Professional Documents
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Labtools Merck 2017
Labtools Merck 2017
LIFE SCIENCE
Innovative tools and laboratory supplies for the life science industry that
make research and biotech production easier, faster and more successful.
PERFORMANCE MATERIALS
A wide range of specialty chemicals, such as liquid crystals for displays,
effect pigments for coatings and cosmetics, or high-tech materials for the
electronics industry.
Total capital
100 %
Thin-layer chromatography 86
Analytical HPLC 88
Specification of column sorbents 90
LC Troubleshooting 94
Sample preparation 100
06 Organic solvents
Organic solvents properties and drying agents 104
Sustainable Solvent Alternatives 108
Density of Ethanol – Water mixtures 110
Drying agents 111
Solvents for organic instrumental analysis 112
Solvents for infrared spectroscopy | transmittances 114
Handling chemicals is not only fascinating, but can also be very dangerous
for human health and the environment, especially if they are not used
adequately. This is one of the reasons why it is that important to inform
oneself upfront about the hazard profile of a chemical and to have
excellent knowledge about all relevant state-of-the-art precautionary
measurements to minimize the risk of adverse effects.
8
General instructions how to use hazardous
substances in the laboratory
1.
Within a risk assessment the employer has to cover all activities
with hazardous chemical products.
2. H
andling of hazardous chemicals should only be allowed if all
necessary measures have been taken to ensure proper protection
regarding health hazards and environmental protection.
3.
All substances and mixtures, including waste, must be part of this
assessment.
9
Hazard and precautionary statements
According to the 5th revised edition of the UN GHS and in addition
EU hazard statements based on the CLP Regulation.
Hazard statements
H200 Unstable explosives.
H201 Explosive; mass explosion hazard.
H202 Explosive, severe projection hazard.
H203 Explosive; fire, blast or projection hazard.
H204 Fire or projection hazard.
H205 May mass explode in fire.
H220 Extremely flammable gas.
H221 Flammable gas.
H222 Extremely flammable aerosol.
H223 Flammable aerosol.
H224 Extremely flammable liquid and vapour.
H225 Highly flammable liquid and vapour.
H226 Flammable liquid and vapour.
H227 Combustible liquid.
H228 Flammable solid.
H229 Pressurised container: May burst if heated.
H230 May react explosively even in the absence of air.
H231 May react explosively even in the absence of airat elevated
pressure and/ or temperature.
H240 Heating may cause an explosion.
H241 Heating may cause a fire or explosion.
H242 Heating may cause a fire.
H250 Catches fire spontaneously if exposed to air.
H251 Self-heating: may catch fire.
H252 Self-heating in large quantities; may catch fire.
H260 In contact with water releases flammable gases which may
ignite spontaneously.
H261 In contact with water releases flammable gases.
H270 May cause or intensify fire; oxidizer.
H271 May cause fire or explosion; strong oxidizer.
H272 May intensify fire; oxidizer.
H280 Contains gas under pressure; may explode if heated.
H281 Contains refrigerated gas; may cause cryogenic burns or injury.
H290 May be corrosive to metals.
H300 Fatal if swallowed.
H300 + H310 Fatal if swallowed or in contact with skin.
H300 + H310 Fatal if swallowed, in contact with skin or if inhaled.
+ H330
10
www.merckmillipore.com/ghs
11
H341 Suspected of causing genetic defects.
H350 May cause cancer.
H350i* May cause cancer by inhalation.
H351 Suspected of causing cancer.
H360 May damage fertility or the unborn child.
H360D* May damage the unborn child.
H360Df* May damage the unborn child. Suspected of damaging
fertility.
H360F* May damage fertility.
H360FD* May damage fertility. May damage the unborn child.
H360Fd* May damage fertility. Suspected of damaging the unborn
child.
H361 Suspected of damaging fertility or the unborn child.
H361d* Suspected of damaging the unborn child.
H361f* Suspected of damaging fertility.
H361fd* Suspected of damaging fertility. Suspected of damaging the
unborn child.
H362 May cause harm to breast-fed children.
H370 Causes damage to organs.
H371 May cause damage to organs.
H372 Causes damage to organs through prolonged or repeated
exposure.
H373 May cause damage to organs through prolonged or
repeated exposure.
H400 Very toxic to aquatic life.
H401 Toxic to aquatic life.
H402 Harmful to aquatic life.
H410 Very toxic to aquatic life with long lasting effects.
H411 Toxic to aquatic life with long lasting effects.
H412 Harmful to aquatic life with long lasting effects.
H413 May cause long lasting harmful effects to aquaticlife.
H420 Harms public health and the environment by destroying
ozone in the upper atmosphere.
* EU hazard statement
12
www.merckmillipore.com/ghs
Precautionary statements
P101 If medical advice is needed, have product container or label
at hand.
P102 Keep out of reach of children.
P103 Read label before use.
P201 Obtain special instructions before use.
P202 Do not handle until all safety precautions have been read and
understood.
P210 Keep away from heat, hot surfaces, sparks, open flames and
other ignition sources. No smoking.
P211 Do not spray on an open flame or other ignition source.
P220 Keep away from clothing and other combustible materials.
P222 Do not allow contact with air.
P223 Do not allow contact with water.
P230 Keep wetted with …
P231 Handle and store contents under inert gas.
P231 + P232 Handle and store contents under inert gas.
Protect from moisture.
P232 Protect from moisture.
13
P234 Keep only in original packaging.
P235 Keep cool.
P240 Ground and bond container and receiving equipment.
P241 Use explosion-proof electrical/ ventilating/ lighting/ …/
equipment.
P242 Use non-sparking tools.
P243 Take action to prevent static discharges.
P244 Keep valves and fittings free from oil and grease.
P250 Do not subject to grinding/ shock/ friction/ …
P251 Do not pierce or burn, even after use.
P260 Do not breathe dust/ fume/ gas/ mist/ vapours/ spray.
P261 Avoid breathing dust/ fume/ gas/ mist/ vapours/ spray.
P262 Do not get in eyes, on skin, or on clothing.
P263 Avoid contact during pregnancy and while nursing.
P264 Wash … thoroughly after handling.
P270 Do not eat, drink or smoke when using this product.
P271 Use only outdoors or in a well-ventilated area.
P272 Contaminated work clothing should not be allowedout of the
workplace.
P273 Avoid release to the environment.
P280 Wear protective gloves/ protective clothing/ eyeprotection /
face protection.
P282 Wear cold insulating gloves and either face shield or eye
protection.
P283 Wear fire resistant or flame retardant clothing.
P284 In case of inadequate ventilation wear respiratory
protection.
P301 IF SWALLOWED:
P301 + P310 IF SWALLOWED: Immediately call a POISON CENTER/ doctor…
P301 + P312 IF SWALLOWED: Call a POISON CENTER/ doctor/ …/
if you feel unwell.
P301 + P330 IF SWALLOWED: Rinse mouth. Do NOT induce vomiting.
+ P331
P302 IF ON SKIN:
P302 + P334 IF ON SKIN: Immerse in cool water or wrap in
wetbandages.
P302 + P335 IF ON SKIN: Brush off loose particles from skin. Immerse in
+ P334 cool water or wrap in wet bandages.
P302 + P352 IF ON SKIN: Wash with plenty of water/ …
P303 IF ON SKIN (or hair):
P303 + P361 IF ON SKIN (or hair): Take off immediately all contaminated
+ P353 clothing. Rinse skin with water or shower.
14
www.merckmillipore.com/ghs
P304 IF INHALED:
P304 + P312 IF INHALED: Call a POISON CENTER/ doctor if you feel unwell.
P304 + P340 IF INHALED: Remove person to fresh air and keep
comfortable for breathing.
P305 IF IN EYES:
P305 + P351 IF IN EYES: Rinse cautiously with water for several minutes.
+ P338 Remove contact lenses, if present and easy to do. Continue
rinsing.
P306 IF ON CLOTHING:
P306 + P360 IF ON CLOTHING: rinse immediately contaminated clothing
and skin with plenty of water before removing clothes.
P308 IF exposed or concerned:
P308 + P311 IF exposed or concerned: Call a POISON CENTER/ doctor/ …
P308 + P313 IF exposed or concerned: Get medical advice/ attention.
P310 Immediately call a POISON CENTER/ doctor/ …
P311 Call a POISON CENTER/ doctor/ …
P312 Call a POISON CENTER/ doctor/ …/ if you feel unwell.
P313 Get medical advice/ attention.
15
P342 + P311 If experiencing respiratory symptoms: Call a POISON
CENTER/ doctor/ …
P351 Rinse cautiously with water for several minutes.
P352 Wash with plenty of water/ …
P353 Rinse skin with water or shower.
P360 Rinse immediately contaminated clothing and skinwith plenty
of water before removing clothes.
P361 Take off immediately all contaminated clothing.
P361 + P364 Take off immediately all contaminated clothing and wash it
before reuse.
P362 Take off contaminated clothing.
P362 + P364 Take off contaminated clothing and wash it beforereuse.
P363 Wash contaminated clothing before reuse.
P364 And wash it before reuse.
P370 In case of fire:
P370 + P372 In case of fire: Explosion risk. Evacuate area.
+ P380 + DO NOT fight fire when fire reaches explosives.
P373
P370 + P376 In case of fire: Stop leak if safe to do so.
P370 + P378 In case of fire: Use … to extinguish.
P370 + P380 In case of fire: Evacuate area. Fight fire remotely due to the
+ P375 risk of explosion.
P370 + P380 In case of fire: Evacuate area. Fight fire remotely due to the
+ P375 + risk of explosion. Use … to extinguish.
P378
P371 In case of major fire and large quantities:
P371 + P380 In case of major fire and large quantities: Evacuate area.
+ P375 Fight fire remotely due to the risk of explosion.
P372 Explosion risk.
P373 DO NOT fight fire when fire reaches explosives.
P375 Fight fire remotely due to the risk of explosion.
P376 Stop leak if safe to do so.
P377 Leaking gas fire: Do not extinguish, unless leakcan be
stopped safely.
