly out of range JCB


    unlikely to be higher mp than bromo analog at -40C JCB
    clearly out of range (4 NIST values) JCB

    clearly out of range JCB


    took bp instead of mp JCB
    this is probably misinterpreted as Less Than -72 from CRC JCB
    inverted sign JCB
    clearly out of range JCB

    clearly out of range JCB


    clearly out of range and analog trend JCB
    took bp instead of mp JCB
    sodium salt JCB
    incorrect SMILES - mp for methylamine JCB
    clearly out of range JCB

    too high - possibly salt JCB

    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    only one value here while many cluster around 206C JCB
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    ch F and Mitchell JBO. 2008 Why are some properties more difficult to predict than others? A study of QSPR models of solubility; melting point and LogP. J. Chem. Inf. M
    too high - possibly salt JCB
    inorganic element phosporus JCB
    clearly out of range JCB
    clearly out of range JCB
    clearly out of range JCB
    clearly out of range JCB

    Value clearly out of range EC


    all sources on Google -59C JCB

    All other sources support 140-144 - EC


    wrong isomer JCB
    clearly out of range JCB
    clearly out of range JCB
    Value clearly out of range EC
    clearly out of range JCB
    Value clearly out of range EC
    almost every chemical supplier lists at -42C JCB

    too high - possibly salt JCB


    clearly out of range JCB
    clearly out of range JCB
    out of range and index of refraction reported at 20C JCB
    Other sources support -158 - EC
    same as flash point JCB
    All other sources support 156-162 - EC

    clearly out of range JCB


    only one value here while many cluster around 206C JCB
    no citrate in caffeine
    Value clearly out of range EC
    Value clearly out of range EC
    clearly out of range
    clearly out of range
    repeating value clearly out of range cc

    Vast majority of literature values support 79-82 - EC


    mp listed is that of (2S) or (2R)-1-amino-2-propanol
    took bp instead of mp JCB
    wrong isomer JCB

    clearly out of range JCB


    clearly out of range JCB
    wrong sign - mp cannot be above bp JCB
    clearly out of range JCB
    freezes at -15C after 16 days http://usefulchem.wikispaces.com/Exp266 JCB
    clearly a liquid at rt http://usefulchem.wikispaces.com/Exp266 JCB
    name does not match smiles JCB
    wrong isomer JCB
    wrong isomer JCB
    clearly out of range JCB

    missing stereochem in SMILES JCB


    liquid cannot melt at 200C JCB

    wrong isomer JCB

    wrong isomer JCB


    wrong isomer JCB

    clearly out of range JCB


    metal and salt - AL
    metal salt -AL
    metal salt -AL
    unlikely to be higher mp than bromo analog at -40C JCB
    clearly out of range JCB
    Likely Kelvin temperature.
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    clearly out of range MJM

    emical Society
    aceutical Sciences

    ; Section B: Organic Chemistry Including Medicinal Chemistry

    emical Society

    mistry Letters
    emical Society

    emical Society

    mistry Letters
    id Crystals Science and Technology; Section A: Molecular Crystals and Liquid Crystals

    emical Society

    sis B: Enzymatic

    emical Society
    emical Society
    sis B: Enzymatic
    mistry Letters

    keda K; Kanaya T; Kawaguchi T; Kaji K Journal of Chemical Physics; 105(2); 732-737 (1996)
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    of Chemical Thermodynamics; 10(4); 403-407 (1978)
    n AV; Kabo AG; Kabo GJ Journal of Chemical Thermodynamics; 35(1); 145-157 (2003)
    iley WF Journal of Organic Chemistry; 74(24); 9524-9527 (2009)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    APS PharmSciTech; 7(1); E1-E8 (2006)


    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    cal and Engineering Data; 16(3); 357-359 (1971)

    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    APS PharmSciTech; 7(1); E1-E8 (2006)


    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    APS PharmSciTech; 7(1); E1-E8 (2006)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    APS PharmSciTech; 7(1); E1-E8 (2006)


    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    APS PharmSciTech; 7(1); E1-E8 (2006)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    APS PharmSciTech; 7(1); E1-E8 (2006)
    APS PharmSciTech; 7(1); E1-E8 (2006)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    hemistry Letters

    emical Society
    APS PharmSciTech; 7(1); E1-E8 (2006)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    APS PharmSciTech; 7(1); E1-E8 (2006)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    APS PharmSciTech; 7(1); E1-E8 (2006)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    APS PharmSciTech; 7(1); E1-E8 (2006)
    APS PharmSciTech; 7(1); E1-E8 (2006)
    APS PharmSciTech; 7(1); E1-E8 (2006)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    tional Trade Co

    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    clearly out of range JCB

    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa

    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    clearly out of range JCB

    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    clearly out of range JCB

    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    APS PharmSciTech; 7(1); E1-E8 (2006)

    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    APS PharmSciTech; 7(1); E1-E8 (2006)
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    APS PharmSciTech; 7(1); E1-E8 (2006)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa

    mp same as flash pt
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    APS PharmSciTech; 7(1); E1-E8 (2006)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    APS PharmSciTech; 7(1); E1-E8 (2006)
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    APS PharmSciTech; 7(1); E1-E8 (2006)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    APS PharmSciTech; 7(1); E1-E8 (2006)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa

    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    kes RA Journal of the American Chemical Society; 60(1); 17-22 (1938)

    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    out of range and 1- and 2-pentanol much closer to lower values JCB

    almost every vendor lists at -42 C

    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    APS PharmSciTech; 7(1); E1-E8 (2006)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    emical Society
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa

    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    clearly a liquid at rt http://usefulchem.wikispaces.com/Exp266 JCB


    freezes at -15C after 16 days http://usefulchem.wikispaces.com/Exp266 JCB

    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa

    e reactions with novel ion-supported Tetrahedron 69 (2013) 2961-2970

    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    rnal of the American Chemical Society; 76(5); 1286-1291 (1954)

    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    ede SB; Jadhav AG; Vidyasagar G International Journal of PharmTech Research; 3(2); 841-851; (2011)
    ede SB; Jadhav AG; Vidyasagar G International Journal of PharmTech Research; 3(2); 841-851; (2011)
    ede SB; Jadhav AG; Vidyasagar G International Journal of PharmTech Research; 3(2); 841-851; (2011)
    ede SB; Jadhav AG; Vidyasagar G International Journal of PharmTech Research; 3(2); 841-851; (2011)
    APS PharmSciTech; 7(1); E1-E8 (2006)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    APS PharmSciTech; 7(1); E1-E8 (2006)


    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    h D Journal of Membrane Science; 293(1-2); 29-35 (2007)

    ussian Journal of Applied Chemistry; 82(7); 1178-1187 (2009)

    APS PharmSciTech; 7(1); E1-E8 (2006)


    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa

    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    clearly out of range JCB

    M Journal of the American Chemical Society; 82(17); 4645-4651 (1960).

    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa

    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    APS PharmSciTech; 7(1); E1-E8 (2006)


    APS PharmSciTech; 7(1); E1-E8 (2006)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    value clearly out of range JCB
    APS PharmSciTech; 7(1); E1-E8 (2006)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa

    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    APS PharmSciTech; 7(1); E1-E8 (2006)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    APS PharmSciTech; 7(1); E1-E8 (2006)


    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    hick D Journal of Organic Chemistry; 40(7); 875-879 (1975)

    repeating value clearly out of range cc


    kelvin repeating value clearly out of range

    APS PharmSciTech; 7(1); E1-E8 (2006)


    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    APS PharmSciTech; 7(1); E1-E8 (2006)


    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    APS PharmSciTech; 7(1); E1-E8 (2006)


    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa

    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    APS PharmSciTech; 7(1); E1-E8 (2006)


    APS PharmSciTech; 7(1); E1-E8 (2006)
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    value clearly out of range JCB
    APS PharmSciTech; 7(1); E1-E8 (2006)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa

    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    urnal of Chemical and Engineering Data; 18(2); 115-126 (1973)

    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    APS PharmSciTech; 7(1); E1-E8 (2006)


    APS PharmSciTech; 7(1); E1-E8 (2006)
    APS PharmSciTech; 7(1); E1-E8 (2006)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    ournal of the American Chemical Society; 26(3); 305-306 (1904)


    emical Physics; 9(11); 794-797 (1941)

    too high - probably salt JCB


    too high - probably salt JCB

    emical Society

    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    APS PharmSciTech; 7(1); E1-E8 (2006)
    APS PharmSciTech; 7(1); E1-E8 (2006)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    Journal of Organic Chemistry; 63(12); 4069-4078 (1998)
    APS PharmSciTech; 7(1); E1-E8 (2006)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    APS PharmSciTech; 7(1); E1-E8 (2006)


    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa

    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    umann T Helvetica Chimica Acta; 41(7); 2213-2216 (1958)

    ournal of the American Chemical Society; 74(22); 5732-5736 (1952)

    clearly out of range JCB


    clearly out of range JCB
    clearly out of range JCB

    mith EA Journal of the American Chemical Society; 61(7); 1868-1876 (1939).

    al of Organic Chemistry; 22(12); 1680-1682 (1957)

    es RR; Mosley JR; Moore GE; Renquist ML Journal of the American Chemical Society; 78(1); 56-59 (1956)
    al of the American Chemical Society; 62(1); 8-16 (1940)

    ulletin des Sociétés Chimiques Belges; 60(5-6); 270-281 (1951)

    ournal of the American Chemical Society; 68(6); 1063-1066 (1946)


    rishin YuK; Sergeyev NM; Bolesov IG Organic Magnetic Resonance; 4(1); 53-62 (1972)

    Derfer JM; Boord CE Journal of the American Chemical Society; 75(14); 3344-3347 (1953)

    . J. Chem. Inf. Model. 2009 49 (3) [Lit]

    APS PharmSciTech; 7(1); E1-E8 (2006)


    APS PharmSciTech; 7(1); E1-E8 (2006)

    APS PharmSciTech; 7(1); E1-E8 (2006)


    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    APS PharmSciTech; 7(1); E1-E8 (2006)


    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa

    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    APS PharmSciTech; 7(1); E1-E8 (2006)
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    APS PharmSciTech; 7(1); E1-E8 (2006)
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    ubstances. Volume 12
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    APS PharmSciTech; 7(1); E1-E8 (2006)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    APS PharmSciTech; 7(1); E1-E8 (2006)


    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    APS PharmSciTech; 7(1); E1-E8 (2006)


    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    value out of range of many other sources - EC
    n Journal of Chemistry; 48B(1),146-151 (2009)
    APS PharmSciTech; 7(1); E1-E8 (2006)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    au M; Letourneau J; Freiss B; Fages J. A three step supercritical process to improve the dissolution rate of Eflucimibe. European Journal of Pharmaceutical Sciences. Volum
    husupova GE; Abilov ZA; Erzhanov KB; Chaudri MI Chemistry of Natural Compounds; 40(5); 465-471 (2004)

    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa

    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    clearly out of range JCB
    al of Chemical and Engineering Data 15(1); 154-157 (1970)
    ournal of Chemical Physics; 67(3); 1150-1156 (1977)
    f the American Chemical Society; 59(2); 273-266 (1937)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    APS PharmSciTech; 7(1); E1-E8 (2006)


    APS PharmSciTech; 7(1); E1-E8 (2006)
    e Chemical Society of Japan; 42(2); 582 (1969)
    cal and Engineering Data; 16(3); 357-359 (1971)

    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    APS PharmSciTech; 7(1); E1-E8 (2006)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    APS PharmSciTech; 7(1); E1-E8 (2006)
    APS PharmSciTech; 7(1); E1-E8 (2006)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    APS PharmSciTech; 7(1); E1-E8 (2006)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    APS PharmSciTech; 7(1); E1-E8 (2006)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    APS PharmSciTech; 7(1); E1-E8 (2006)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    APS PharmSciTech; 7(1); E1-E8 (2006)


    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa

    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    Libermann E; Wilhelm E; Ratkovics F; Salamon T Journal of Physical Chemistry; 85(17); 2520-2524 (1981)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    only one value here while many cluster around 206C JCB