P378 Use … to extinguish.
P380 Evacuate area.
P381 In case of leakage, eliminate all ignition sources.
P390 Absorb spillage to prevent material damage.
P391 Collect spillage.
P401 Store in accordance with …
P402 Store in a dry place.
P403 Store in a well-ventilated place.
P403 + P233 Store in a well-ventilated place. Keep containertightly closed.
16
www.merckmillipore.com/ghs
17
Storage of chemicals in safety cabinets
Inappropriate storage of different chemicals in a safety cabinet might cause
accidents. The following storage rules will help to reduce the risks. The
storage table for small quantities shows, by means of GHS pictograms,
combinations of products which may be stored together (+) or not (–). There
are no exceptions for explosive substances, gases, organic peroxides, self-
reactive substances and radioactive substances; the mixed storage table of
the StoreCard still applies.
none
+ + - - - + + + + + +
+ + + + - + + + + + +
- + + + - - + + + + +
- + + + - - - - - - -
- - - - + + + + + + +
+ + - - + + - + + + +
+ + + - + - + + + + +
+ + + - + + + + + + +
+ + + - + + + + + + +
+ + + - + + + + + + +
none + + + - + + + + + + +
18
GHS – the first-ever globally uniform approach
The Globally Harmonized System of Classification and Labelling of
Chemicals (GHS) was developed by the United Nations over more than
a decade of intense work. It is a “living” document which will be regularly
revised and updated to reflect new national, regional and international
experiences in the area of hazard communication.
Purpose
Enhance the protection of human health and the environment by providing
an internationally comprehensible system for hazard communication
Reduce the need for testing and evaluation of chemicals, and facilitate in-
ternational trade in chemicals whose hazards have been properly assessed
on an international basis
Scope
GHS covers inter alia the following elements:
Harmonized criteria for classifying substances and mixtures according to
their health, environmental and physical hazards
Harmonized hazard communication elements, including requirements for
labelling and safety data sheets
19
Hazard pictograms
GHS – Hazard pictograms and examples for associated hazard classes
Physical Hazards
Corrosive to
metals
20
www.merckmillipore.com/
regulatory-support
Health Hazards
1)
MR: carcinogenicty,
C
Environmental hazards
germ cell mutagenicity,
reproductive toxicity
2)
TOT: specific target organ
S
toxicity
21
Incompatible chemicals
The chemicals listed below may react violently with one another. They
must be kept apart and must never come into contact with one another. The
objective of this list is to give information on how to avoid accidents in the
laboratory. Due to the great number of hazardous materials, this list includes
only some examples. Detailed information about the stability and reactivity of
the substance are available in the safety data sheet.
22
Substance: Ammonium nitrate Order number: 101188
Incompatible with
Exothermic reaction Reducing agents, oils, metallic chlorides, chlora-
with: tes, salts of oxyhalogenic acids, sulphides, organic
nitro compounds, aluminium, organic substances,
oxidizing agents, ammonium compounds, alka-
lines, nitrites, combustible substance, carbides,
non-metals, alkali metals, metals, acids, mild steel
Risk of ignition of Acetic acid, metals, nitrites, ammonium
formation of compounds, potassium dichromate
inflammable gases or
vapours with:
23
Incompatible chemicals
Substance: Chromium(VI) oxide Order number: 100229
Incompatible with
Risk of ignition or Organic combustible substance, alkali metals,
formation of ammonia, non-metals, halogen-halogen
inflammable gases or compounds hydrazine and derivatives, nitrates,
vapours with: reducing agents, nitric acid
24
Substance: Iodine Order number: 104761
Incompatible with
Risk of explosion with: Reducing agents, alkali metals, acetylene, am-
monia, potassium, copper compounds, sodium,
oxyhalogenic compounds, Boron, halogen oxides,
iodides, azides, ammonium compounds, antimo-
ny, in powder form, mercury oxide with methanol
and ethanol
Risk of ignition of Powdered metals, zinc, semimetals, halogen-
formation of halogen compounds, non-metals, non-metallic
inflammable gases or oxides, alkali salts, iron, fluorine, formaldehyde,
vapours with: hydrides, sodium phosphide, phosphorus, sulphur,
titanium, powdered aluminium, acetylidene,
combustible substances, powdered magnesium,
petrol, butadiene, calcium hydride, diethyl ether
with aluminium
Exothermic reaction Carbides, azides, turpentine oils and/or turpentine
with: substitutes, alkali oxides, lithium silicide, alkaline
25
Incompatible chemicals
Substance: Nitric acid Order number: 101719
Incompatible with
Risk of ignition of Formaldehyde, glycerol, sulphuric acid, hydrogen
formation of iodide, chlorates, organic substance, carbon / soot,
inflammable gases or hydrocarbons, alkali metals, lithium silicide, orga-
vapours with: nic solvent, phosphorus, pyridine, sulphur dioxide,
hydrogen sulphide, hydrogen peroxide, aceto-
nitrile, acetylidene, alcohols, anilines, antimony
hydride, amines, ammonia, combustible subs-
tances, phosphides, aldehydes, dichloromethane,
hydrazines, dioxane, acetic acid, acetone, acetic,
anhydride, fluorine, powdered metals
Violent reactions Nitriles, antimony, arsenic, boron, ferric oxide,
possible with: alkalines, sodium hypochlorite
26
Substance: Potassium chlorate Order number: 104944
Incompatible with
Risk of explosion with: Arsenic, resins, charcoal, powdered metals,
sulphuric acid, nitrates, tannin, zinc oxide, alco-
hols, organic combustible substances, sulphides,
hydrocarbons, ammonium compounds, reducing
agents, phosphorus, hydrides, fluorine, alkali me-
tals, cyanides, alkali amides, sulphur, potassium
dichromate, powdered aluminium, germanium,
potassium, copper compounds, powdered
magnesium, nitric acid, titanium, sugars, organic
substances
Exothermic reaction Ammonia, calcium silicide, nitrides, phosphides,
with: chromium
Risk of ignition of Sulphur dioxide, hydrogen iodide
formation of
inflammable gases or
vapours with:
27
Safety Data Sheet
The safety data sheet (SDS) is the most important and common document
when talking about product safety. With the implementation of all safety and
precautionary measures given in the SDS the protection of human health and
the environment as well as a sufficient workplace safety standard should be
assured.
28
Section 2: Hazards identification
29
Safety Data Sheet
Section 8: Exposure controls / personal protection
30
Section 10: Stability and reactivity
31
Label information
With GHS for the first time standardized and harmonized elements for global
hazard communication are available:
The label example on page 33 describes where to find this key information.
As mentioned already on page 28, the SDS includes all essential information
concerning product safety. This implies next to the labeling elements also the
classification of a hazardous chemical product based on GHS requirements.
32
H (hazard) and P (precautionary) statements
and special US requirements
Storage
30°C
temperature
5°C
Signal word
Hazard
Name and
address of
supplier (US / EU)
1.06469.1000
Batch
number Country of orgin
BATCH12345
Empirical
formulas,
Density,
Molar mass
33
Safety in daily solvents handling | Electrostatic charging
If flammable liquids (e.g. solvents) are to be used, the container (10 L and
more) must be properly earthed according to valid safety regulations to avoid
explosion and fire risks. Appropriate measures must be taken to discharge
static electricity.
HE
E
YG
AT
OX
FUEL
Heavy and light gases, hydrocarbon liquids and vapors, vapors of
chemicals / lubricants / solvents, frac oils, flammable materials
Removing at least one of the components avoids the fire / explosion.
34
General warnings and safety instructions must be observed.
ll components (e.g. container and withdrawal system) must be grounded
A
separately in accordance with the applicable safety regulations.
Grounding clamps must have metallic contact with both the container and
the withdrawal system, and a safe ground connection.
he grounding of the container and the grounding of the withdrawal
T
system must be installed before opening the container.
he user must always wear conductive personal protective equipment,
T
especially shoes and gloves, to avoid electrostatic charges. Therefore,
the user must always wear conductive personal protective equipment,
especially shoes and gloves.
The floor has to be conductive.
ampling vessels made of insulating material with a volume greater than
S
1 liter should not be used.
efore using organic solvents, the user must ensure that there are
B
no additional ignition hazards caused by process-specific parameters, such
as increased ignitability of the substances due to changed environmental
conditions or when sampling in combination with highly charge-generating
35
Declaration of suitability of MERCK packaging materials
Merck packaging materials are based on European state-of-the-art technology
and undergo rigorous technical and analytical quality controls both when they
themselves are being manufactured and also during filling and packaging
operations at Merck.
All of the primary and secondary packaging materials used at Merck undergo
quality control testing to reach a consistently high standard of quality. Testing
is performed using defect evaluation lists and on feature lists published by the
German Chemical Industry Association, VCI. The methods used for testing are
based on DIN, EN and CEN Standards. Only flawless packaging materials reach
point-of-use.
36
The starting materials used to manufacture the packagings either contain
no hazardous substances, no origin animal substances (TSE/BSE free) or
their percentages are below the legal limits. The materials employed conform
to the REACH regulation for chemicals, contain no Substances of very high
concern (SVHC) or other toxic substances, and satisfys Directive 1935/2004/EC
on materials coming into contact with foods as well as Regulation EU 10/2011
and Regulation Packaging Waste Directive 94/62/EC.
We confirm also that all of the packaging units used fully meet the interna-
tional requirements for transport of dangerous goods by road (ADR), rail
(RID), sea (IMDG Code) and air (IATA). Unit packs are specifically tested and
released for the respective modes of transport. The packaging used for indi-
vidual modes of transport will already have been type-tested and approved
for compliance with UN regulations.