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    ournal of Pharmaceutics; 251(1-2); 79-84 (2003)

    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    APS PharmSciTech; 7(1); E1-E8 (2006)


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    ns of the Royal Society of Canada


    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    APS PharmSciTech; 7(1); E1-E8 (2006)


    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    APS PharmSciTech; 7(1); E1-E8 (2006)
    APS PharmSciTech; 7(1); E1-E8 (2006)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    APS PharmSciTech; 7(1); E1-E8 (2006)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    APS PharmSciTech; 7(1); E1-E8 (2006)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    WL; MacFarlane DR; Rogers RD Chemical Communications; 47; 2267-2269 (2010)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa

    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    APS PharmSciTech; 7(1); E1-E8 (2006)


    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

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    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
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    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    APS PharmSciTech; 7(1); E1-E8 (2006)
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
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    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa

    APS PharmSciTech; 7(1); E1-E8 (2006)


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    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

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    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

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    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
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    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa

    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    APS PharmSciTech; 7(1); E1-E8 (2006)
    APS PharmSciTech; 7(1); E1-E8 (2006)

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    APS PharmSciTech; 7(1); E1-E8 (2006)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    APS PharmSciTech; 7(1); E1-E8 (2006)
    APS PharmSciTech; 7(1); E1-E8 (2006)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    APS PharmSciTech; 7(1); E1-E8 (2006)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

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    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

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    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
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    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

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    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
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    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
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    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

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    emistry; 28; 104-114 (2004)

    . J. Chem. Inf. Model. 2009 49 (3) [Lit]


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    D International Journal of Pharmaceutics; 235(1-2); 179-192 (2002)

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    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
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    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
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    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    APS PharmSciTech; 7(1); E1-E8 (2006)
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    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
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    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
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    APS PharmSciTech; 7(1); E1-E8 (2006)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    APS PharmSciTech; 7(1); E1-E8 (2006)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa

    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
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    urnal of Chemical and Engineering Data; 18(2); 115-126 (1973)

    erloni P Journal of Chemical Thermodynamics; 31(4); 537-546 (1999)


    Journal of Chemical Physics; 42(7); 2307-2310 (1965)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    APS PharmSciTech; 7(1); E1-E8 (2006)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    APS PharmSciTech; 7(1); E1-E8 (2006)


    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    APS PharmSciTech; 7(1); E1-E8 (2006)
    APS PharmSciTech; 7(1); E1-E8 (2006)

    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    APS PharmSciTech; 7(1); E1-E8 (2006)


    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    APS PharmSciTech; 7(1); E1-E8 (2006)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa

    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

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    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    APS PharmSciTech; 7(1); E1-E8 (2006)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    APS PharmSciTech; 7(1); E1-E8 (2006)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    APS PharmSciTech; 7(1); E1-E8 (2006)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    cal and Engineering Data; 16(3); 357-359 (1971)

    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    APS PharmSciTech; 7(1); E1-E8 (2006)

    e Chemical Society of Japan; 42(2); 582 (1969)

    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa

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    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    APS PharmSciTech; 7(1); E1-E8 (2006)


    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa

    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    salt and metal

    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    possibly for uncommon polymorph


    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    APS PharmSciTech; 7(1); E1-E8 (2006)


    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    APS PharmSciTech; 7(1); E1-E8 (2006)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa

    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    APS PharmSciTech; 7(1); E1-E8 (2006)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    Journal of the American Chemical Society; 67(10); 1705-1709 (1945)

    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    PS PharmSciTech; 7(1); E1-E8 (2006)
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    PS PharmSciTech; 7(1); E1-E8 (2006)
    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    PS PharmSciTech; 7(1); E1-E8 (2006)


    L and SCHAPER K-J. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 2. Solubility in 1-octa
    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)

    . W.E. The solubility of liquid and solid compounds in dry octan-1-ol. Chemosphere (2013)
    omput. Sci.; (Article); 2003; 43(4); 1177-1186
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    omput. Sci.; (Article); 2003; 43(4); 1177-1454
    omput. Sci.; (Article); 2003; 43(4); 1177-1455
    omput. Sci.; (Article); 2003; 43(4); 1177-1456
    omput. Sci.; (Article); 2003; 43(4); 1177-1457
    omput. Sci.; (Article); 2003; 43(4); 1177-1458
    omput. Sci.; (Article); 2003; 43(4); 1177-1459
    omput. Sci.; (Article); 2003; 43(4); 1177-1460
    omput. Sci.; (Article); 2003; 43(4); 1177-1461

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    45(3); 581-1311
    45(3); 581-1312
    45(3); 581-1313
    45(3); 581-1314
    45(3); 581-1315
    45(3); 581-1316
    45(3); 581-1317
    45(3); 581-1318
    45(3); 581-1319
    45(3); 581-1320
    45(3); 581-1321
    45(3); 581-1322
    45(3); 581-1323
    45(3); 581-1324
    45(3); 581-1325
    45(3); 581-1328
    45(3); 581-1329
    45(3); 581-1330

    45(3); 581-1333

    45(3); 581-1337
    45(3); 581-1338
    45(3); 581-1339
    45(3); 581-1340
    45(3); 581-1341
    45(3); 581-1342
    45(3); 581-1343
    45(3); 581-1344
    45(3); 581-1345
    45(3); 581-1346
    45(3); 581-1347
    45(3); 581-1348
    45(3); 581-1349
    45(3); 581-1350
    45(3); 581-1351
    45(3); 581-1352
    45(3); 581-1353
    45(3); 581-1354
    45(3); 581-1355
    45(3); 581-1356
    45(3); 581-1357
    45(3); 581-1358
    45(3); 581-1359
    45(3); 581-1360
    45(3); 581-1361
    45(3); 581-1362
    45(3); 581-1363
    45(3); 581-1364
    45(3); 581-1365
    45(3); 581-1366
    45(3); 581-1367
    45(3); 581-1368
    45(3); 581-1369
    45(3); 581-1370
    45(3); 581-1371
    45(3); 581-1372
    45(3); 581-1374
    45(3); 581-1375
    45(3); 581-1376
    45(3); 581-1377
    45(3); 581-1378
    45(3); 581-1379
    45(3); 581-1380
    45(3); 581-1381
    45(3); 581-1382
    45(3); 581-1383
    45(3); 581-1384
    45(3); 581-1385
    45(3); 581-1386
    45(3); 581-1387
    45(3); 581-1388
    45(3); 581-1389
    45(3); 581-1390
    45(3); 581-1391
    45(3); 581-1392
    45(3); 581-1393

    45(3); 581-1395
    45(3); 581-1396
    45(3); 581-1397
    45(3); 581-1398
    45(3); 581-1399
    45(3); 581-1400
    45(3); 581-1401
    45(3); 581-1402
    45(3); 581-1403
    45(3); 581-1404
    45(3); 581-1405
    45(3); 581-1406
    45(3); 581-1407
    45(3); 581-1408
    45(3); 581-1409
    45(3); 581-1410
    45(3); 581-1411
    45(3); 581-1412
    45(3); 581-1413
    45(3); 581-1414
    45(3); 581-1415
    45(3); 581-1416
    45(3); 581-1417
    45(3); 581-1418
    45(3); 581-1419
    45(3); 581-1420
    45(3); 581-1421
    45(3); 581-1422
    45(3); 581-1423
    45(3); 581-1424
    45(3); 581-1425
    45(3); 581-1426
    45(3); 581-1427
    45(3); 581-1428

    45(3); 581-1431

    45(3); 581-1433
    45(3); 581-1434
    45(3); 581-1435
    45(3); 581-1436
    45(3); 581-1437
    45(3); 581-1438
    45(3); 581-1439
    45(3); 581-1440
    45(3); 581-1441
    45(3); 581-1442
    45(3); 581-1443
    45(3); 581-1444

    45(3); 581-1446
    45(3); 581-1447
    45(3); 581-1448

    45(3); 581-1450
    45(3); 581-1451
    45(3); 581-1452

    45(3); 581-1454
    45(3); 581-1455
    45(3); 581-1456

    45(3); 581-1458
    45(3); 581-1459
    45(3); 581-1460
    45(3); 581-1461
    45(3); 581-1462
    45(3); 581-1463
    45(3); 581-1464
    45(3); 581-1465
    45(3); 581-1466
    45(3); 581-1467
    45(3); 581-1468
    45(3); 581-1469
    45(3); 581-1470
    45(3); 581-1471