37
Ni
292 d1 4s
0
1.70 [Ar] 3
48
3
0, 2, 2 7
107.8 8
Co
8 4s
[Ar] 3
d
961 .7
, 2, 3
47 2162
Cd
2
-1, 0 7 4s2 106.4.8
[Ar] 3
d
1554 3 1.42
46
Ag
1
102.9 4 296
196 1.30 1, 21
45 3695
Pd
10 5s
] 4 d
1.45 [Kr
80
,4 7
0, 2 10 196.9 8
Rh
] 4 d ,1
[Kr 64
10 56
2, 3,
4, 5 8
195.0.2 79 28
0, 1, ] 4d8 5s 1.42
H
1
[Kr 1768 5
78
8
Au
2
192.2 6 382
5s 1.42
1
244 1, 31
77 4428
Pt
.23 10 s
14 5d 6
033 1.55 0, 2, 1
4 [Xe] 4f
5012 *280 1
Ir
9 6s
4f 5
14 d
1.52 [Xe]
1, 2, 3
, 4, 62
-1, 0, 4f14 5d7 6s
*281 111
[Xe]
110
,8
Rg
, 4, 66 2 .1 4
6s *268
f14 5d
109
Ds
*277 5f 6d
14 7s
9
[Rn]
Mt
7s
2
5f 6d
8
14
[Rn]
6d 7s
2
7
14
5f
[Rn]
f14 6d
7s6
2
82
6
151.9 2 64
Rn] 5
63 1596
[ 6
150.3 2
62
107
1794
1.01
G
Eu
.91
*144 42 1.07
10 2, 32
61 3000
Sm
.24 ] 4 f7 6s
016 1.07 2, 32
[Xe
3074
.06
*243 76 9
Pm
6 6s
f
1.07 [Xe] 4 11
02
95
3
5 6s
2 .06
*244 40 2011
[Xe ] 4 f 6 1.20
94
3
3228
Am
.05
4f 6s
4
2
*237 44 1.22
e] 6 5, 6
3, 4, 7 7s
93 3902
Pu
.03
*238 35 1.22 [Rn]
5 f
11 5, 6
3, 4, 6 7s2
Np
4131 ] 5 f
1.22 5, 6
[R n
3, 4, 1 7s2
4 6d
5f
5, 62 [Rn]
3, 4,
1 7
321.0 7 Sn 2 2
In
5s 5p
2
10
76 [Kr] 4
d
83
3
1.46 207.2
5s 5p
1
6
327.4 9
2
10
r] 4d
82
[K
Bi
2
8
204.3 4 174
10 5s
2 30 1.55
81 1473
d
Pb
[Kr] 4
9
200.5 3 1.44 2, 42 [Xe
–38.8 2
Tl
10 6s 6p
2
356.6 4 4f 5d
14
1, 31
1.4
6 s2 6p
[Xe] *287 11
Hg
10
f 5d
114
14
[Xe] 4 *284
1, 22
d10 6s
113 U
Fl
f 5
14
[Xe] 4 85
*2
Uut
10 s 7p
2
112
2
5f
14 6d 7
[Rn]
10 7s 7p
1
2
Cn
f14 6d
[ Rn] 5
7s
2 164.9
147
10
5f 6d
14
[Rn]
s2
0
162.5 2
141
67 27
1
66 2567
Ho
3
158.9 9
135 1.10
65 Chemical and physical
Dy
5
157.2 3 3230
131 1.10
properties of 3 [Xe]
3273
Tb
elements and f 6s
2
10 *2
1.11 [Xe] 4
3, 42 compounds
inorganic 51.08 99
Gd
4f 6s *2
900
9
[Xe]
Table of elements 40
98
3
Es
.07
7 5d 6s
1
2
*247 96 1.20
f 9
[Xe] 4
97
Cf
.0 7
*247 45 1.20
13 3, 42
96
Bk
5 7s
10
f
1.20 3, 42 [Rn]
Cm
] 5 f9 7s
[Rn
3, 42
7 6d 7s
1
5 f
6 [Rn]
s2
sin
ce bu
life scien
The
Table of the elements
40
Oxidation Electron Percentage mass Ionization Redox potential
states configuration of the earth’s energy (0°C, 1 bar)
core in eV
41
Element Sym- Atomic Relative Density Melting Boiling Atomic Electronegativity
name bol No. atomic (20 °C) Point Point radius (Allred- (Pauling)
mass in °C in °C in pm Rochow)
in g/mol
Holmium Ho 67 164.93 8.78 g/cm3 1472 2700 176.2 1.10 1.23
Hydrogen H 1 1.0079 0.084 g/L -259.1 -252.76 37.5 2.20 2.2
Indium In 49 114.82 7.31 g/cm3 156.60 2072 162.6 1.49 1.78
Iodine I 53 126.90 4.94 g/cm3 113.7 184.4 133.3 2.21 2.66
Iridium Ir 77 192.22 22.65 g/cm3 2446 4428 135.7 1.55 2.20
42
Oxidation Electron Percentage mass Ionization Redox potential
states configuration of the earth’s energy (0°C, 1 bar)
core in eV
43
Element Sym- Atomic Relative Density Melting Boiling Atomic Electronegativity
name bol No. atomic (20 °C) Point Point radius (Allred- (Pauling)
mass in °C in °C in pm Rochow)
in g/mol
Rhodium Rh 45 102.91 12.41 g/cm3 1964 3695 134.5 1.45 2.28
44
Oxidation Electron Percentage mass Ionization Redox potential
states configuration of the earth’s energy (0°C, 1 bar)
core in eV
45
03
Solutions –
aqueous systems
General formulas for mixing liquids 48
Conversion table for water hardness units 49
Mixture rules 50
Preparation of dilute solutions 51
Solubility of inorganic compounds in water
in relation to temperature 52
Solubility products of slighty soluble
inorganic compounds 60
Solubility of inorganic compounds in organic solvents 63
Sulfuric acid 64
Phosphoric acid 66
Hydrochloric acid 66
Nitric acid 68
Sodium hydroxide solution 70
Potassium hydroxide solution 72
Ammonia 74
Commercially available concentrations
of some acids and bases 75
General formulas for mixing liquids
C (a – c) B (a – b)
A = c – b B= C=
a – b a–c
With:
Example
Available: concentrated sulfuric acid with a density of d 20° = 1.84 (= 97.5 weight%).
4°
How much sulfuric acid and how much water are needed to
prepare 10 L (= 12.8 kg) of battery sulfuric acid?
Calculation
48
Conversion table for water hardness units
Alkaline Alkaline German CaCO3 British French
earth ions earth ions degree conc. degree degree
in mmol/L in mval/L in °d in ppm in °e in °f
www.merckmillipore.com/test-strips
49
Mixture rules
Example
1.435
1.520
1.824
Calculation
The table ‘Sulfuric acid’ (page 64) informs that sulfuric acid with a density
54 30
62
92 8
i.e. 30 parts by weight of 54.00 % sulfuric acid must be mixed with 8 parts by
weight of 92.00 % sulfuric acid to yield sulfuric acid of 62.00 weight% H2SO4,
50
Preparation of dilute solutions
Slowly stir the stated quantity of concentrated solution or solid KOH or NaOH,
respectively, into water.
51
Solubility of inorganic compounds in water
in relation to temperature
Name Ord. No. Formula
52
Solubility in g/100 g H2O at °C Content of Density of
the total the total
solution at solution at
0 20 40 60 80 100 20°C in % 20°C in %
2.60 6.59 12.36 21.1 35.2 109.2 6.18 1.0459
(95°C) (15.5°C)
44.9 45.6 46.3 47.0 47.7 – 31.3 –
61.0 75.44 89.0 108.0 – – 43.0 –
2.96 6.01 13.6 33.3 72.0 109.0 5.67 1.053
(90°C)
31.2 36.44 45.6 58.0 73.0 89.0 26.7 1.308
60.6 75.5 91.1 107.8 126.7 145.6 43.9 –
29.7 37.56 46.0 55.3 65.6 77.3 27.3 1.075
22.7 36.8 56.7 82.9 120.7 174.0 26.9 –
11.9 21.22 36.6 59.2 109.2 355.0 17.5 1.070
57.5 68.6 81.8 97.6 (115.5) – 40.70 1.3436
(14.5°C)
17.8 26.9 38.5 53.4 73.0 – 21.2 1.180
– 4.8 13.2 – – – – –
118.5 187.7 283.0 415.0 610.0 1000.0 65.0 1.308
53
Name Ord. No. Formula
54
Solubility in g/100 g H2O at °C Content of Density of
the total the total
solution at solution at
0 20 40 60 80 100 20°C in % 20°C in %
– 62.35 68.6 78.3 – – 38.4 1.490
15.65 26.58 40.3 47.6 – – 21.0 1.225
(50°C)
– – – – 43.8 (31.6) – –
74.5 91.94 – – – – 47.9 1.520
0.6728 0.99 1.45 1.98 2.62 3.31 0.98 1.007
36.4 52.22 69.4 88.0 107.5 127.3 34.3 1.40
– 1.33 – – – – 1.31 –
– 82.82 90.4 100.0 113.0 (127.5) 45.3 1.290
36.2 34.8 33.5 32.3 31.5 31.0 25.6 1.23
52.8 54.57 57.5 60.7 65.87 72.7 35.3 1.331
63.9 70.07 81.8 93.7 – – 41.2 1.388
(25°C)
30.05 35.6 45.4 – – – 26.25 1.310
(10°C)
63.6 73.62 88.7 (106.0) – – 42.4 1.499
55
Name Ord. No. Formula
56
Solubility in g/100 g H2O at °C Content of Density of
the total the total
solution at solution at
0 20 40 60 80 100 20°C in % 20°C in %
4.7 8.11 12.9 18.5 24.8 32.3 7.5 1.064
127.8 144.51 161.0 176.2 191.5 208.0 59.1 1.710
13.25 31.66 63.9 109.9 169.0 245.2 24.1 1.160
– 35.88 – – – – 26.4 –
0.76 1.73 3.63 7.18 13.38 22.2 1.7 1.008
2.83 6.43 12.56 22.4 – – 6.0 1.040
0.18 0.47 1.1 – – – 0.468 –
7.33 11.11 14.79 18.2 21.29 24.1 10.0 1.0807
177.0 218.0 – – – – 68.55 1.420
70.6 83.6 – – – 128.0 – –
115.0 219.2 334.8 471.0 652.0 1024.0 68.6 2.180
0.573 0.796 0.979 1.15 1.3 1.46 0.75 –
36.3 46.42 65.4 138.0 – – 31.7 1.170
(58°C)
– – – 118.0 118.3 121.2 – –
6.86 21.66 – – – – 17.8 1.1941
57
Name Ord. No. Formula
58
Solubility in g/100 g H2O at °C Content of Density of
the total the total
solution at solution at
0 20 40 60 80 100 20°C in % 20°C in %
44.1 53.85 66.6 85.2 – – 35.0 1.390
0.35 0.7 1.5 3.13 7.02 24.2 0.69 –
– – 91.2 94.2 97.2 101.2 – –
– – 453.0 488.0 541.0 614 – –
– – 211.5 – – – – –
41.6 53.8 – – – – 35.0 1.470
– – – 76.5 66.7 60.5 – –
59
Solubility products of slightly soluble
inorganic compounds
Substance Formula Solubility product at given
temperature in mol/L
A Aluminum hydroxide Al(OH)3 4.00 x 10–13 (15°)
1.50 x 10–15 (18°)
3.70 x 10–15 (25°)
B Barium carbonate BaCO3 7.00 x 10–9 (16°)
8.10 x 10–9 (25°)
Barium chromate BaCrO4 1.60 x 10–10 (18°)
2.40 x 10–10 (28°)
Barium fluoride BaF2 1.60 x 10–6 (10°)
1.70 x 10–6 (18°)
Barium oxalate BaC2O4 · 2H2O 1.20 x 10–7 (18°)
Barium sulfate BaSO4 8.70 x 10–11 (18°)
1.08 x 10–10 (25°)
1.98 x 10–10 (50°)
Beryllium hydroxide Be(OH)2 2.70 x 10–19 (25°)
Bismuth hydroxide Bi(OH)3 4.30 x 10–31 (18°)
Bismuth oxide chloride BiOCl 1.60 x 10–31 (25°)
Bismuth sulfide Bi2S3 1.60 x 10–72 (18°)
C Cadmium carbonate CdCO3 2.50 x 10–14 (25°)
Cadmium oxalate CdC2O4 · 3H2O 1.53 x 10–8 (18°)
Cadmium sulfide CdS 3.60 x 10–29 (18°)
Calcium carbonate CaCO3 4.80 x 10–9 (25°)
Calcium fluoride CaF2 3.40 x 10–11 (18°)
3.95 x 10–11 (26°)
Calcium hydroxide Ca(OH)2 5.47 x 10–6 (18°)
Calcium oxalate CaC2O4 · H2O 1.78 x 10–9 (18°)
2.57 x 10–9 (25°)
Calcium phosphate Ca3(PO4)2 1.00 x 10–25 (25°)
Calcium sulfate CaSO4 6.10 x 10–5 (10°)
2.45 x 10–5 (25°)
Calcium tartrate CaC4H4O6 · 2H2O 7.70 x 10–7 (25°)
Cobalt(II) carbonate CoCO3 1.00 x 10–12 (25°)
Cobalt(II) sulfide CoS 1.90 x 10–27 (20°)
Copper(I) bromide CuBr 4.15 x 10–8 (18 – 20°)
Copper(II) carbonate CuCO3 1.37 x 10–10 (25°)
Copper(I) chloride CuCl 1.02 x 10–6 (18 – 20°)
Copper(II) hydroxide Cu(OH)2 5.60 x 10–20 (25°)
Copper(I) iodide CuL 5.06 x 10–12 (18 – 20°)
Copper(I) sulfide Cu2S 2.00 x 10–47 (18°)
Copper(II) sulfide CuS 8.00 x 10–45 (18°)
Copper(I) thiocyanate CuSCN 1.60 x 10–11 (18°)
I Iron(II) carbonate FeCO3 2.50 x 10–11 (20°)
Iron(II) hydroxide Fe(OH)2 1.64 x 10–14 (18°)
Iron(III) hydroxide Fe(OH)3 1.10 x 10–36 (18°)
L Lanthanum hydroxide La(OH)3 ~ 10–20 (25°)
Lead bromide PbBr2 3.90 x 10–5 (25°)
Lead carbonate PbCO3 3.30 x 10–14 (18°)
60
Substance Formula Solubility product at given
temperature in mol/L
L Lead chloride PbCl2 2.12 x 10–5 (25°)
Lead chromate PbCrO4 1.77 x 10–14 (25°)
Lead fluoride PbF2 2.70 x 10–8 (9°)
3.20 x 10–8 (18°)
Lead iodate Pb(IO3)2 5.30 x 10–14 (9.2°)
1.20 x 10–13 (18°)
2.60 x 10–13 (25.8°)
Lead iodide Pbl2 7.50 x 10–9 (15°)
1.40 x 10–9 (25°)
Lead oxalate PbC2O4 2.74 x 10–11 (18°)
Lead sulfate PbSO4 1.06 x 10–8 (18°)
Lead sulfide PbS 3.40 x 10–28 (18°)
Lithium carbonate Li2CO3 1.70 x 10–3 (25°)
M Magnesium ammonium MgNH4PO4 2.50 x 10–13 (25°)
phosphate
Magnesium carbonate MgCO3 2.60 x 10–5 (12°)
Magnesium fluoride MgF2 7.10 x 10–9 (18°)
Magnesium hydroxide Mg(OH)2 1.20 x 10–11 (18°)
61
Substance Formula Solubility product at given
temperature in mol/L
S Silver chromate Ag2CrO4 1.20 x 10–12 (14.8°)
9.00 x 10–12 (25°)
Silver iodide Agl 0.32 x 10–16 (13°)
1.50 x 10–16 (25°)
Silver sulfide Ag2S 1.60 x 10–49 (18°)
Silver thiocyanate AgSCN 0.49 x 10–12 (18°)
1.16 x 10–12 (25°)
Strontium carbonate SrCO3 1.60 x 10–9 (25°)
Strontium fluoride SrF2 2.80 x 10–9 (18°)
Strontium oxalate SrC2O4 5.60 x 10–8 (18°)
Strontium sulfate SrSO4 2.80 x 10–7 (2.9°)
3.80 x 10–7 (17.4°)
T Thallium(I) bromide TlBr 3.90 x 10–6 (25°)
Thallium(I) chloride TlCl 1.90 x 10–4 (25°)
Thallium(I) iodide TlI 5.80 x 10–8 (25°)
Thallium(III) hydroxide Tl(OH)3 1.40 x 10–53 (25°)
Thallium(II) sulfide Tl2S 9.00 x 10–23 (25°)
Thallium(I) thiocyanate TlSCN 2.30 x 10–4 (25°)
Z Zinc carbonate ZnCO3 6.00 x 10–11 (25°)
Zinc hydroxide Zn(OH)2 1.00 x 10–17 (25°)
Zinc sulfide, alpha ZnS 6.90 x 10–26 (20°)
Zinc sulfide, beta ZnS 1.10 x 10–24 (25°)
62
Solubility of inorganic compounds in organic solvents
Unless otherwise stated, this table indicates the solubility of the anhydrous
substance in 100 g pure solvent
Solubility in g / 100 g Solvent
Ethanol Methanol Acetone Pyridine
(absolute)
Ord. No. 100983 106009 100014 109728
Ammonium bromide 101125 - - - 8.14 (25°C)
Ammonium chloride 101145 0.6 (15°C) 3.4 - -
Ammonium nitrate 101188 3.8 17.1 - -
Antimon(III) 107838 - - 538 -
chloride
Barium nitrate 101729 - 0.5 (25°C) - -
Boric acid 100165 11 (25°C) - 0.5 -
Cobalt(II) sulfate 102556 2.5 (3°C) 5.5 - -
heptahydrate
Copper(II) chloride 102733 - - 8.9 (15°C) -
dihydrate
Copper(II) sulfate 102791 - 1.05 - -
anhydrous
Copper(II) sulfate 102790 1.1 (3°C) 15.6 - -
pentahydrate
63
Sulfuric acid
H2SO4 , M = 98.08 g/mol
64
H2SO4 , M = 98.08 g/mol
65
Phosphoric acid Hydrochloric acid
H3PO4 , M = 97.99 g/mol HCl, M = 36.47 g/mol
66
www.merckmillipore.com/acids
67
Nitric acid
HNO3 , M = 63.02 g/mol
68
HNO3 , M = 63.02 g/mol
www.merckmillipore.com/safebreak
69
Sodium hydroxide solution
NaOH, M = 40.01 g/mol
70
NaOH, M = 40.01 g/mol
71
Potassium hydroxide solution
KOH, M = 56.11 g/mol
72
KOH, M = 56.11 g/mol
73
Ammonia
NH3 , M = 17.03 g/mol
74
Commercially available concentrations
of some acids and bases
Name weight% Density Concen
20° tration
d
4° in mol/L
Acetic acid 96 1.05 17
Acetic acid (glacial acetic acid) 99 – 100 1.05 17.5
Acetic acid 60 1.06 10.5
Acetic acid 30 1.04 5
Ammonia solution 32 0.88 16.5
Ammonia solution 30 0.90 16
Ammonia solution 25 0.90 13.5
Formic acid 98 – 100 1.22 26
Hydriodic acid 57 1.7 7.5
Hydrobromic acid 47 1.49 8.5
Hydrochloric acid 25 1.12 7.5
Hydrochloric acid 32 1.16 10
Hydrochloric acid, fuming 37 1.19 12
Hydrofluoric acid 48 1.16 28
Hydrofluoric acid 40 1.13 22.5
Nitric acid 65 1.39 14.5
Nitric acid 69 1.41 15.5
Example
145
145 – = 43.60°Bé
density
75
04
Indicators and buffers
pH indicators 78
Buffer solutions 80
pKa values of selected biological buffers 82
Buffer ranges 83
pH-indicators
0 1 2 3
Ord. Material name pH value and
No. color change
105225 Cresol red pink brown
106798 4-Nitrophenol
106794 3-Nitrophenol
106246 1-Naphtholphthalein
106202 1-Naphtholbenzein
107233 Phenolphthalein
108175 Thymolphtalein
78
4 5 6 7 8 9 10 11 12 13 14
red
blue - violet
orange - red
orange - yellow
reen blue
reen blue
yellow purple
colorless yellow
yellow blue
yellow blue
colorless yellow
pinkbrownish blue
apricot turquoiseblue
colorless red - violet
colorless blue
blue - violet dark - pink
yellow orange
79
Buffer solutions
Prepare stock and buffer solutions with distilled, boiled, CO2-free water.