    45(3); 581-1476
    45(3); 581-1477
    45(3); 581-1478
    45(3); 581-1479
    45(3); 581-1480
    45(3); 581-1481
    45(3); 581-1482
    45(3); 581-1483
    45(3); 581-1484
    45(3); 581-1485
    45(3); 581-1486
    45(3); 581-1487
    45(3); 581-1488
    45(3); 581-1489
    45(3); 581-1490
    45(3); 581-1491
    45(3); 581-1492
    45(3); 581-1493
    45(3); 581-1494
    45(3); 581-1495
    45(3); 581-1496
    45(3); 581-1497
    45(3); 581-1498
    45(3); 581-1499
    45(3); 581-1500
    45(3); 581-1501
    45(3); 581-1502
    45(3); 581-1503
    45(3); 581-1504
    45(3); 581-1505
    45(3); 581-1506
    45(3); 581-1507
    45(3); 581-1508
    45(3); 581-1509
    45(3); 581-1510
    45(3); 581-1511
    45(3); 581-1512
    45(3); 581-1513
    45(3); 581-1514
    45(3); 581-1515
    45(3); 581-1516
    45(3); 581-1517
    45(3); 581-1518
    45(3); 581-1519
    45(3); 581-1520
    45(3); 581-1521
    45(3); 581-1522
    45(3); 581-1523
    45(3); 581-1524
    45(3); 581-1525
    45(3); 581-1526
    45(3); 581-1527
    45(3); 581-1528
    45(3); 581-1529
    45(3); 581-1530
    45(3); 581-1531
    45(3); 581-1532
    45(3); 581-1533
    45(3); 581-1534
    45(3); 581-1535
    45(3); 581-1536
    45(3); 581-1537
    45(3); 581-1538
    45(3); 581-1539
    45(3); 581-1540
    45(3); 581-1541
    45(3); 581-1542
    45(3); 581-1543
    45(3); 581-1544
    45(3); 581-1545
    45(3); 581-1546
    45(3); 581-1547
    45(3); 581-1548
    45(3); 581-1549
    45(3); 581-1550
    45(3); 581-1551
    45(3); 581-1552
    45(3); 581-1553
    45(3); 581-1554
    45(3); 581-1555
    45(3); 581-1556
    45(3); 581-1557
    45(3); 581-1558
    45(3); 581-1559
    45(3); 581-1560
    45(3); 581-1561
    45(3); 581-1562
    45(3); 581-1563
    45(3); 581-1564
    45(3); 581-1565
    45(3); 581-1566
    45(3); 581-1567
    45(3); 581-1568
    45(3); 581-1569
    45(3); 581-1570
    45(3); 581-1571
    45(3); 581-1572
    45(3); 581-1573
    45(3); 581-1574
    45(3); 581-1575
    45(3); 581-1576
    45(3); 581-1577
    45(3); 581-1578
    45(3); 581-1579
    45(3); 581-1580
    45(3); 581-1581
    45(3); 581-1582
    45(3); 581-1583
    45(3); 581-1584
    45(3); 581-1585
    45(3); 581-1586
    45(3); 581-1587
    45(3); 581-1588
    45(3); 581-1589
    45(3); 581-1590
    45(3); 581-1591
    45(3); 581-1592
    45(3); 581-1593
    45(3); 581-1594
    45(3); 581-1595
    45(3); 581-1596
    45(3); 581-1597
    45(3); 581-1598
    45(3); 581-1599
    45(3); 581-1600
    45(3); 581-1601
    45(3); 581-1602
    45(3); 581-1603
    45(3); 581-1604
    45(3); 581-1605
    45(3); 581-1606
    45(3); 581-1607
    45(3); 581-1608
    45(3); 581-1609
    45(3); 581-1610
    45(3); 581-1611
    45(3); 581-1612
    45(3); 581-1613
    45(3); 581-1614
    45(3); 581-1615
    45(3); 581-1616
    45(3); 581-1617
    45(3); 581-1618
    45(3); 581-1619
    45(3); 581-1620
    45(3); 581-1621
    45(3); 581-1622
    45(3); 581-1623
    45(3); 581-1624
    45(3); 581-1625
    45(3); 581-1626
    45(3); 581-1627
    45(3); 581-1628
    45(3); 581-1629
    45(3); 581-1630
    45(3); 581-1631
    45(3); 581-1632
    45(3); 581-1633
    45(3); 581-1634
    45(3); 581-1635
    45(3); 581-1636
    45(3); 581-1637
    45(3); 581-1638
    45(3); 581-1639
    45(3); 581-1640
    45(3); 581-1641
    45(3); 581-1642
    45(3); 581-1643
    45(3); 581-1644
    45(3); 581-1645
    45(3); 581-1646
    45(3); 581-1647
    45(3); 581-1648
    45(3); 581-1649
    45(3); 581-1650
    45(3); 581-1651
    45(3); 581-1652
    45(3); 581-1653
    45(3); 581-1654
    45(3); 581-1655
    45(3); 581-1656
    45(3); 581-1657
    45(3); 581-1658
    45(3); 581-1659
    45(3); 581-1660
    45(3); 581-1661
    45(3); 581-1662
    45(3); 581-1663
    45(3); 581-1664
    45(3); 581-1665
    45(3); 581-1666
    45(3); 581-1667
    45(3); 581-1668
    45(3); 581-1669
    45(3); 581-1670
    45(3); 581-1671
    45(3); 581-1672
    45(3); 581-1673
    45(3); 581-1674
    45(3); 581-1675
    45(3); 581-1676
    45(3); 581-1677
    45(3); 581-1678
    45(3); 581-1679
    45(3); 581-1680
    45(3); 581-1681
    45(3); 581-1682
    45(3); 581-1683
    45(3); 581-1684
    45(3); 581-1685
    45(3); 581-1686
    45(3); 581-1687
    45(3); 581-1688
    45(3); 581-1689
    45(3); 581-1690
    45(3); 581-1691
    45(3); 581-1692
    45(3); 581-1693
    45(3); 581-1694
    45(3); 581-1695
    45(3); 581-1696
    45(3); 581-1697
    45(3); 581-1698
    45(3); 581-1699
    45(3); 581-1700
    45(3); 581-1701
    45(3); 581-1702
    45(3); 581-1703
    45(3); 581-1704
    45(3); 581-1705
    45(3); 581-1706
    45(3); 581-1707
    45(3); 581-1708
    45(3); 581-1709
    45(3); 581-1710
    45(3); 581-1711
    45(3); 581-1712
    45(3); 581-1713
    45(3); 581-1714
    45(3); 581-1715
    45(3); 581-1716
    45(3); 581-1717
    45(3); 581-1718
    45(3); 581-1719
    45(3); 581-1720
    45(3); 581-1721
    45(3); 581-1722
    45(3); 581-1723
    45(3); 581-1724
    45(3); 581-1725
    45(3); 581-1726
    45(3); 581-1727
    45(3); 581-1728
    45(3); 581-1729
    45(3); 581-1730
    45(3); 581-1731
    45(3); 581-1732
    45(3); 581-1733
    45(3); 581-1734
    45(3); 581-1735
    45(3); 581-1736
    45(3); 581-1737
    45(3); 581-1738
    45(3); 581-1739
    45(3); 581-1740
    45(3); 581-1741
    45(3); 581-1742
    45(3); 581-1743
    45(3); 581-1744
    45(3); 581-1745
    45(3); 581-1746
    45(3); 581-1747
    45(3); 581-1748
    45(3); 581-1749
    45(3); 581-1750
    45(3); 581-1751
    45(3); 581-1752
    45(3); 581-1753
    45(3); 581-1754
    45(3); 581-1755
    45(3); 581-1756
    45(3); 581-1757
    45(3); 581-1758
    45(3); 581-1759
    45(3); 581-1760
    45(3); 581-1761
    45(3); 581-1762
    45(3); 581-1763
    45(3); 581-1764
    45(3); 581-1765
    45(3); 581-1766
    45(3); 581-1767
    45(3); 581-1768
    45(3); 581-1769
    45(3); 581-1770
    45(3); 581-1771
    45(3); 581-1772
    45(3); 581-1773
    45(3); 581-1774
    45(3); 581-1775
    45(3); 581-1776
    45(3); 581-1777
    45(3); 581-1778
    45(3); 581-1779
    45(3); 581-1780
    45(3); 581-1781
    45(3); 581-1782
    45(3); 581-1783
    45(3); 581-1784
    45(3); 581-1785
    45(3); 581-1786
    45(3); 581-1787
    45(3); 581-1788
    45(3); 581-1789
    45(3); 581-1790
    45(3); 581-1791
    45(3); 581-1792
    45(3); 581-1793
    45(3); 581-1794
    45(3); 581-1795
    45(3); 581-1796
    45(3); 581-1797
    45(3); 581-1798
    45(3); 581-1799
    45(3); 581-1800
    45(3); 581-1801
    45(3); 581-1802
    45(3); 581-1803
    45(3); 581-1804
    45(3); 581-1805
    45(3); 581-1806
    45(3); 581-1807
    45(3); 581-1808
    45(3); 581-1809
    45(3); 581-1810
    45(3); 581-1811
    45(3); 581-1812
    45(3); 581-1813
    45(3); 581-1814
    45(3); 581-1815
    45(3); 581-1816
    45(3); 581-1817
    45(3); 581-1818
    45(3); 581-1819
    45(3); 581-1820
    45(3); 581-1821
    45(3); 581-1822
    45(3); 581-1823
    45(3); 581-1824
    45(3); 581-1825
    45(3); 581-1826
    45(3); 581-1827
    45(3); 581-1828
    45(3); 581-1829
    45(3); 581-1830

    45(3); 581-1832
    45(3); 581-1833
    45(3); 581-1834
    45(3); 581-1835
    45(3); 581-1836
    45(3); 581-1837
    45(3); 581-1838
    45(3); 581-1839
    45(3); 581-1840
    45(3); 581-1841
    45(3); 581-1842
    45(3); 581-1843
    45(3); 581-1844
    45(3); 581-1845
    45(3); 581-1846
    45(3); 581-1847
    45(3); 581-1848
    45(3); 581-1849
    45(3); 581-1850
    45(3); 581-1851
    45(3); 581-1852
    45(3); 581-1853
    45(3); 581-1854
    45(3); 581-1855
    45(3); 581-1856
    45(3); 581-1857
    45(3); 581-1858
    45(3); 581-1859
    45(3); 581-1860
    45(3); 581-1861
    45(3); 581-1862
    45(3); 581-1863
    45(3); 581-1864
    45(3); 581-1865
    45(3); 581-1866
    45(3); 581-1867
    45(3); 581-1868
    45(3); 581-1869
    45(3); 581-1870
    45(3); 581-1871

    45(3); 581-1874

    45(3); 581-1876
    45(3); 581-1877
    45(3); 581-1878
    45(3); 581-1879
    45(3); 581-1880
    45(3); 581-1881
    45(3); 581-1882
    45(3); 581-1883

    45(3); 581-1885
    45(3); 581-1886
    45(3); 581-1887
    45(3); 581-1888
    45(3); 581-1889
    45(3); 581-1890
    45(3); 581-1891
    45(3); 581-1892
    45(3); 581-1893
    45(3); 581-1894
    45(3); 581-1895
    45(3); 581-1896
    45(3); 581-1897
    45(3); 581-1898
    45(3); 581-1899
    45(3); 581-1900
    45(3); 581-1901
    45(3); 581-1902
    45(3); 581-1903

    45(3); 581-1905
    45(3); 581-1906
    45(3); 581-1907
    45(3); 581-1908
    45(3); 581-1909
    45(3); 581-1910
    45(3); 581-1911
    45(3); 581-1912
    45(3); 581-1913
    45(3); 581-1914
    45(3); 581-1915
    45(3); 581-1916
    45(3); 581-1917
    45(3); 581-1918
    45(3); 581-1919
    45(3); 581-1920
    45(3); 581-1921
    45(3); 581-1922
    45(3); 581-1923
    45(3); 581-1924
    45(3); 581-1925
    45(3); 581-1926
    45(3); 581-1927
    45(3); 581-1928
    45(3); 581-1929
    45(3); 581-1930
    45(3); 581-1931
    45(3); 581-1932
    45(3); 581-1933
    45(3); 581-1934
    45(3); 581-1935
    45(3); 581-1936
    45(3); 581-1937
    45(3); 581-1938
    45(3); 581-1939
    45(3); 581-1940
    45(3); 581-1941
    45(3); 581-1942
    45(3); 581-1943
    45(3); 581-1944
    45(3); 581-1945
    45(3); 581-1946
    45(3); 581-1947
    45(3); 581-1948
    45(3); 581-1949
    45(3); 581-1950
    45(3); 581-1951
    45(3); 581-1952
    45(3); 581-1953
    45(3); 581-1954
    45(3); 581-1955
    45(3); 581-1956
    45(3); 581-1957
    45(3); 581-1958
    45(3); 581-1959
    45(3); 581-1960
    45(3); 581-1961
    45(3); 581-1962
    45(3); 581-1963
    45(3); 581-1964
    45(3); 581-1965
    45(3); 581-1966
    45(3); 581-1967
    45(3); 581-1968
    45(3); 581-1969
    45(3); 581-1970
    45(3); 581-1971
    45(3); 581-1972
    45(3); 581-1973
    45(3); 581-1974
    45(3); 581-1975
    45(3); 581-1976
    45(3); 581-1977
    45(3); 581-1978
    45(3); 581-1979
    45(3); 581-1980
    45(3); 581-1981
    45(3); 581-1982
    45(3); 581-1983
    45(3); 581-1984
    45(3); 581-1985
    45(3); 581-1986
    45(3); 581-1987
    45(3); 581-1988
    45(3); 581-1989
    45(3); 581-1990
    45(3); 581-1991
    45(3); 581-1992
    45(3); 581-1993
    45(3); 581-1994
    45(3); 581-1995
    45(3); 581-1996
    45(3); 581-1997
    45(3); 581-1998
    45(3); 581-1999
    45(3); 581-2000
    45(3); 581-2001
    45(3); 581-2002
    45(3); 581-2003
    45(3); 581-2004
    45(3); 581-2005
    45(3); 581-2006
    45(3); 581-2007
    45(3); 581-2008
    45(3); 581-2009
    45(3); 581-2010
    45(3); 581-2011
    45(3); 581-2012
    45(3); 581-2013
    45(3); 581-2014
    45(3); 581-2015
    45(3); 581-2016
    45(3); 581-2017
    45(3); 581-2018
    45(3); 581-2019
    45(3); 581-2020
    45(3); 581-2021
    45(3); 581-2022
    45(3); 581-2023
    45(3); 581-2024
    45(3); 581-2025
    45(3); 581-2026
    45(3); 581-2027
    45(3); 581-2028
    45(3); 581-2029
    45(3); 581-2030
    45(3); 581-2031
    45(3); 581-2032
    45(3); 581-2033
    45(3); 581-2034
    45(3); 581-2035
    45(3); 581-2036
    45(3); 581-2037
    45(3); 581-2038
    45(3); 581-2039
    45(3); 581-2040
    45(3); 581-2041
    45(3); 581-2042
    45(3); 581-2043
    45(3); 581-2044
    45(3); 581-2045
    45(3); 581-2046
    45(3); 581-2047
    45(3); 581-2048
    45(3); 581-2049
    45(3); 581-2050
    45(3); 581-2051
    45(3); 581-2052
    45(3); 581-2053
    45(3); 581-2054
    45(3); 581-2055
    45(3); 581-2056
    45(3); 581-2057
    45(3); 581-2058
    45(3); 581-2059
    45(3); 581-2060
    45(3); 581-2061
    45(3); 581-2062
    45(3); 581-2063
    45(3); 581-2064
    45(3); 581-2065
    45(3); 581-2066
    45(3); 581-2067
    45(3); 581-2068
    45(3); 581-2069
    45(3); 581-2070
    45(3); 581-2071
    45(3); 581-2072
    45(3); 581-2073
    45(3); 581-2074
    45(3); 581-2075
    45(3); 581-2076
    45(3); 581-2077
    45(3); 581-2078
    45(3); 581-2079
    45(3); 581-2080
    45(3); 581-2081
    45(3); 581-2082
    45(3); 581-2083
    45(3); 581-2084
    45(3); 581-2085
    45(3); 581-2086
    45(3); 581-2087
    45(3); 581-2088
    45(3); 581-2089
    45(3); 581-2090
    45(3); 581-2091
    45(3); 581-2092
    45(3); 581-2093
    45(3); 581-2094
    45(3); 581-2095
    45(3); 581-2096
    45(3); 581-2097
    45(3); 581-2098
    45(3); 581-2099
    45(3); 581-2100
    45(3); 581-2101
    45(3); 581-2102
    45(3); 581-2103
    45(3); 581-2104
    45(3); 581-2105
    45(3); 581-2106
    45(3); 581-2107
    45(3); 581-2108
    45(3); 581-2109
    45(3); 581-2110
    45(3); 581-2111
    45(3); 581-2112
    45(3); 581-2113
    45(3); 581-2114
    45(3); 581-2115
    45(3); 581-2116
    45(3); 581-2117
    45(3); 581-2118
    45(3); 581-2119
    45(3); 581-2120
    45(3); 581-2121
    45(3); 581-2122
    45(3); 581-2123
    45(3); 581-2124
    45(3); 581-2125
    45(3); 581-2126
    45(3); 581-2127
    45(3); 581-2128