No. Stock solutions and their content of buffer substance Composition
of buffer
A B solution
1 Glycine 0.1 mol/L + NaCl 0.1 mol/L HCl 0.1 mol/L x parts A +
[Glycine: 7.507 g/L + NaCl: 5.844 g/L] (100-x) parts B
2 di-Sodium citrate 0.1 mol/L HCl 0.1 mol/L x parts A +
[Citric acid monohydrate: (100-x) parts B
21.014 g/L + 200 mL NaOH 1 mol/L]
3 Potassium hydrogen phthalate L HCl 0.1 mol/L 50 mL A + x mL B
0.1 mol/L [C8H5KO4: 20.42 g/L] make up to 100 mL*
4 As No. 3 NaOH 0.1 mol/L 50 mL A + x mL B
make up to 100 mL*
5 As No. 2 NaOH 0.1 mol/L x parts A +
(100-x) parts B
6 Potassium dihydrogen phosphate di-Sodium x parts A +
1/15 mol/L [KH2PO4: 9.073 g/L] hydrogen (100-x) parts B
[Na2HPO4 · 2 H2O: 11.87 g/L] phosphate
1/15 mol/L
7 5.5-Diethylbarbituric acid HCl 0.1 mol/L x parts A +
sodium salt 0.1 mol/L (100-x) parts B
[Barbital-Na: 20.62 g/L]
8 Borax solution 0.05 mol/L HCl 0.1 mol/L x parts A +
[H3BO3: 12.37 g/L + 100 mL NaOH (100-x) parts B
1 mol/L]
9 As No. 1 NaOH 0.1 mol/L x parts A +
(100-x) parts B
10 Citric acid 0.1 mol/L di-Sodium hydrogen x parts A +
[Citric acid monohydrate: 21.014 g/L] phosphate 0.2 mol/L (100-x) parts B
[Na2HPO4 · 2 H2O: 35.60 g/L]
11 Sodium acetate 0.1 mol/L Acetic acid x parts A +
[C2H3O2Na: 8.204 g/L or 0.1 mol/L (100-x) parts B
C2H3O2Na · 3 H2O: 13.61 g/L]
12 Imidazole 0.2 mol/L HCl 0.1 mol/L 25 mL A + x mL B,
[C3H4N2: 13.62 g/L] make up to 100 mL*
13 Triethanolamine 0.5 mol/L + HCl 0.05 mol/L 10 mL A + x mL B,
Titriplex® III make up to 100 mL*
[C6H15NO3: 74.60 g/L +
Titriplex® III: 20 g/L]
14 Tris(hydroxymethyl)aminomethane HCl 0.1 mol/L 25 mL A + x mL B,
0.2 mol/L [TRIS: 24.23 g/L] make up to 100 mL*
15 Sodium carbonate 0.1 mol/L Sodium hydrogen x parts A +
(10.60 g/L) [Na2CO3: 10.60 g/L] carbonate (100-x) parts B
[NaHCO3: 8.401 g/L] 0.1 mol/L
80
Indicators and buffers
CertiPUR®-Buffer Sachets for
calibration of pH instruments!
81
pKa values of selected biological buffers
Buffer pKa (4°C) pKa (20°C) pKa (25°C) pKa (37°C) pKa/°C
82
Buffer ranges
Buffer
Glycine / HCl
Citric acid / Na-citrate
Acetic acid / Na-acetate
KH2PO4 / Na2HPO4
MES
BIS-TRIS
ADA
ACES
PIPES
Imidazole / HCl
BES
MOPS
HEPES
TES
TRIS / HCl
HEPPS
83
05
Analytical
chromatography
Thin-layer chromatography 86
Analytical HPLC 88
Specification of column sorbents 90
LC Troubleshooting 94
Sample preparation 100
Thin-layer chromatography
Thin-layer chromatography is a simple, fast and highly versatile separation tool
for both qualitative and quantitative analysis. The field of application covers
virtually all classes of substances including pesticides, steroids, alkaloids, lipids,
nucleotides, glycosides, carbohydrates, fatty acids and many others.
www.merckmillipore.com/chromatography
86
Aluminium and plastic backed
plates can be cut to smaller size to
reduce the cost of analysis.
Analytical chromatography
silica gel 60 plate under identical
conditions. The comparison clearly
demonstrates that the HPTLC plate
delivers sharper zones with shorter
migration distances and hence run-
ning times. In addition the HPTLC
plate allows the separation of twice
the number of samples simultane-
ously.
Compounds:
1. N-alpha-dansyl-L-arginine
2. alpha-dansyl-L-arginine
3. Dansyl-L-cysteic acid
4. N-Dansyl-glycine
5. Dansyl-glycine
6. N-N-Didansyl-L-tyrosine
Migration
distance: TLC 10 cm; HPTLC 5 cm
Analysis time: TLC 42 min;
HPTLC 13 min 45 sec
Detection: UV 366
87
Analytical HPLC
www.merckmillipore.com/analytical-hplc
88
Purospher® HPLC columns are based upon a high-purity silica for
excellent separations with very good peak symmetry. The base material for
Purospher® high-purity HPLC columns consists of tetra-alkoxysilane.
Due to the absence of heavy metals in the silica matrix and in combination
with a complete coverage of the silica surface, this stationary phase
enables tailing-free chromatography of acidic, basic and chelating com-
pounds. This is of particular advantage for method development.
Thanks to its outstanding performance and stability, Purospher® STAR
RP-18 endcapped is the most versatile column in the Purospher® range.
Robust methods can be developed across the entire pH spectrum from 1.5
to 10.5 enabling the use of the complete range of mobile phases and
temperatures. In addition Purospher® STAR RP-18 endcapped, 2 µm and
3 µm UHPLC columns speed separation up to 10 times and save up to
84.5 % solvent.
Analytical chromatography
ZIC®-HILIC technology is based on a stationary phase with a covalently
bonded, highly polar zwitterionic functional group that provides higher
stability and more robust HILIC separations than conventional silica or
amino phases.
IC
RPLC ZIC®-HILIC
89
Specifications of column sorbents
Polar stationary phases (normal phase chromatography)
(shipping eluent: n-Heptane / Dioxane (99/1))
90
Particle Pore Pore Spec. surface area
size in µm size in Å volume in mL/g in m2/g
5, 7, 10 60 0.75 500
5, 7, 10 100 1.0 300
5, 10 60 0.85 700
5, 10 100 1.25 400
10 300 0.78 60
10 1000 0.78 30
10 4000 0.78 10
4 60 0.85 700
5 120 1.1 330
monolithic 130 1 300
Analytical chromatography
91
Specifications of column sorbents
Non-polar stationary phases (reversed phase chromatography)
(shipping eluent: acetronitrile / water)
92
Particle Pore Pore Spec. Carbon Surface
size in µm size in Å volume surface content coverage
in mL/g in m2/g in % in µmol/m2
5, 7, 10 100 1.0 300 9.5 3.4
Analytical chromatography
5, 10 100 1.25 350 21.6 4.09
93
LC Troubleshooting
94
Solution
Change precolumn
Change filter of column head; flush column; change column
Change capillary
Checkpump; check frit; check mobil phase composition; fix leak
Check sample injection system
Flush column
Flush column with strong eluent
Flush column; improve sample cleanup; use HPLC-grade solvents
Use column thermostat
Analytical chromatography
interference sources
Use longer run-time; flush column with strong solvent after each run;
improve sample cleanup; use gradient elution
Improve sample cleanup
Flush column with strong solvent after each run; improve sample cleanup
Use HPLC-grade solvents
Dissolve sample in mobil phase
Prepare fresh daily; use antioxidant
Change precolumn
Change column
95
LC Troubleshooting
Silanol interactions
Temperature decreasing
Decreasing retention times Flow rate is increasing
Column overload
Loss of bonded stationary phase
Mobile phase composition changing
Temperature increasing
Column ageing
96
Solution
Use shorter capillaries with smaller i.D.; check for dead volume
Use column with smaller particles
Decrease sample size; increase column diameter; use higher capacity
stationary phase
Improve sample cleanup; adjust mobile phase;
check column with test mixture; use HPLC-grade solvents
Use modifier (triethylamine); increase buffer or salt concentration (ion-pair-
chromatography); lower mobil phase pH; use base deactivated column
Analytical chromatography
Replace frit; add in-line filter; filter samples
Check capillary connections
Replace column; use less aggressive conditions
Reduce sample volume; dilute sample; inject sample prepared in mobil phase
Dissolve sample in mobile phase or (if not possible) inject very small sample
volume (1 µL)
Replace column; use less aggressive conditions
Replace frit; add in-line filter; filter samples
Replace injecto rotor
Fix leaks; replace pump seals; remove bubbles; check for cavitation
Use mobile phase modifier; add triethylamine; use base-deactivated column
Keep mobile phase pH between 2 and 7.5
Check pump; check frit; avoid evaporation or
degradation of mobile phase
Use column thermostat
Check pump; check flow
Decrease sample size
Keep mobile phase pH between 2 and 7.5
Check pump; check frit; avoid evaporation or degradation of mobile phase
Use column thermostat
Replace column; use guard column
97
LC Troubleshooting
Temperature varying
Column to column reproducibility
98
Solution
Fix leaks; replace pump seals; remove bubbles; check for phase
Equilibrate with at least 10 column volume of mobile phase
Use buffer concentration > 20 mM and < 50 mM
Check pump; check frit; avoid evaporation or degradation of mobile phase
Analytical chromatography
use HPLC-grade solvent
Use column thermostat
Replace column; check with manufacturer
99
Sample preparation
The more complicated the matrix, the more important the sample
preparation! The better the sample preparation, the simpler the subsequent
chromatographic separation!