    45(3); 581-2130
    45(3); 581-2131
    45(3); 581-2132
    45(3); 581-2133
    45(3); 581-2134
    45(3); 581-2135
    45(3); 581-2136
    45(3); 581-2137
    45(3); 581-2138
    45(3); 581-2139
    45(3); 581-2140
    45(3); 581-2141
    45(3); 581-2142
    45(3); 581-2143
    45(3); 581-2144
    45(3); 581-2145
    45(3); 581-2146
    45(3); 581-2147
    45(3); 581-2148
    45(3); 581-2149
    45(3); 581-2150
    45(3); 581-2151
    45(3); 581-2152
    45(3); 581-2153
    45(3); 581-2154
    45(3); 581-2155
    45(3); 581-2156
    45(3); 581-2157
    45(3); 581-2158
    45(3); 581-2159
    45(3); 581-2160
    45(3); 581-2161
    45(3); 581-2162
    45(3); 581-2163
    45(3); 581-2164
    45(3); 581-2165
    45(3); 581-2166
    45(3); 581-2167
    45(3); 581-2168
    45(3); 581-2169
    45(3); 581-2170
    45(3); 581-2171
    45(3); 581-2172
    45(3); 581-2173
    45(3); 581-2174
    45(3); 581-2175
    45(3); 581-2176
    45(3); 581-2177
    45(3); 581-2178
    45(3); 581-2179
    45(3); 581-2180
    45(3); 581-2181
    45(3); 581-2182
    45(3); 581-2183
    45(3); 581-2184
    45(3); 581-2185
    45(3); 581-2186
    45(3); 581-2187
    45(3); 581-2188
    45(3); 581-2189
    45(3); 581-2190
    45(3); 581-2191
    45(3); 581-2192
    45(3); 581-2193
    45(3); 581-2194
    45(3); 581-2195
    45(3); 581-2196
    45(3); 581-2197
    45(3); 581-2198
    45(3); 581-2199
    45(3); 581-2200
    45(3); 581-2201
    45(3); 581-2202
    45(3); 581-2203
    45(3); 581-2204
    45(3); 581-2205
    45(3); 581-2206
    45(3); 581-2207
    45(3); 581-2208
    45(3); 581-2209
    45(3); 581-2210
    45(3); 581-2211
    45(3); 581-2212
    45(3); 581-2213
    45(3); 581-2214
    45(3); 581-2215
    45(3); 581-2216
    45(3); 581-2217
    45(3); 581-2218
    45(3); 581-2219
    45(3); 581-2220
    45(3); 581-2221
    45(3); 581-2222
    45(3); 581-2223
    45(3); 581-2224
    45(3); 581-2225
    45(3); 581-2226
    45(3); 581-2227
    45(3); 581-2228
    45(3); 581-2229
    45(3); 581-2230
    45(3); 581-2231
    45(3); 581-2232
    45(3); 581-2233
    45(3); 581-2234
    45(3); 581-2235
    45(3); 581-2236
    45(3); 581-2237
    45(3); 581-2238
    45(3); 581-2239
    45(3); 581-2240
    45(3); 581-2241
    45(3); 581-2242
    45(3); 581-2243
    45(3); 581-2244
    45(3); 581-2245
    45(3); 581-2246
    45(3); 581-2247
    45(3); 581-2248
    45(3); 581-2249
    45(3); 581-2250
    45(3); 581-2251
    45(3); 581-2252
    45(3); 581-2253
    45(3); 581-2254
    45(3); 581-2255
    45(3); 581-2256
    45(3); 581-2257
    45(3); 581-2258
    45(3); 581-2259
    45(3); 581-2260
    45(3); 581-2261
    45(3); 581-2262
    45(3); 581-2263
    45(3); 581-2264
    45(3); 581-2265
    45(3); 581-2266
    45(3); 581-2267
    45(3); 581-2268
    45(3); 581-2269
    45(3); 581-2270
    45(3); 581-2271
    45(3); 581-2272
    45(3); 581-2273
    45(3); 581-2274
    45(3); 581-2275
    45(3); 581-2276
    45(3); 581-2277
    45(3); 581-2278
    45(3); 581-2279
    45(3); 581-2280
    45(3); 581-2281
    45(3); 581-2282
    45(3); 581-2283
    45(3); 581-2284
    45(3); 581-2285
    45(3); 581-2286
    45(3); 581-2287
    45(3); 581-2288
    45(3); 581-2289
    45(3); 581-2290
    45(3); 581-2291
    45(3); 581-2292
    45(3); 581-2293
    45(3); 581-2294
    45(3); 581-2295
    45(3); 581-2296
    45(3); 581-2297
    45(3); 581-2298
    45(3); 581-2299
    45(3); 581-2300
    45(3); 581-2301
    45(3); 581-2302
    45(3); 581-2303
    45(3); 581-2304
    45(3); 581-2305
    45(3); 581-2306
    45(3); 581-2307
    45(3); 581-2308
    45(3); 581-2309
    45(3); 581-2310
    45(3); 581-2311
    45(3); 581-2312
    45(3); 581-2313
    45(3); 581-2314
    45(3); 581-2315
    45(3); 581-2316
    45(3); 581-2317
    45(3); 581-2318
    45(3); 581-2319
    45(3); 581-2320
    45(3); 581-2321
    45(3); 581-2322
    45(3); 581-2323
    45(3); 581-2324
    45(3); 581-2325
    45(3); 581-2326
    45(3); 581-2327
    45(3); 581-2328
    45(3); 581-2329
    45(3); 581-2330
    45(3); 581-2331
    45(3); 581-2332
    45(3); 581-2333
    45(3); 581-2334
    45(3); 581-2335
    45(3); 581-2336
    45(3); 581-2337
    45(3); 581-2338
    45(3); 581-2339
    45(3); 581-2340
    45(3); 581-2341
    45(3); 581-2342
    45(3); 581-2343
    45(3); 581-2344
    45(3); 581-2345
    45(3); 581-2346
    45(3); 581-2347
    45(3); 581-2348
    45(3); 581-2349

    45(3); 581-2355
    45(3); 581-2356
    45(3); 581-2357
    45(3); 581-2358
    45(3); 581-2359
    45(3); 581-2360
    45(3); 581-2361
    45(3); 581-2362
    45(3); 581-2363
    45(3); 581-2364
    45(3); 581-2365
    45(3); 581-2366
    45(3); 581-2367
    45(3); 581-2368

    45(3); 581-2370
    45(3); 581-2371
    45(3); 581-2372
    45(3); 581-2373
    45(3); 581-2374
    45(3); 581-2375
    45(3); 581-2376
    45(3); 581-2377
    45(3); 581-2378
    45(3); 581-2379
    45(3); 581-2380
    45(3); 581-2381
    45(3); 581-2382
    45(3); 581-2383
    45(3); 581-2384
    45(3); 581-2385
    45(3); 581-2386
    45(3); 581-2387
    45(3); 581-2388
    45(3); 581-2389
    45(3); 581-2390
    45(3); 581-2391
    45(3); 581-2392
    45(3); 581-2393
    45(3); 581-2394
    45(3); 581-2395
    45(3); 581-2396
    45(3); 581-2397
    45(3); 581-2398
    45(3); 581-2399
    45(3); 581-2400
    45(3); 581-2401
    45(3); 581-2402
    45(3); 581-2403
    45(3); 581-2404
    45(3); 581-2405
    45(3); 581-2406
    45(3); 581-2407
    45(3); 581-2408
    45(3); 581-2409
    45(3); 581-2410
    45(3); 581-2411
    45(3); 581-2412
    45(3); 581-2413
    45(3); 581-2414
    45(3); 581-2415
    45(3); 581-2416
    45(3); 581-2417
    45(3); 581-2418
    45(3); 581-2419
    45(3); 581-2420
    45(3); 581-2421
    45(3); 581-2422
    45(3); 581-2423
    45(3); 581-2424
    45(3); 581-2425
    45(3); 581-2426
    45(3); 581-2427
    45(3); 581-2428
    45(3); 581-2429
    45(3); 581-2430
    45(3); 581-2431
    45(3); 581-2432
    45(3); 581-2433
    45(3); 581-2434
    45(3); 581-2435
    45(3); 581-2436
    45(3); 581-2437
    45(3); 581-2438
    45(3); 581-2439
    45(3); 581-2440
    45(3); 581-2441
    45(3); 581-2442
    45(3); 581-2443
    45(3); 581-2444
    45(3); 581-2445
    45(3); 581-2446

    45(3); 581-2448
    45(3); 581-2449
    45(3); 581-2450
    45(3); 581-2451
    45(3); 581-2452
    45(3); 581-2453
    45(3); 581-2454
    45(3); 581-2455
    45(3); 581-2456
    45(3); 581-2457
    45(3); 581-2458
    45(3); 581-2459
    45(3); 581-2460
    45(3); 581-2461
    45(3); 581-2462
    45(3); 581-2463
    45(3); 581-2464
    45(3); 581-2465
    45(3); 581-2466
    45(3); 581-2467
    45(3); 581-2468
    45(3); 581-2469
    45(3); 581-2470
    45(3); 581-2471
    45(3); 581-2472
    45(3); 581-2473
    45(3); 581-2474
    45(3); 581-2475
    45(3); 581-2476
    45(3); 581-2477
    45(3); 581-2478
    45(3); 581-2479
    45(3); 581-2480
    45(3); 581-2481
    45(3); 581-2482
    45(3); 581-2483
    45(3); 581-2484
    45(3); 581-2485
    45(3); 581-2486
    45(3); 581-2487
    45(3); 581-2488
    45(3); 581-2489
    45(3); 581-2490
    45(3); 581-2491
    45(3); 581-2492
    45(3); 581-2493
    45(3); 581-2494
    45(3); 581-2495
    45(3); 581-2496
    45(3); 581-2497
    45(3); 581-2498
    45(3); 581-2499
    45(3); 581-2500
    45(3); 581-2501
    45(3); 581-2502
    45(3); 581-2503
    45(3); 581-2504
    45(3); 581-2505

    45(3); 581-2511
    45(3); 581-2512
    45(3); 581-2513
    45(3); 581-2514
    45(3); 581-2515
    45(3); 581-2516
    45(3); 581-2517
    45(3); 581-2518
    45(3); 581-2519
    45(3); 581-2520
    45(3); 581-2521
    45(3); 581-2522
    45(3); 581-2523
    45(3); 581-2524
    45(3); 581-2525
    45(3); 581-2526
    45(3); 581-2527
    45(3); 581-2528
    45(3); 581-2529
    45(3); 581-2530
    45(3); 581-2531
    45(3); 581-2532
    45(3); 581-2533
    45(3); 581-2534
    45(3); 581-2535
    45(3); 581-2536
    45(3); 581-2537
    45(3); 581-2538
    45(3); 581-2539
    45(3); 581-2540
    45(3); 581-2541
    45(3); 581-2542
    45(3); 581-2543
    45(3); 581-2544
    45(3); 581-2545
    45(3); 581-2546
    45(3); 581-2547
    45(3); 581-2548
    45(3); 581-2549
    45(3); 581-2550
    45(3); 581-2551
    45(3); 581-2552
    45(3); 581-2553
    45(3); 581-2554
    45(3); 581-2555
    45(3); 581-2556
    45(3); 581-2557
    45(3); 581-2558
    45(3); 581-2559
    45(3); 581-2560
    45(3); 581-2561
    45(3); 581-2562
    45(3); 581-2563
    45(3); 581-2564
    45(3); 581-2565
    45(3); 581-2566
    45(3); 581-2567
    45(3); 581-2568
    45(3); 581-2569
    45(3); 581-2570
    45(3); 581-2571
    45(3); 581-2572
    45(3); 581-2573
    45(3); 581-2574
    45(3); 581-2575
    45(3); 581-2576
    45(3); 581-2577
    45(3); 581-2578
    45(3); 581-2579
    45(3); 581-2580
    45(3); 581-2581
    45(3); 581-2582
    45(3); 581-2583
    45(3); 581-2584
    45(3); 581-2585
    45(3); 581-2586
    45(3); 581-2587
    45(3); 581-2588
    45(3); 581-2589
    45(3); 581-2590
    45(3); 581-2591
    45(3); 581-2592
    45(3); 581-2593
    45(3); 581-2594
    45(3); 581-2595
    45(3); 581-2596
    45(3); 581-2597
    45(3); 581-2598
    45(3); 581-2599
    45(3); 581-2600
    45(3); 581-2601
    45(3); 581-2602
    45(3); 581-2603
    45(3); 581-2604
    45(3); 581-2605
    45(3); 581-2606
    45(3); 581-2607
    45(3); 581-2608
    45(3); 581-2609
    45(3); 581-2610
    45(3); 581-2611
    45(3); 581-2612
    45(3); 581-2613
    45(3); 581-2614
    45(3); 581-2615
    45(3); 581-2616
    45(3); 581-2617
    45(3); 581-2618
    45(3); 581-2619
    45(3); 581-2620
    45(3); 581-2621
    45(3); 581-2622
    45(3); 581-2623
    45(3); 581-2624

    45(3); 581-2630
    45(3); 581-2631
    45(3); 581-2632
    45(3); 581-2633
    45(3); 581-2634
    45(3); 581-2635
    45(3); 581-2636
    45(3); 581-2637
    45(3); 581-2638
    45(3); 581-2639
    45(3); 581-2640
    45(3); 581-2641
    45(3); 581-2642
    45(3); 581-2643
    45(3); 581-2644
    45(3); 581-2645
    45(3); 581-2646
    45(3); 581-2647
    45(3); 581-2648
    45(3); 581-2649
    45(3); 581-2650
    45(3); 581-2651
    45(3); 581-2652
    45(3); 581-2653
    45(3); 581-2654
    45(3); 581-2655
    45(3); 581-2656

    45(3); 581-2658
    45(3); 581-2659
    45(3); 581-2660
    45(3); 581-2661
    45(3); 581-2662
    45(3); 581-2663
    45(3); 581-2664
    45(3); 581-2665
    45(3); 581-2666
    45(3); 581-2667
    45(3); 581-2668
    45(3); 581-2669
    45(3); 581-2670
    45(3); 581-2671
    45(3); 581-2672
    45(3); 581-2673
    45(3); 581-2674

    45(3); 581-2676

    45(3); 581-2681
    45(3); 581-2682
    45(3); 581-2683

    45(3); 581-2685
    45(3); 581-2686

    45(3); 581-2695

    45(3); 581-2698
    45(3); 581-2699

    45(3); 581-2702

    45(3); 581-2704
    45(3); 581-2705
    45(3); 581-2706
    45(3); 581-2707
    45(3); 581-2708
    45(3); 581-2709

    45(3); 581-2711

    45(3); 581-2714
    45(3); 581-2715
    45(3); 581-2716
    45(3); 581-2717
    45(3); 581-2718
    45(3); 581-2719
    45(3); 581-2720
    45(3); 581-2721
    45(3); 581-2722
    45(3); 581-2723
    45(3); 581-2724
    45(3); 581-2725
    45(3); 581-2726
    45(3); 581-2727
    45(3); 581-2728
    45(3); 581-2729
    45(3); 581-2730
    45(3); 581-2731
    45(3); 581-2732
    45(3); 581-2733
    45(3); 581-2734
    45(3); 581-2735
    45(3); 581-2736
    45(3); 581-2737
    45(3); 581-2738
    45(3); 581-2739
    45(3); 581-2740
    45(3); 581-2741
    45(3); 581-2742
    45(3); 581-2743
    45(3); 581-2744
    45(3); 581-2745
    45(3); 581-2746
    45(3); 581-2747
    45(3); 581-2748
    45(3); 581-2749
    45(3); 581-2750
    45(3); 581-2751
    45(3); 581-2752
    45(3); 581-2753
    45(3); 581-2754
    45(3); 581-2755
    45(3); 581-2756
    45(3); 581-2757
    45(3); 581-2758
    45(3); 581-2759
    45(3); 581-2760
    45(3); 581-2761
    45(3); 581-2762
    45(3); 581-2763
    45(3); 581-2764
    45(3); 581-2765
    45(3); 581-2766
    45(3); 581-2767
    45(3); 581-2768
    45(3); 581-2769

    45(3); 581-2787
    45(3); 581-2788
    45(3); 581-2789
    45(3); 581-2790
    45(3); 581-2791
    45(3); 581-2792
    45(3); 581-2793
    45(3); 581-2794
    45(3); 581-2795
    45(3); 581-2796
    45(3); 581-2797
    45(3); 581-2798
    45(3); 581-2799
    45(3); 581-2800
    45(3); 581-2801
    45(3); 581-2802
    45(3); 581-2803
    45(3); 581-2804
    45(3); 581-2805
    45(3); 581-2806
    45(3); 581-2807
    45(3); 581-2808
    45(3); 581-2809
    45(3); 581-2810
    45(3); 581-2811
    45(3); 581-2812
    45(3); 581-2818
    45(3); 581-2819
    45(3); 581-2820
    45(3); 581-2821
    45(3); 581-2822
    45(3); 581-2823
    45(3); 581-2824
    45(3); 581-2825
    45(3); 581-2826
    45(3); 581-2827
    45(3); 581-2828
    45(3); 581-2829
    45(3); 581-2830
    45(3); 581-2831
    45(3); 581-2832
    45(3); 581-2833
    45(3); 581-2834
    45(3); 581-2835
    45(3); 581-2836
    45(3); 581-2837
    45(3); 581-2838
    45(3); 581-2839
    45(3); 581-2840
    45(3); 581-2841
    45(3); 581-2842
    45(3); 581-2843
    45(3); 581-2844
    45(3); 581-2845
    45(3); 581-2846
    45(3); 581-2847
    45(3); 581-2848
    45(3); 581-2849
    45(3); 581-2850
    45(3); 581-2851
    45(3); 581-2852
    45(3); 581-2853
    45(3); 581-2854
    45(3); 581-2855
    45(3); 581-2856
    45(3); 581-2857
    45(3); 581-2858
    45(3); 581-2859
    45(3); 581-2860
    45(3); 581-2861
    45(3); 581-2862
    45(3); 581-2863
    45(3); 581-2864
    45(3); 581-2865
    45(3); 581-2866
    45(3); 581-2867
    45(3); 581-2868
    45(3); 581-2869
    45(3); 581-2870
    45(3); 581-2871
    45(3); 581-2872
    45(3); 581-2873
    45(3); 581-2874
    45(3); 581-2875
    45(3); 581-2876
    45(3); 581-2877
    45(3); 581-2878
    45(3); 581-2879
    45(3); 581-2880
    45(3); 581-2881
    45(3); 581-2882
    45(3); 581-2883
    45(3); 581-2884
    45(3); 581-2885
    45(3); 581-2886
    45(3); 581-2887
    45(3); 581-2888
    45(3); 581-2889
    45(3); 581-2890
    45(3); 581-2891
    45(3); 581-2892
    45(3); 581-2893
    45(3); 581-2894
    45(3); 581-2895
    45(3); 581-2896
    45(3); 581-2897
    45(3); 581-2898
    45(3); 581-2899
    45(3); 581-2900
    45(3); 581-2901
    45(3); 581-2902
    45(3); 581-2903
    45(3); 581-2904
    45(3); 581-2905
    45(3); 581-2906
    45(3); 581-2907
    45(3); 581-2908
    45(3); 581-2911
    45(3); 581-2912
    45(3); 581-2913
    45(3); 581-2914
    45(3); 581-2915
    45(3); 581-2916

    45(3); 581-2918
    45(3); 581-2919
    45(3); 581-2920
    45(3); 581-2921
    45(3); 581-2922
    45(3); 581-2923
    45(3); 581-2924
    45(3); 581-2925
    45(3); 581-2926
    45(3); 581-2927
    45(3); 581-2928
    45(3); 581-2929
    45(3); 581-2930
    45(3); 581-2931
    45(3); 581-2932
    45(3); 581-2933
    45(3); 581-2934
    45(3); 581-2935
    45(3); 581-2936
    45(3); 581-2937

    45(3); 581-2939
    45(3); 581-2940

    45(3); 581-2942
    45(3); 581-2943
    45(3); 581-2944
    45(3); 581-2945
    45(3); 581-2946
    45(3); 581-2947
    45(3); 581-2948

    45(3); 581-2951
    45(3); 581-2952
    45(3); 581-2953
    45(3); 581-2954
    45(3); 581-2961
    45(3); 581-2962
    45(3); 581-2963
    45(3); 581-2964
    45(3); 581-2965
    45(3); 581-2966
    45(3); 581-2967
    45(3); 581-2968
    45(3); 581-2969
    45(3); 581-2970
    45(3); 581-2971
    45(3); 581-2972
    45(3); 581-2973
    45(3); 581-2974
    45(3); 581-2975
    45(3); 581-2976
    45(3); 581-2977
    45(3); 581-2978
    45(3); 581-2979
    45(3); 581-2980
    45(3); 581-2981

    45(3); 581-2983
    45(3); 581-2984
    45(3); 581-2985
    45(3); 581-2986
    45(3); 581-2987
    45(3); 581-2988
    45(3); 581-2989
    45(3); 581-2990
    45(3); 581-2991
    45(3); 581-2992

    45(3); 581-2996
    45(3); 581-2997

    45(3); 581-2999

    45(3); 581-3001
    45(3); 581-3002
    45(3); 581-3006
    45(3); 581-3007
    45(3); 581-3008
    45(3); 581-3009
    45(3); 581-3010
    45(3); 581-3011
    45(3); 581-3012
    45(3); 581-3013
    45(3); 581-3014
    45(3); 581-3015
    45(3); 581-3016
    45(3); 581-3017
    45(3); 581-3018
    45(3); 581-3019
    45(3); 581-3020
    45(3); 581-3021
    45(3); 581-3022
    45(3); 581-3023
    45(3); 581-3024
    45(3); 581-3025
    45(3); 581-3026
    45(3); 581-3027
    45(3); 581-3028
    45(3); 581-3029
    45(3); 581-3030
    45(3); 581-3031
    45(3); 581-3032
    45(3); 581-3033
    45(3); 581-3034
    45(3); 581-3035