100
Routine laboratory work involves purifying, enriching or separating for
subsequent analysis. The number of samples to be analysed is constantly on
the increase: Comprehensive control of the most important parameters helps
to ensure product quality, prevent damage and maintain quality of life. In
order to be able to utilise the possibilities offered by instrument analysis, the
sample must be optimally prepared. This is often the most time consuming
and critical step of the entire analysis. Selective and specific sample prepara-
tion ensures rational, economic and meaningful analysis.
Analytical chromatography
quantitatively determined in the required concentration range.
101
06
Organic solvents
Organic solvents properties and drying agents 104
Sustainable Solvent Alternatives 108
Density of Ethanol – Water mixtures 110
Drying agents 111
Solvents for organic instrumental analysis 112
Solvents for infrared spectroscopy | transmittances 114
Organic solvents properties and drying agents
104
MAC (2) Drying agent (1)
ppm mg/m3
10 25 CuSO4
5 21 –
500 1200 K2CO3; Molecular sieve 0.3 nm
20 34 CaCl2; P2O5; K2CO3; Molecular sieve 0.3 nm
2 7,7 KOH; Molecular sieve 0.5 nm
– – CaCl2; Distillation; Na; CaH2; Molecular sieve 0.5 nm
– – CaCl2; Na; Distillation; Molecular sieve 0.5 nm; CaH2
100 310 K2CO3; Distillation; Molecular sieve 0.4 nm
– – K2CO3; Distillation; Molecular sieve 0.5 nm
20 62 CaO; Freezing; Molecular sieve 0.5 nm
100 480 MgSO4; Molecular sieve 0.4 nm
5 16 CaCl2; P2O5
10 47 CaCl2; Distillation; Molecular sieve 0.5 nm
le 0.5 2.5 CaCl2; Molecular sieve 0.4 nm; P2 05
200 700 CaCl2; KOH; Molecular sieve 0.4 nm; Molecular sieve 0.5 nm
Organic solvents
5 29 –
le 50 180 CaCl2; Molecular sieve 0.4 nm
– – –
5 28 CaCl2; Na; CaH2; Molecular sieve 0.5 nm
400 1200 CaCl2; CaH2; LiAlH4; Molecular sieve 0.4 nm; Na
200 850 CaCl2; CaH2; Molecular sieve 0.4 nm; Na
5 15 Distillation; Molecular sieve 0.4 nm; CaH2
50 160 Distillation; Molecular sieve 0.3 nm; CaH2
20 73 CaCl2; Na; Molecular sieve 0.4 nm; CaH2
500 960 CaO; Mg; MgO; Molecular sieve 0.3 nm
200 750 K2CO3; P2O5; Na2SO4; Molecular sieve 0.4 nm
10 26 Distillation; Na2SO4; Molecular sieve 0.4 nm
1 3.2 Distillation
100 300 MgSO4; Na2SO4; Molecular sieve 0.4 nm
– – Na2SO4; CaO; Molecular sieve 0.3 nm
– 200E Distillation
le –
50 180 CaH2; LiAIH4; Molecular sieve 0.4 nm; Na
100 310 K2CO3; CaO; Mg; Ca; Molecular sieve 0.4 nm
20 83 CaCl2; K2CO3; Molecular sieve 0.5 nm
200 270 Mg; CaO; Molecular sieve 0.3 nm, MgO
100 310 K2CO3; CaO; Molecular sieve 0.4 nm
20 82 –
200 600 K2CO3; Molecular sieve 0.4 nm
0.1 0.51 CaCl2; Distillation; Molecular sieve 0.5 nm; P2O5
105
Solvent Boiling Density Refractive Flash
point in °C d 20° index in n 20° point in °C
4° D
n-Pentane ca. 36 0.63 1.358 – 48
1-Propanol 96.5 – 98 0.80 1.385 + 15
2-Propanol 82.4 0.786 1.378 + 12
Pyridine 115 0.982 1.510 + 17
Tetrahydrofuran 65 – 66 0.89 1.405 – 21.5
Tetrahydronaphthalene (Tetralin) 200 –209 0.97 1.541 + 71–77
Toluene 110.6 0.87 1.494 +4
Trichloroethylene 87 1.46 1.477 non-flammable
Xylene (isomeric mixture) 136 –145 0.87 ~ 1.50 + 24
Substances for which no MAC value is given have not been classified by the
German Senate Commission on hazardous materials, though this fact is not to
be construed as meaning that the substances carry no risk.
106
MAC (2) Drying agent (1)
ppm mg/m3
– – CaH2; Molecular sieve 0.4 nm; Na
– – CaO; Mg; MgO; Molecular sieve 0.4 nm
200 500 CaO; Mg; Molecular sieve 0.3 nm
– – Molecular sieve 0.3 nm; CaO; Mg; MgO
50 150 Molecular sieve 0.4 nm; CaH2; KOH
2 11 –
50 190 CaCl2; CaH2; Distillation; Molecular sieve 0.4 nm; Na
– – Distillation; K2CO3; Molecular sieve 0.5 nm; Na2SO4
100 440 CaCl2; CaH2; Distillation; Molecular sieve 0.4 nm; Na
Organic solvents
107
Sustainable Solvent Alternatives
The products we create help our customers improve people's lives every day, but
we recognize that every product we make also has an environmental impact.
That's why we are committed to continually improving the sustainability perfor-
mance of our products and adopting a greener chemical process.
Benefits
Produced from renewable sources
Reliable availability (supply risk uncoupled from petrochemical production)
Less solvent needed due to more efficient extraction and higher reaction yields
Lower volatility and higher flash point increase user safety
Limited miscibility in water reduces waste stream
Ordering Information
Product Description Pack size and material Ord. No.
1 L GL 1.08292.1000
2-Methyltetrahydrofuran
EMPLURA® 2.5 L GL 1.08292.2500
4 L GL 1.08292.4000
GL = glass bottle
108
www.SigmaAldrich.com/
greener-solvents
Ethyl lactate
Ethyl lactate is a safer and more sustainable alternative to ethyl acetate
and acetone. It is an ester of natural L-lactic acid, which is produced by
fermentation of sugar.
Benefits
Increased user safety due to less toxicity (non-carcinogenic)
No waste due to 100 % biodegradability
Non-corrosive in contact with metals
Ordering Information
Product Description Pack size and material Ord. No.
1 L GL 1.09639.1000
Ethyl lactate EMPLURA® 2.5 L GL 1.09639.2500
4 L GL 1.09639.4000
GL = glass bottle
Organic solvents
Cyclopentyl methyl ether is a greener substitute for
tetrahydrofuran, tert-butyl methyl ether, 1,4 dioxane
and other ether solvents. It is produced by an 100%
atomic catalytic reaction without any formation of by-products.
Benefits
Resistance to peroxide formation improves
laboratory safety
One-step reaction saves energy and reduces waste water
More stable than tetrahydrofuran
More hydrophobic solvent increases yields and selectivity
Limited miscibility in water reduces waste stream
Ordering Information
Product Description Pack size and material Ord. No.
1 L GL 1.08293.1000
Cyclopentyl methyl ether
EMPLURA® 2.5 L GL 1.08293.2500
4 L GL 1.08293.4000
GL = glass bottle
109
Density of Ethanol – Water mixtures
0 0.99820 0 0.99705
5 0.98935 5 0.98814
10 0.98184 10 0.98040
15 0.97511 15 0.97331
20 0.96861 20 0.96636
25 0.96165 25 0.95892
30 0.95379 30 0.95064
35 0.94491 35 0.94143
40 0.93515 40 0.93145
45 0.92469 45 0.92082
50 0.91381 50 0.90982
55 0.90255 55 0.89847
60 0.89110 60 0.88696
65 0.87945 65 0.87524
70 0.86763 70 0.86337
75 0.85561 75 0.85131
80 0.84341 80 0.83908
85 0.83093 85 0.82658
90 0.81795 90 0.81360
95 0.80422 95 0.79989
100 0.78932 100 0.78504
110
Drying agents
Organic solvents
Magnesium Mg Inert gases, air, Organic substance 0.0005 – 0.002
perchlorate (ClO4)2 ammonia (explosion hazard)
111
Solvents for organic instrumental analysis
112
Dielectric Dipole ° against Flow coefficient x in mm2/s DC- UV Ord. No.
constant moment Al2O3 (1) (silica gel 60 precoated plate) cut-off
(1)
(22°C) (2)
[DK] Migration distance in nm LiChrosolv® Uvasol®
(20 / 25°C) (50 mm) (70 mm) (100 mm)
1.9 0 0.01 9.2 10.6 11.4 200 104390 104366
1.9 0 0.01 12.5 13.9 14.6 195 104391 104372
2.0 0 0.04 5.4 6.3 6.7 200 102827 102822
2.0 0 0.09 12.5 13.9 14.6 195 104335 –
1.9 0 0.01 7.9 8.3 8.7 215 104717 104718
2.4 0.36 0.29 8.3 9.3 11.0 284 108327 108331
– – 0.2 – – – 210 101845 101984
2.28 0 0.32 – – – 280 101768 –
7.15 1.74 0.26 – – – 220 101692 –
4.8 1.01 0.40 9.0 10.5 11.6 245 102444 102447
9.1 1.60 0.42 10.1 11.8 13.2 232 106044 106048
10.6 1.75 0.44 7.6 8.4 8.9 230 113713 –
17.8 1.66 0.7 – – – 265 101988 101989
7.4 1.63 0.57 10.9 11.9 12.6 212 108101 108110
Organic solvents
18.3 1.66 0.82 2.1 2.3 2.5 205 101040 100993
6.0 1.78 0.59 9.2 10.9 12.1 256 100868 100863
2.2 0.40 0.56 5.2 6.0 6.5 215 103132 –
24.3 1.70 0.88 3.4 3.9 4.2 210 111727 100980
20.7 2.88 0.56 12.7 14.7 16.2 330 100020 100022
37.5 3.92 0.65 12.6 14.0 15.4 190 100030 100016
32.6 1.70 0.95 5.6 6.5 7.1 205 106007 106002
80.2 1.85 – 5.1 5.7 5.8 – 115333 –
42.1 108262
LiChrosolv® Acetonitrile
gradient grade for liquid
chromatography in 1, 2.5
and 4 L glass bottles.
113
Solvents for infrared spectroscopy | transmittances
The colored bars mark the windows in the IR range in which the transmittance
of the solvent is higher than 25 %.
Product Uvasol®
Ord. No.
Acetone 100022
Acetonitrile 100016
Benzol
1-Butanol 101989
Carbon tetrachloride
Chloroform 102447
Cyclohexane 102822
Dichloroethane
Dichloromethane 106048
Dioxane
n-Hexane 104372
Paraffin liquid
n-Pentane 107179
Tetrachloroethene
Tetrachloroethylene 100965
Tetrahydrofuran 108110
Trichloromethane
Trichlorotrifluoroethane 108239
114
Organic solvents
115
07
Physical methods for the
deTermination of elements
Flame photometry 118
Wavelength and wave number 118
Photometry – transmission rate and absorbance 118
Calculation of the standard deviation 118
Direct-current polarography 119
Cathode ray polarography 119
Flame photometry
Important emission lines in the flame spectra of some elements
1) = Flame Emission
(B) = Band of the oxide
(D) = Dual line, the center point between the two lines is given
(G) = Group of lines in the region of the stated wavelength
118
Direct-current polarography
Half-wave potentials of some important metals
119
08
Mass and Weight
Energy dimensions – conversion factors 122
Pressure dimensions – conversion factors 122
Decimal units multiplies and subdivisions 123
Concentrations 123
Basic units 123
Derived units with conversion of previous units 124
US and British measuring units 128
Energy dimensions – conversion factors
1 N·m -2
1 10–5
9.8692 1.019710 7.50062 1.45038
1 Pa (1) ·10-6 ·10-1 ·10–3 ·10-4
1 bar (1) 105 1 9.8692 1.019716 750.062 14.5038
·104
122
Concentrations
Basic units
123
Derived units with conversion of previous units
124
Size SI unit Symbol Further units Relationship
Name
Name Symbol
Time
Time second s
Time interval
minute min 1 min = 60 s
hour h 1h = 60 min
day d 1d = 24 h
Frequency Hertz Hz 1 Hz = 1 s-1
Velocity Meter
per
second m·s–1
Kilometer
per
hour km·h-1 1 km·h-1
= 1 m·s-1
3.6
Viscosity
125
Size SI unit Symbol Further units Relationship
Name
Name Symbol
126
Size SI unit Symbol Further units Relationship
Name
Name Symbol
Ionizing radiation
Activity Becquerel Bq 1 Bq = 1 s-1
Curie Ci 1 Ci = 37 G Bq
Enzymatic activity
Enzymatic Katal kat 1 kat
activity = 1 mol·s-1
= 60 mol·min-1
Enzyme U 1U
unit = 1 mol·s-1
= 1 µkat
60
= 16.67 nkat
127
US and British measuring units
Conversion to metric units
Volume
Liters x 0.2642 = US gallons
US gallons x 3.785 = Liters
Imperial gallons x 1.201 = US gallons
Imperial gallons x 4.546 = Liters
US gallons x 0.8327 = Imperial gallons
Cubic meters x 35.31 = Cubic feet
Cubic feet x 0.0283 = Cubic meters
Cubic meters x 264.2 = US gallons
US gallons x 0.00379 = Cubic meters
Length
Meters x 3.281 = Feet
Feet x 0.3048 = Meters
Meters x 39.37 = Inches
Inches x 0.0254 = Meters
Centimeters x 0.3937 = Inches
Inches x 2.540 = Centimeters
Millimeters x 0.0394 = Inches
Inches x 25.4 = Millimeters
Weight
Kilograms x 2.2046 = Pounds
Pounds x 0.4536 = Kilograms
Tons (long) x 1016.05 = Kilograms
Tons (long) x 2240 = Pounds
Tonnes (metr.) x 1000 = Kilograms
Tonnes (metr.) x 2204.6 = Pounds
Tons (short) x 907.185 = Kilograms
Tons (short) x 2000 = Pounds
Grams x 15.432653 = Grains
Grains x 0.0647989 = Grams
Grams x 0.0352740 = Ounces (US)
Ounces (US) x 28.349527 = Grams
Ounces (troy) x 31.1035 = Grams
128
US and British measuring units
Conversion to metric units
Temperature required in
a·8 a · 9 + 32
a °Centigrade –
10 5
b · 10 b · 9 + 32
b °Réaumur –
8 4
(c – 32) · 10 (c – 32) · 8
c °Fahrenheit –
18 18
°C °F °C °F °C °F °C °F °C °F °C °F
– 40 – 40 +5 41 50 122 95 203 140 284 185 365
– 35 – 31 10 50 55 131 100 212 145 293 190 374
– 30 – 22 15 59 60 140 105 221 150 302 195 383
– 25 – 13 20 68 65 149 110 230 155 311 200 392
– 20 –4 25 77 70 158 115 239 160 320 210 410
– 15 +5 30 86 75 167 120 248 165 329
129
09
Other useful tables
Physical constants 132
NMR Chemical Shifts of Common
Synthetic Trace Impurities 133
Greek alphabet 136
Greek numbers / Roman numbers 137
Freezing mixtures 138
Extran® laboratory cleaning agents 138
Particle sizes 140
NMR: Carbon (13C) chemical shifts 142
NMR: Proton chemical shifts 144
Miscibility table 146
Periodic table of the elements 148
Physical constants
132
NMR Chemical Shifts of Common Synthetic Trace Impurities
This table is to support you in identifying and separating NMR signals of impurities
that might originate from residual solvents or from your reaction apparatus. Here we
present the NMR shifts of the most commonly used solvents and impurities organic
synthesis - measured in the 7 most frequently used deuterated solvents. Please note that
the values given in the tables are temperature- and partly concentration-dependent
and therefore represent average values only. The 1H-NMR data were obtained using a
300 MHz spectrometer, the 13C-NMR data using 75 MHz.
'H NMR Data proton mult CDCl3 (CD3)2CO (CD3)2SO C6D6 CD3CN CD3OD D2O
Solvent residual 7.26 2.05 2.50 7.16 1.94 3.31 4.79
peak
H2O s 1.56 2.84 3.33 0.40 2.13 4.87
Acetic acid CH3 s 2.10 1.96 1.91 1.55 1.96 1.99 2.08
Acetone CH3 s 2.17 2.09 2.09 1.55 2.08 2.15 2.22
Acetonitrile CH3 s 2.10 2.05 2.07 1.55 1.96 2.03 2.06
Benzene CH s 7.36 7.36 7.37 7.15 7.37 7.33
Tert-butyl CH3 s 1.28 1.18 1.11 1.05 1.16 1.40 1.24
alcohol OH s 4.19 1.55 2.18
Tert-butyl CCH3 s 1.19 1.13 1.11 1.07 1.14 1.15 1.21
methyl ether OCH3 s 3.22 3.13 3.08 3.04 3.13 3.20 3.22
BHTa ArH s 6.98 6.96 6.87 7.05 6.97 6.92
OH s 5.01 6.65 4.79 5.20
ArCH3 s 2.27 2.22 2.18 2.24 2.22 2.21
ArC(CH3)3 s 1.43 1.41 1.36 1.38 1.39 1.40
Chloroform CH s 7.26 8.02 8.32 6.15 7.58 7.90
Cyclohexane CH2 s 1.43 1.43 1.40 1.40 1.44 1.45
1,2-dichloroe- CH2 s 3.73 3.87 3.90 2.90 3.81 3.78
thane
Dichloro- CH2 s 5.30 5.63 5.76 4.27 5.44 5.49
methane
Diethyl ether CH3 t, 7 1.21 1.11 1.09 1.11 1.12 1.18 1.17
CH2 q, 7 3.48 3.41 3.38 3.26 3.42 3.49 3.56
Diglyme CH2 m 3.65 3.56 3.51 3.46 3.53 3.61 3.67
CH2 m 3.57 3.47 3.38 3.34 3.45 3.58 3.61
OCH3 s 3.39 3.28 3.24 3.11 3.29 3.35 3.37
1,2-dimethoxy- CH3 s 3.40 3.28 3.24 3.12 3.28 3.35 3.37
ethane CH2 s 3.55 3.46 3.43 3.33 3.45 3.52 3.60
Dimethylacet- CH3CO s 2.09 1.97 1.96 1.60 1.97 2.07 2.08
amide NCH3 s 3.02 3.00 2.94 2.57 2.96 3.31 3.06
NCH3 s 2.94 2.83 2.78 2.05 2.83 2.92 2.90
Dimethylforma- CH s 8.02 7.96 7.95 7.63 7.92 7.97 7.92
mide CH3 s 2.96 2.94 2.89 2.36 2.89 2.99 3.01
CH3 s 2.88 2.78 2.73 1.86 2.77 2.86 2.85