    45(3); 581-3037
    45(3); 581-3038
    45(3); 581-3039
    45(3); 581-3040
    45(3); 581-3041
    45(3); 581-3042
    45(3); 581-3043

    45(3); 581-3045
    45(3); 581-3046
    45(3); 581-3047
    45(3); 581-3048
    45(3); 581-3049
    45(3); 581-3050
    45(3); 581-3051
    45(3); 581-3052
    45(3); 581-3054
    45(3); 581-3055
    45(3); 581-3056
    45(3); 581-3057
    45(3); 581-3058
    45(3); 581-3059
    45(3); 581-3060
    45(3); 581-3061
    45(3); 581-3062
    45(3); 581-3063
    45(3); 581-3064
    45(3); 581-3065
    45(3); 581-3066
    45(3); 581-3067
    45(3); 581-3068
    45(3); 581-3069
    45(3); 581-3070
    45(3); 581-3071
    45(3); 581-3072
    45(3); 581-3073
    45(3); 581-3074
    45(3); 581-3075
    45(3); 581-3076

    45(3); 581-3078

    45(3); 581-3084
    45(3); 581-3085
    45(3); 581-3086
    45(3); 581-3087
    45(3); 581-3088
    45(3); 581-3089
    45(3); 581-3090
    45(3); 581-3091
    45(3); 581-3092
    45(3); 581-3093
    45(3); 581-3094
    45(3); 581-3095
    45(3); 581-3096
    45(3); 581-3097
    45(3); 581-3098
    45(3); 581-3099

    45(3); 581-3101
    45(3); 581-3102
    45(3); 581-3103
    45(3); 581-3104
    45(3); 581-3105
    45(3); 581-3106
    45(3); 581-3107
    45(3); 581-3108
    45(3); 581-3109
    45(3); 581-3110
    45(3); 581-3111
    45(3); 581-3112
    45(3); 581-3113
    45(3); 581-3114
    45(3); 581-3115

    45(3); 581-3117
    45(3); 581-3118
    45(3); 581-3119
    45(3); 581-3120
    45(3); 581-3121
    45(3); 581-3122
    45(3); 581-3123

    45(3); 581-3125
    45(3); 581-3126
    45(3); 581-3127
    45(3); 581-3128
    45(3); 581-3129
    45(3); 581-3130
    45(3); 581-3131
    45(3); 581-3132
    45(3); 581-3133
    45(3); 581-3134
    45(3); 581-3135
    45(3); 581-3136
    45(3); 581-3137
    45(3); 581-3138
    45(3); 581-3139
    45(3); 581-3140
    45(3); 581-3141
    45(3); 581-3142
    45(3); 581-3143
    45(3); 581-3144
    45(3); 581-3145
    45(3); 581-3146
    45(3); 581-3147
    45(3); 581-3148
    45(3); 581-3150

    45(3); 581-3152
    45(3); 581-3153
    45(3); 581-3154
    45(3); 581-3155
    45(3); 581-3156
    45(3); 581-3157
    45(3); 581-3158
    45(3); 581-3159
    45(3); 581-3160
    45(3); 581-3161
    45(3); 581-3162
    45(3); 581-3163
    45(3); 581-3164
    45(3); 581-3165
    45(3); 581-3166
    45(3); 581-3167
    45(3); 581-3168
    45(3); 581-3169
    45(3); 581-3170
    45(3); 581-3171
    45(3); 581-3172
    45(3); 581-3173
    45(3); 581-3174
    45(3); 581-3175
    45(3); 581-3176
    45(3); 581-3177
    45(3); 581-3178
    45(3); 581-3179
    45(3); 581-3180
    45(3); 581-3181
    45(3); 581-3182
    45(3); 581-3183
    45(3); 581-3184
    45(3); 581-3185
    45(3); 581-3186
    45(3); 581-3187
    45(3); 581-3188
    45(3); 581-3189
    45(3); 581-3190
    45(3); 581-3191
    45(3); 581-3192
    45(3); 581-3193
    45(3); 581-3194
    45(3); 581-3195
    45(3); 581-3196
    45(3); 581-3197
    45(3); 581-3198
    45(3); 581-3199
    45(3); 581-3200
    45(3); 581-3201
    45(3); 581-3202

    45(3); 581-3205

    45(3); 581-3209
    45(3); 581-3210

    45(3); 581-3212

    45(3); 581-3214

    45(3); 581-3217
    45(3); 581-3218
    45(3); 581-3219
    45(3); 581-3220
    45(3); 581-3221
    45(3); 581-3222
    45(3); 581-3223
    45(3); 581-3224
    45(3); 581-3225
    45(3); 581-3226
    45(3); 581-3227
    45(3); 581-3228
    45(3); 581-3229
    45(3); 581-3230

    45(3); 581-3233
    45(3); 581-3234
    45(3); 581-3235
    45(3); 581-3236
    45(3); 581-3237

    45(3); 581-3239
    45(3); 581-3240
    45(3); 581-3241
    45(3); 581-3242
    45(3); 581-3243
    45(3); 581-3244
    45(3); 581-3245
    45(3); 581-3246
    45(3); 581-3247
    45(3); 581-3248
    45(3); 581-3249
    45(3); 581-3250
    45(3); 581-3251
    45(3); 581-3252
    45(3); 581-3253
    45(3); 581-3254
    45(3); 581-3255
    45(3); 581-3256

    45(3); 581-3258
    45(3); 581-3259
    45(3); 581-3260
    45(3); 581-3261
    45(3); 581-3262
    45(3); 581-3263
    45(3); 581-3264

    45(3); 581-3266
    45(3); 581-3267
    45(3); 581-3268
    45(3); 581-3269
    45(3); 581-3270
    45(3); 581-3271
    45(3); 581-3272
    45(3); 581-3273
    45(3); 581-3274
    45(3); 581-3275
    45(3); 581-3276
    45(3); 581-3277
    45(3); 581-3278
    45(3); 581-3279
    45(3); 581-3280
    45(3); 581-3281
    45(3); 581-3282
    45(3); 581-3283
    45(3); 581-3284
    45(3); 581-3285
    45(3); 581-3286
    45(3); 581-3287
    45(3); 581-3288
    45(3); 581-3289
    45(3); 581-3290
    45(3); 581-3291
    45(3); 581-3292
    45(3); 581-3293
    45(3); 581-3294
    45(3); 581-3295
    45(3); 581-3296
    45(3); 581-3297
    45(3); 581-3298
    45(3); 581-3299
    45(3); 581-3300
    45(3); 581-3301
    45(3); 581-3302
    45(3); 581-3303
    45(3); 581-3304
    45(3); 581-3305
    45(3); 581-3306
    45(3); 581-3307
    45(3); 581-3308
    45(3); 581-3309

    45(3); 581-3311
    45(3); 581-3312
    45(3); 581-3313
    45(3); 581-3314
    45(3); 581-3315

    45(3); 581-3317
    45(3); 581-3318
    45(3); 581-3319

    45(3); 581-3321
    45(3); 581-3322
    45(3); 581-3323
    45(3); 581-3324
    45(3); 581-3325
    45(3); 581-3326
    45(3); 581-3327
    45(3); 581-3328

    45(3); 581-3330
    45(3); 581-3331
    45(3); 581-3332
    45(3); 581-3333
    45(3); 581-3334
    45(3); 581-3335
    45(3); 581-3336
    45(3); 581-3337
    45(3); 581-3338
    45(3); 581-3339
    45(3); 581-3340
    45(3); 581-3341
    45(3); 581-3342
    45(3); 581-3343
    45(3); 581-3344
    45(3); 581-3345
    45(3); 581-3346
    45(3); 581-3347
    45(3); 581-3348
    45(3); 581-3349
    45(3); 581-3350
    45(3); 581-3351
    45(3); 581-3352
    45(3); 581-3353
    45(3); 581-3354
    45(3); 581-3355
    45(3); 581-3356
    45(3); 581-3357
    45(3); 581-3358
    45(3); 581-3359
    45(3); 581-3360
    45(3); 581-3361
    45(3); 581-3362
    45(3); 581-3363
    45(3); 581-3364
    45(3); 581-3365
    45(3); 581-3366
    45(3); 581-3367
    45(3); 581-3368
    45(3); 581-3369
    45(3); 581-3370
    45(3); 581-3371
    45(3); 581-3372
    45(3); 581-3373
    45(3); 581-3374
    45(3); 581-3375
    45(3); 581-3376
    45(3); 581-3377
    45(3); 581-3378
    45(3); 581-3379
    45(3); 581-3380
    45(3); 581-3381
    45(3); 581-3382
    45(3); 581-3383
    45(3); 581-3384
    45(3); 581-3385
    45(3); 581-3386
    45(3); 581-3387
    45(3); 581-3388
    45(3); 581-3389
    45(3); 581-3390
    45(3); 581-3391
    45(3); 581-3392
    45(3); 581-3393
    45(3); 581-3394
    45(3); 581-3395
    45(3); 581-3396
    45(3); 581-3397
    45(3); 581-3398
    45(3); 581-3399
    45(3); 581-3400
    45(3); 581-3401
    45(3); 581-3402
    45(3); 581-3403
    45(3); 581-3404
    45(3); 581-3405
    45(3); 581-3406
    45(3); 581-3407
    45(3); 581-3408
    45(3); 581-3409
    45(3); 581-3410
    45(3); 581-3411
    45(3); 581-3412
    45(3); 581-3413
    45(3); 581-3414
    45(3); 581-3415
    45(3); 581-3416
    45(3); 581-3417
    45(3); 581-3418
    45(3); 581-3419
    45(3); 581-3420
    45(3); 581-3421
    45(3); 581-3422
    45(3); 581-3423
    45(3); 581-3424
    45(3); 581-3425
    45(3); 581-3426
    45(3); 581-3427
    45(3); 581-3428
    45(3); 581-3429
    45(3); 581-3430
    45(3); 581-3431
    45(3); 581-3432
    45(3); 581-3433
    45(3); 581-3434
    45(3); 581-3435
    45(3); 581-3436
    45(3); 581-3437
    45(3); 581-3438
    45(3); 581-3439
    45(3); 581-3440
    45(3); 581-3441
    45(3); 581-3442
    45(3); 581-3443
    45(3); 581-3444
    45(3); 581-3445
    45(3); 581-3446
    45(3); 581-3447
    45(3); 581-3448
    45(3); 581-3449
    45(3); 581-3450
    45(3); 581-3451
    45(3); 581-3452
    45(3); 581-3453
    45(3); 581-3454
    45(3); 581-3455
    45(3); 581-3456
    45(3); 581-3457
    45(3); 581-3458
    45(3); 581-3459
    45(3); 581-3460
    45(3); 581-3461
    45(3); 581-3462
    45(3); 581-3463
    45(3); 581-3464
    45(3); 581-3465
    45(3); 581-3466
    45(3); 581-3467
    45(3); 581-3468
    45(3); 581-3469
    45(3); 581-3470
    45(3); 581-3471
    45(3); 581-3472
    45(3); 581-3473
    45(3); 581-3474
    45(3); 581-3475
    45(3); 581-3476
    45(3); 581-3477
    45(3); 581-3478
    45(3); 581-3479
    45(3); 581-3480
    45(3); 581-3481
    45(3); 581-3482
    45(3); 581-3483
    45(3); 581-3484
    45(3); 581-3485
    45(3); 581-3486
    45(3); 581-3487
    45(3); 581-3488
    45(3); 581-3489
    45(3); 581-3490
    45(3); 581-3491
    45(3); 581-3492
    45(3); 581-3493
    45(3); 581-3494
    45(3); 581-3495
    45(3); 581-3496
    45(3); 581-3497
    45(3); 581-3498
    45(3); 581-3499
    45(3); 581-3500
    45(3); 581-3501
    45(3); 581-3502
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    45(3); 581-3507
    45(3); 581-3508
    45(3); 581-3509
    45(3); 581-3510
    45(3); 581-3511
    45(3); 581-3512
    45(3); 581-3513
    45(3); 581-3514
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    45(3); 581-3518
    45(3); 581-3519
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    45(3); 581-3521
    45(3); 581-3522
    45(3); 581-3523
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    45(3); 581-3528
    45(3); 581-3529
    45(3); 581-3530
    45(3); 581-3531
    45(3); 581-3532
    45(3); 581-3533
    45(3); 581-3534
    45(3); 581-3535
    45(3); 581-3536
    45(3); 581-3537
    45(3); 581-3538
    45(3); 581-3539
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    45(3); 581-3563
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    45(3); 581-3568
    45(3); 581-3569
    45(3); 581-3570
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    45(3); 581-3596
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    45(3); 581-3600
    45(3); 581-3601
    45(3); 581-3602
    45(3); 581-3603
    45(3); 581-3604
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    45(3); 581-3606
    45(3); 581-3607
    45(3); 581-3608
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    45(3); 581-3610
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    45(3); 581-3612
    45(3); 581-3613
    45(3); 581-3614
    45(3); 581-3615

    45(3); 581-3617
    45(3); 581-3618
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    45(3); 581-3660
    45(3); 581-3661
    45(3); 581-3662
    45(3); 581-3663
    45(3); 581-3664
    45(3); 581-3665
    45(3); 581-3666
    45(3); 581-3667
    45(3); 581-3668
    45(3); 581-3669
    45(3); 581-3670
    45(3); 581-3671
    45(3); 581-3672
    45(3); 581-3673
    45(3); 581-3674
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    45(3); 581-3676
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    45(3); 581-3679
    45(3); 581-3680
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    45(3); 581-3689
    45(3); 581-3690
    45(3); 581-3691
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    45(3); 581-3693
    45(3); 581-3694
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    45(3); 581-3696
    45(3); 581-3697
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    45(3); 581-3700
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    45(3); 581-3702
    45(3); 581-3703
    45(3); 581-3704
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    45(3); 581-3706
    45(3); 581-3707
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    45(3); 581-3709
    45(3); 581-3710
    45(3); 581-3711
    45(3); 581-3712
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    45(3); 581-3714
    45(3); 581-3715
    45(3); 581-3716
    45(3); 581-3717
    45(3); 581-3718
    45(3); 581-3719
    45(3); 581-3720
    45(3); 581-3721
    45(3); 581-3722
    45(3); 581-3723
    45(3); 581-3724
    45(3); 581-3725
    45(3); 581-3726
    45(3); 581-3727
    45(3); 581-3728
    45(3); 581-3729
    45(3); 581-3730
    45(3); 581-3731
    45(3); 581-3732
    45(3); 581-3733
    45(3); 581-3734
    45(3); 581-3735
    45(3); 581-3736
    45(3); 581-3737
    45(3); 581-3738
    45(3); 581-3739
    45(3); 581-3740
    45(3); 581-3741

    45(3); 581-3743
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    45(3); 581-3745
    45(3); 581-3746
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    45(3); 581-3808
    45(3); 581-3809
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    45(3); 581-3829
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    45(3); 581-3860
    45(3); 581-3861
    45(3); 581-3862
    45(3); 581-3863
    45(3); 581-3864
    45(3); 581-3865
    45(3); 581-3866
    45(3); 581-3867
    45(3); 581-3868
    45(3); 581-3869
    45(3); 581-3870
    45(3); 581-3871
    45(3); 581-3872
    45(3); 581-3873
    45(3); 581-3874
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    45(3); 581-3882
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    45(3); 581-3889
    45(3); 581-3890
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    45(3); 581-3912
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    45(3); 581-3918
    45(3); 581-3919
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    45(3); 581-3923
    45(3); 581-3924
    45(3); 581-3925
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    45(3); 581-3927
    45(3); 581-3928
    45(3); 581-3929
    45(3); 581-3930
    45(3); 581-3931
    45(3); 581-3932
    45(3); 581-3933
    45(3); 581-3934
    45(3); 581-3935
    45(3); 581-3936
    45(3); 581-3937
    45(3); 581-3938
    45(3); 581-3939
    45(3); 581-3940
    45(3); 581-3941
    45(3); 581-3942
    45(3); 581-3943
    45(3); 581-3944
    45(3); 581-3945
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    45(3); 581-3947
    45(3); 581-3948
    45(3); 581-3949
    45(3); 581-3950
    45(3); 581-3951
    45(3); 581-3952
    45(3); 581-3953
    45(3); 581-3954
    45(3); 581-3955
    45(3); 581-3956
    45(3); 581-3957
    45(3); 581-3958
    45(3); 581-3959
    45(3); 581-3960
    45(3); 581-3961
    45(3); 581-3962
    45(3); 581-3963
    45(3); 581-3964
    45(3); 581-3965
    45(3); 581-3966
    45(3); 581-3967
    45(3); 581-3968
    45(3); 581-3969
    45(3); 581-3970
    45(3); 581-3971
    45(3); 581-3972
    45(3); 581-3973
    45(3); 581-3974
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    45(3); 581-3982
    45(3); 581-3983
    45(3); 581-3984
    45(3); 581-3985
    45(3); 581-3986
    45(3); 581-3987
    45(3); 581-3988
    45(3); 581-3989
    45(3); 581-3990
    45(3); 581-3991
    45(3); 581-3992
    45(3); 581-3993
    45(3); 581-3994
    45(3); 581-3995
    45(3); 581-3996
    45(3); 581-3997
    45(3); 581-3998
    45(3); 581-3999
    45(3); 581-4000
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    45(3); 581-4002
    45(3); 581-4003
    45(3); 581-4004
    45(3); 581-4005
    45(3); 581-4006
    45(3); 581-4007
    45(3); 581-4008
    45(3); 581-4009
    45(3); 581-4010
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    45(3); 581-4012
    45(3); 581-4013
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    45(3); 581-4016
    45(3); 581-4017
    45(3); 581-4018
    45(3); 581-4019
    45(3); 581-4020
    45(3); 581-4021
    45(3); 581-4022
    45(3); 581-4023
    45(3); 581-4024
    45(3); 581-4025
    45(3); 581-4026
    45(3); 581-4027
    45(3); 581-4028
    45(3); 581-4029
    45(3); 581-4030
    45(3); 581-4031
    45(3); 581-4032
    45(3); 581-4033
    45(3); 581-4034
    45(3); 581-4035
    45(3); 581-4036
    45(3); 581-4037
    45(3); 581-4038
    45(3); 581-4039
    45(3); 581-4040
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    45(3); 581-4043
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    45(3); 581-4045
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    45(3); 581-4047
    45(3); 581-4048
    45(3); 581-4049
    45(3); 581-4050
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    45(3); 581-4052
    45(3); 581-4053
    45(3); 581-4054
    45(3); 581-4055
    45(3); 581-4056
    45(3); 581-4057
    45(3); 581-4058
    45(3); 581-4059
    45(3); 581-4060
    45(3); 581-4061
    45(3); 581-4062
    45(3); 581-4063
    45(3); 581-4064
    45(3); 581-4065
    45(3); 581-4066
    45(3); 581-4067
    45(3); 581-4068
    45(3); 581-4069
    45(3); 581-4070
    45(3); 581-4071
    45(3); 581-4072
    45(3); 581-4073
    45(3); 581-4074
    45(3); 581-4075
    45(3); 581-4076
    45(3); 581-4077
    45(3); 581-4078
    45(3); 581-4079
    45(3); 581-4080
    45(3); 581-4081
    45(3); 581-4082
    45(3); 581-4083
    45(3); 581-4084
    45(3); 581-4085
    45(3); 581-4086
    45(3); 581-4087
    45(3); 581-4088
    45(3); 581-4089
    45(3); 581-4090
    45(3); 581-4091
    45(3); 581-4092
    45(3); 581-4093
    45(3); 581-4094
    45(3); 581-4095
    45(3); 581-4096
    45(3); 581-4097
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    45(3); 581-4117
    45(3); 581-4118
    45(3); 581-4119
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    45(3); 581-4123
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    45(3); 581-4127
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    45(3); 581-4132
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    45(3); 581-4136
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    45(3); 581-4148
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    45(3); 581-4157
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    45(3); 581-4162
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    45(3); 581-4181
    45(3); 581-4182
    45(3); 581-4183
    45(3); 581-4184
    45(3); 581-4185
    45(3); 581-4186
    45(3); 581-4187
    45(3); 581-4188
    45(3); 581-4189
    45(3); 581-4190
    45(3); 581-4191
    45(3); 581-4192
    45(3); 581-4193
    45(3); 581-4194
    45(3); 581-4195
    45(3); 581-4196
    45(3); 581-4197
    45(3); 581-4198
    45(3); 581-4199
    45(3); 581-4200
    45(3); 581-4201
    45(3); 581-4202
    45(3); 581-4203
    45(3); 581-4204
    45(3); 581-4205
    45(3); 581-4206
    45(3); 581-4207
    45(3); 581-4208
    45(3); 581-4209
    45(3); 581-4210
    45(3); 581-4211

    45(3); 581-4213
    45(3); 581-4214
    45(3); 581-4215
    45(3); 581-4216
    45(3); 581-4217
    45(3); 581-4218
    45(3); 581-4219
    45(3); 581-4220
    45(3); 581-4221
    45(3); 581-4222
    45(3); 581-4223
    45(3); 581-4224
    45(3); 581-4225
    45(3); 581-4226
    45(3); 581-4227
    45(3); 581-4228
    45(3); 581-4229
    45(3); 581-4230
    45(3); 581-4231
    45(3); 581-4232
    45(3); 581-4233
    45(3); 581-4234
    45(3); 581-4235
    45(3); 581-4236
    45(3); 581-4237
    45(3); 581-4238
    45(3); 581-4239

    45(3); 581-4241
    45(3); 581-4242
    45(3); 581-4243
    45(3); 581-4244
    45(3); 581-4245
    45(3); 581-4246

    45(3); 581-4248
    45(3); 581-4249
    45(3); 581-4250
    45(3); 581-4251
    45(3); 581-4252
    45(3); 581-4253
    45(3); 581-4254
    45(3); 581-4255
    45(3); 581-4256
    45(3); 581-4257
    45(3); 581-4258
    45(3); 581-4259
    45(3); 581-4260
    45(3); 581-4261
    45(3); 581-4262
    45(3); 581-4263
    45(3); 581-4264
    45(3); 581-4265
    45(3); 581-4266
    45(3); 581-4267
    45(3); 581-4268
    45(3); 581-4269
    45(3); 581-4270
    45(3); 581-4271
    45(3); 581-4272
    45(3); 581-4273
    45(3); 581-4274
    45(3); 581-4275
    45(3); 581-4276
    45(3); 581-4277
    45(3); 581-4278
    45(3); 581-4279
    45(3); 581-4280
    45(3); 581-4281
    45(3); 581-4282
    45(3); 581-4283
    45(3); 581-4284
    45(3); 581-4285
    45(3); 581-4286
    45(3); 581-4287
    45(3); 581-4288
    45(3); 581-4289
    45(3); 581-4290
    45(3); 581-4291
    45(3); 581-4292
    45(3); 581-4293
    45(3); 581-4294
    45(3); 581-4295
    45(3); 581-4296
    45(3); 581-4297
    45(3); 581-4298
    45(3); 581-4299
    45(3); 581-4300
    45(3); 581-4301
    45(3); 581-4302
    45(3); 581-4303
    45(3); 581-4304
    45(3); 581-4305
    45(3); 581-4306
    45(3); 581-4307
    45(3); 581-4308
    45(3); 581-4309
    45(3); 581-4310
    45(3); 581-4311
    45(3); 581-4312
    45(3); 581-4313
    45(3); 581-4314
    45(3); 581-4315
    45(3); 581-4316
    45(3); 581-4317
    45(3); 581-4318

    45(3); 581-4320
    45(3); 581-4321
    45(3); 581-4322
    45(3); 581-4323
    45(3); 581-4324
    45(3); 581-4325
    45(3); 581-4326
    45(3); 581-4327
    45(3); 581-4328
    45(3); 581-4329
    45(3); 581-4330
    45(3); 581-4331
    45(3); 581-4332
    45(3); 581-4333
    45(3); 581-4334
    45(3); 581-4335
    45(3); 581-4336
    45(3); 581-4337
    45(3); 581-4338
    45(3); 581-4339
    45(3); 581-4340
    45(3); 581-4341
    45(3); 581-4342
    45(3); 581-4343
    45(3); 581-4344
    45(3); 581-4345
    45(3); 581-4346
    45(3); 581-4347
    45(3); 581-4348
    45(3); 581-4349
    45(3); 581-4350
    45(3); 581-4351
    45(3); 581-4352
    45(3); 581-4353
    45(3); 581-4354
    45(3); 581-4355
    45(3); 581-4356
    45(3); 581-4357
    45(3); 581-4358
    45(3); 581-4359
    45(3); 581-4360
    45(3); 581-4361
    45(3); 581-4362
    45(3); 581-4363
    45(3); 581-4364
    45(3); 581-4365
    45(3); 581-4366
    45(3); 581-4367
    45(3); 581-4368
    45(3); 581-4369
    45(3); 581-4370
    45(3); 581-4371
    45(3); 581-4372
    45(3); 581-4373
    45(3); 581-4374
    45(3); 581-4375
    45(3); 581-4376
    45(3); 581-4377
    45(3); 581-4378
    45(3); 581-4379
    45(3); 581-4380
    45(3); 581-4381
    45(3); 581-4382
    45(3); 581-4383
    45(3); 581-4384
    45(3); 581-4385
    45(3); 581-4386
    45(3); 581-4387
    45(3); 581-4388
    45(3); 581-4389
    45(3); 581-4390
    45(3); 581-4391
    45(3); 581-4392
    45(3); 581-4393
    45(3); 581-4394
    45(3); 581-4395
    45(3); 581-4396
    45(3); 581-4397
    45(3); 581-4398
    45(3); 581-4399
    45(3); 581-4400
    45(3); 581-4401
    45(3); 581-4402
    45(3); 581-4403
    45(3); 581-4404
    45(3); 581-4405
    45(3); 581-4406
    45(3); 581-4407
    45(3); 581-4408
    45(3); 581-4409
    45(3); 581-4410
    45(3); 581-4411
    45(3); 581-4412
    45(3); 581-4413
    45(3); 581-4414
    45(3); 581-4415
    45(3); 581-4416
    45(3); 581-4417
    45(3); 581-4418
    45(3); 581-4419
    45(3); 581-4420
    45(3); 581-4421
    45(3); 581-4422
    45(3); 581-4423
    45(3); 581-4424
    45(3); 581-4425
    45(3); 581-4426
    45(3); 581-4427
    45(3); 581-4428
    45(3); 581-4429
    45(3); 581-4430
    45(3); 581-4431
    45(3); 581-4432
    45(3); 581-4433
    45(3); 581-4434
    45(3); 581-4435
    45(3); 581-4436
    45(3); 581-4437
    45(3); 581-4438
    45(3); 581-4439
    45(3); 581-4440
    45(3); 581-4441
    45(3); 581-4442
    45(3); 581-4443
    45(3); 581-4444
    45(3); 581-4445
    45(3); 581-4446
    45(3); 581-4447
    45(3); 581-4448
    45(3); 581-4449
    45(3); 581-4450
    45(3); 581-4451
    45(3); 581-4452
    45(3); 581-4453
    45(3); 581-4454
    45(3); 581-4455
    45(3); 581-4456
    45(3); 581-4457
    45(3); 581-4458
    45(3); 581-4459
    45(3); 581-4460

    45(3); 581-4462
    45(3); 581-4463
    45(3); 581-4464
    45(3); 581-4465

    45(3); 581-4467
    45(3); 581-4468
    45(3); 581-4469
    45(3); 581-4470
    45(3); 581-4471
    45(3); 581-4472
    45(3); 581-4473
    45(3); 581-4474
    45(3); 581-4475
    45(3); 581-4476
    45(3); 581-4477
    45(3); 581-4478
    45(3); 581-4479
    45(3); 581-4480
    45(3); 581-4481
    45(3); 581-4482
    45(3); 581-4483
    45(3); 581-4484
    45(3); 581-4485
    45(3); 581-4486
    45(3); 581-4487
    45(3); 581-4488
    45(3); 581-4489
    45(3); 581-4490
    45(3); 581-4491
    45(3); 581-4492
    45(3); 581-4493
    45(3); 581-4494
    45(3); 581-4495
    45(3); 581-4496

    45(3); 581-4498
    45(3); 581-4499
    45(3); 581-4500
    45(3); 581-4501
    45(3); 581-4502
    45(3); 581-4503
    45(3); 581-4504
    45(3); 581-4505
    45(3); 581-4506
    45(3); 581-4507
    45(3); 581-4508
    45(3); 581-4509
    45(3); 581-4510
    45(3); 581-4511
    45(3); 581-4512
    45(3); 581-4513
    45(3); 581-4514
    45(3); 581-4515
    45(3); 581-4516
    45(3); 581-4517
    45(3); 581-4518
    45(3); 581-4519
    45(3); 581-4520
    45(3); 581-4521
    45(3); 581-4522
    45(3); 581-4523
    45(3); 581-4524
    45(3); 581-4525
    45(3); 581-4526
    45(3); 581-4527
    45(3); 581-4528
    45(3); 581-4529
    45(3); 581-4530
    45(3); 581-4531
    45(3); 581-4532
    45(3); 581-4533
    45(3); 581-4534
    45(3); 581-4535
    45(3); 581-4536
    45(3); 581-4537
    45(3); 581-4538
    45(3); 581-4539
    45(3); 581-4540
    45(3); 581-4541
    45(3); 581-4543
    45(3); 581-4544
    45(3); 581-4545
    45(3); 581-4546

    45(3); 581-4548
    45(3); 581-4549
    45(3); 581-4550
    45(3); 581-4551
    45(3); 581-4552
    45(3); 581-4553
    45(3); 581-4554
    45(3); 581-4555
    45(3); 581-4556
    45(3); 581-4557
    45(3); 581-4558
    45(3); 581-4559
    45(3); 581-4560
    45(3); 581-4561
    45(3); 581-4562
    45(3); 581-4563
    45(3); 581-4564
    45(3); 581-4565
    45(3); 581-4566
    45(3); 581-4567
    45(3); 581-4568
    45(3); 581-4569
    45(3); 581-4570
    45(3); 581-4571

    45(3); 581-4573
    45(3); 581-4574
    45(3); 581-4575
    45(3); 581-4576
    45(3); 581-4577
    45(3); 581-4578
    45(3); 581-4579
    45(3); 581-4580
    45(3); 581-4581
    45(3); 581-4582
    45(3); 581-4583
    45(3); 581-4584
    45(3); 581-4585
    45(3); 581-4586
    45(3); 581-4587
    45(3); 581-4588
    45(3); 581-4589
    45(3); 581-4590
    45(3); 581-4591
    45(3); 581-4592
    45(3); 581-4593
    45(3); 581-4594
    45(3); 581-4595
    45(3); 581-4596
    45(3); 581-4597
    45(3); 581-4598
    45(3); 581-4599
    45(3); 581-4600
    45(3); 581-4601
    45(3); 581-4602
    45(3); 581-4603
    45(3); 581-4604
    45(3); 581-4605
    45(3); 581-4606
    45(3); 581-4607
    45(3); 581-4608
    45(3); 581-4609
    45(3); 581-4610
    45(3); 581-4611
    45(3); 581-4612
    45(3); 581-4613
    45(3); 581-4614
    45(3); 581-4615
    45(3); 581-4616
    45(3); 581-4617
    45(3); 581-4618
    45(3); 581-4619
    45(3); 581-4620
    45(3); 581-4621
    45(3); 581-4622
    45(3); 581-4623
    45(3); 581-4624
    45(3); 581-4625
    45(3); 581-4626
    45(3); 581-4627
    45(3); 581-4628
    45(3); 581-4629
    45(3); 581-4630
    45(3); 581-4631
    45(3); 581-4632
    45(3); 581-4633
    45(3); 581-4634
    45(3); 581-4635
    45(3); 581-4636
    45(3); 581-4637
    45(3); 581-4638
    45(3); 581-4639
    45(3); 581-4640
    45(3); 581-4641
    45(3); 581-4642
    45(3); 581-4643
    45(3); 581-4644
    45(3); 581-4645
    45(3); 581-4646
    45(3); 581-4647
    45(3); 581-4648
    45(3); 581-4649
    45(3); 581-4650
    45(3); 581-4651
    45(3); 581-4652
    45(3); 581-4653
    45(3); 581-4654
    45(3); 581-4655
    45(3); 581-4656
    45(3); 581-4657
    45(3); 581-4658
    45(3); 581-4659
    45(3); 581-4660
    45(3); 581-4661
    45(3); 581-4662
    45(3); 581-4663
    45(3); 581-4664
    45(3); 581-4665
    45(3); 581-4666
    45(3); 581-4667
    45(3); 581-4668
    45(3); 581-4669
    45(3); 581-4670
    45(3); 581-4671

    45(3); 581-4673
    45(3); 581-4674
    45(3); 581-4675
    45(3); 581-4676
    45(3); 581-4677
    45(3); 581-4678
    45(3); 581-4679
    45(3); 581-4680
    hemical Society; Washington; 1973.
    hemical Society; Washington; 1973.
    hemical Society; Washington; 1973.
    hemical Society; Washington; 1973.

    hemical Society; Washington; 1973.


    hemical Society; Washington; 1973.
    hemical Society; Washington; 1973.
    hemical Society; Washington; 1973.
    hemical Society; Washington; 1973.
    hemical Society; Washington; 1973.
    hemical Society; Washington; 1973.
    hemical Society; Washington; 1973.
    hemical Society; Washington; 1973.
    hemical Society; Washington; 1973.

    hemical Society; Washington; 1973.


    hemical Society; Washington; 1973.
    hemical Society; Washington; 1973.
    hemical Society; Washington; 1973.
    hemical Society; Washington; 1973.
    hemical Society; Washington; 1973.

    hemical Society; Washington; 1973.


    hemical Society; Washington; 1973.
    hemical Society; Washington; 1973.
    hemical Society; Washington; 1973.

    hemical Society; Washington; 1973.

    hemical Society; Washington; 1973.


    hemical Society; Washington; 1973.
    hemical Society; Washington; 1973.
    hemical Society; Washington; 1973.
    hemical Society; Washington; 1973.
    hemical Society; Washington; 1973.
    hemical Society; Washington; 1973.
    hemical Society; Washington; 1973.
    hemical Society; Washington; 1973.

    hemical Society; Washington; 1973.


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    armaceutical Sciences. Volume 26; Issue 2; October 2005; Pages 184-193. ISSN 0928-0987. DOI: 10.1016/j.ejps.2005.05.011.

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    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578
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    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578

    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578

    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578

    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578

    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578

    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578

    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578

    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578

    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578
    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578

    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578

    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578

    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578

    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578

    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578

    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578
    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578

    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578

    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578

    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578

    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578

    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578

    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578

    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578

    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578
    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578

    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578

    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578

    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578

    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578
    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578

    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578

    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578

    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578

    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578

    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578

    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578
    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578

    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578

    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578

    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578

    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578
    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578

    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578

    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578

    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578

    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578

    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578

    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578
    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578

    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578

    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578

    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578
    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578

    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578
    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578

    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578

    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578

    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578

    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578

    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578

    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578

    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578

    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578

    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578

    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578

    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578

    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578
    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578

    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578

    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578

    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578

    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578

    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578

    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578

    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578

    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578

    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578

    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578

    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578
    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578

    ms. Part 2. Solubility in 1-octanol. SAR and QSAR in Environmental Research Vol. 18 Nos. 5–6 July–September 2007 543–578

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