Dimethyl CH3 s 2.62 2.52 2.54 1.68 2.50 2.65 2.71
sulfoxide
Dioxane CH2 s 3.71 3.59 3.57 3.35 3.60 3.66 3.75
Ethanol CH3 t, 7 1.25 1.12 1.06 0.96 1.12 1.19 1.17
CH2 q, 7 3.72 3.57 3.44 3.34 3.54 3.60 3.65
OH s 1.32 3.39 4.63 2.47
Ethyl CH3CO s 2.05 1.97 1.99 1.65 1.97 2.01 2.07
acetate CH2CH3 q, 7 4.12 4.05 4.03 3.89 4.06 4.09 4.14
CH2CH3 t, 7 1.26 1.20 1.17 0.92 1.20 1.24 1.24
Ethyl methyl CH3CO s 2.14 2.07 2.07 1.58 2.06 2.12 2.19
ketone CH2CH3 q, 7 2.46 2.45 2.43 1.81 2.43 2.50 3.18
CH2CH3 t, 7 1.06 0.96 0.91 0.85 0.96 1.01 1.26
Ethylene glycol CH s 3.76 3.28 3.34 3.41 3.51 3.59 3.65
133
'H NMR Data proton mult CDCl3 (CD3)2CO (CD3)2SO C6D6 CD3CN CD3OD D2O
“Grease” CH3 m 0.86 0.87 0.92 0.86 0.88
CH2 br s 1.26 1.29 1.36 1.27 1.29
N-hexane CH3 t 0.88 0.88 0.86 0.89 0.89 0.90
CH2 m 1.26 1.28 1.25 1.24 1.28 1.29
HMPA CH3 d, 2.65 2.59 2.53 2.40 2.57 2.64 2.61
9.5
Methanol CH3 s 3.49 3.31 3.16 3.07 3.28 3.34 3.34
OH s 1.09 3.12 4.01 2.16
Nitromethane CH3 s 4.33 4.43 4.42 2.94 4.31 4.34 4.40
n-pentane CH3 t, 7 0.88 0.88 0.86 0.87 0.89 0.90
CH2 m 1.27 1.27 1.27 1.23 1.29 1.29
2-propanol CH3 d, 6 1.22 1.10 1.04 0.95 1.09 1.50 1.17
CH sep, 4.04 3.90 3.78 3.67 3.87 3.92 4.02
6
Pyridine CH(2) m 8.62 8.58 8.58 8.53 8.57 8.53 8.52
CH(3) m 7.29 7.35 7.39 6.66 7.33 7.44 7.45
CH(4) m 7.68 7.76 7.79 6.98 7.73 7.85 7.87
Silicone grease CH3 s 0.07 0.13 0.29 0.08 0.10
Tetrahydrofuran CH2 m 1.85 1.79 1.76 1.40 1.80 1.87 1.88
CH2O m 3.76 3.63 3.60 3.57 3.64 3.71 3.74
Toluene CH3 s 2.36 2.32 2.30 2.11 2.33 2.32
CH(o/p) m 7.17 7.1 – 7.2 7.18 7.02 7.1 – 7.3 7.16
CH(m) m 7.25 7.1 – 7.2 7.25 7.13 7.1 – 7.3 7.16
Triethylamine CH3 t, 7 1.03 0.96 0.93 0.96 0.96 1.05 0.99
CH2 q, 7 2.53 2.45 2.43 2.40 2.45 2.58 2.57
a
2,6-Dimethyl-4-tert-butylphenol, bHexamethylphosophoramide
C NMR Data
13
CDCl3 (CD3)2CO (CD3)2SO C6D6 CD3CN CD3OD D2O
Solvent signals 77.16 29.84 ± 0.01 39.52 128.06 1.32 ±0.02 49.00
± 0.06 206.26 ± 0.13 ± 0.06 ±0.02 118.26 ±0.02 ±0.01
Acetic acid CO 175.99 172.31 171.93 175.82 173.21 175.11 177.21
CH3 20.81 20.51 20.95 20.37 20.73 20.56 21.03
Acetone CO 207.07 205.87 206.31 204.43 207.43 209.67 215.94
CH3 30.92 30.60 30.56 30.14 30.91 30.67 30.89
Acetonitrile CN 116.43 117.60 117.91 116.02 118.26 118.06 119.68
CH3 1.89 1.12 1.03 0.20 1.79 0.85 1.47
Benzene CH 128.37 129.15 128.30 128.62 129.32 129.34
Tert-butyl C 69.15 68.13 66.88 68.19 68.74 69.40 70.36
alcohol CH3 31.25 30.72 30.38 30.47 30.68 30.91 30.29
Tert-butyl CCH3 49.45 49.35 48.70 49.19 49.52 49.66 49.37
methyl C 72.87 72.81 72.04 72.40 73.17 74.32 75.62
ether CCH3 26.99 27.24 26.79 27.09 27.28 27.22 26.60
BHT C(1) 151.55 152.51 151.47 152.05 152.42 152.85
C(2) 135.87 138.19 139.12 136.08 138.13 139.09
CH(3) 125.55 129.05 127.97 128.52 129.61 129.49
C(4) 128.27 126.03 124.85 125.83 126.38 126.11
CH3Ar 21.20 21.31 20.97 21.40 21.23 21.38
CH3C 30.33 31.61 31.25 31.34 31.50 31.15
C 34.25 35.00 34.33 34.35 35.05 35.36
Chloroform CH 77.36 79.19 79.16 77.79 79.17 79.44
Cyclohexane CH2 26.94 27.51 26.33 27.23 27.63 27.96
1,2-dichloroe- CH2 43.50 45.25 45.02 43.59 45.54 45.11
thane
Dichloromethane CH2 53.52 54.95 54.84 53.46 55.32 54.78
134
C NMR Data
13
CDCl3 (CD3)2CO (CD3)2SO C6D6 CD3CN CD3OD D2O
Diethyl ether CH3 15.20 15.78 15.12 15.46 15.63 15.46 14.77
CH2 65.91 66.12 62.05 65.94 66.32 66.88 66.42
Diglyme CH3 59.01 58.77 57.98 58.66 58.90 59.06 58.67
CH2 70.51 71.03 69.54 70.87 70.99 71.33 70.05
CH2 71.90 72.63 71.25 72.35 72.63 72.92 71.63
1,2-dimethoxy- CH3 59.08 58.45 58.01 58.68 58.89 59.06 58.67
ethane CH2 71.84 72.47 17.07 72.21 72.47 72.72 71.49
Dimethylacet- CH3 21.53 21.51 21.29 21.16 21.76 21.32 21.09
amide CO 171.07 170.61 169.54 169.95 171.31 173.32 174.57
NCH3 35.28 34.89 37.38 34.67 35.17 35.50 35.03
NCH3 38.13 37.92 34.42 37.03 38.26 38.43 38.76
Dimethylforma- CH 162.62 162.79 162.29 162.13 163.31 164.73 165.53
mide CH3 36.50 36.15 35.73 35.25 36.57 36.89 37.54
CH3 31.45 31.03 30.73 30.72 31.32 31.61 32.03
Dimethyl CH3 40.76 41.23 40.45 40.03 41.31 40.45 39.39
sulfoxide
Dioxane CH2 67.14 67.60 66.36 67.16 67.72 68.11 67.19
Ethanol CH3 18.41 18.89 18.51 18.72 18.80 18.40 17.47
CH2 58.28 57.72 56.07 57.86 57.96 58.26 58.05
Ethyl acetate CH3CO 21.04 20.83 20.68 20.56 21.16 20.88 21.15
CO 171.36 170.96 170.31 170.44 171.68 172.89 175.26
CH2 60.49 60.56 59.74 60.21 60.98 61.50 62.32
CH3 14.19 14.50 14.40 14.19 14.54 14.49 13.92
Ethyl methyl CH3CO 29.49 29.30 29.26 28.56 29.60 29.39 29.49
ketone CO 209.56 208.30 208.72 206.55 209.88 212.16 218.43
CH2 CH3 36.89 36.75 35.83 36.36 37.09 37.34 37.27
CH2 CH3 7.86 8.03 7.61 7.91 8.14 8.09 7.87
Ethylene glycol CH2 63.79 64.26 62.76 64.34 64.22 64.30 63.17
“Grease” CH2 29.76 30.73 29.20 30.21 30.86 31.29
N-hexane CH3 14.14 14.34 13.88 14.32 14.43 14.45
CH2(2) 22.70 23.28 22.05 23.04 23.40 23.68
CH2(3) 31.64 32.30 30.95 31.96 32.36 32.73
HMPA CH3 36.87 37.04 36.42 36.88 37.10 37.00 36.46
Methanol CH3 50.41 49.77 48.59 49.97 49.90 49.86 49.50
Nitromethane CH3 62.50 63.21 63.28 61.16 63.66 63.08 63.22
N-pentane CH3 14.08 14.29 13.28 14.25 14.37 14.39
CH2(2) 22.38 22.98 21.70 22.72 23.08 23.38
CH2(3) 34.16 34.83 33.48 34.45 34.89 35.30
2-propanol CH3 25.14 25.67 25.43 25.18 25.55 25.27 24.38
CH 64.50 63.85 64.92 64.23 64.30 64.71 64.88
Pyridine CH(2) 149.90 150.67 149.58 150.27 150.76 150.07 149.18
CH(3) 123.75 124.57 123.84 123.58 127.76 125.53 125.12
CH(4) 135.96 136.56 136.05 135.28 136.89 138.35 138.27
Silicone grease CH3 1.04 1.40 1.38 2.10
Tetrahydrofuran CH2 25.62 26.15 25.14 25.72 26.27 26.48 25.67
CH2O 67.97 68.07 67.03 67.80 68.33 68.83 68.68
Toluene CH3 21.46 21.46 20.99 21.10 21.50 21.50
CH(i) 137.89 138.48 137.35 137.91 138.90 138.85
CH(o) 129.07 129.76 128.88 129.33 129.94 129.91
CH(m) 128.26 129.03 128.18 128.56 129.23 129.20
CH(p) 125.33 126.12 125.29 125.68 126.28 126.29
Triethylamine CH3 11.61. 12.49 11.74 12.35 12.38 11.09 9.07
CH2 46.25 47.07 45.74 46.77 47.10 46.96 47.19
Merck offers you a broad range of deuterated solvents, including a large variety of rare specialities.
135
Greek alphabet
136
Greek numbers / Roman numbers
½ hemi –
1 mono – I
1½ sesqui –
2 di –, bi – II
2½ hemipenta –
3 tri – III
4 tetra – IV
5 penta – V
6 hexa – VI
7 hepta – VII
8 octa – VIII
9 nona –, ennea – IX
10 deca – X
11 hendeca –, undeca XI
12 dodeca – XII
13 trideca XIII
14 tetradeca – XIV
15 pentadeca – XV
16 hexadeca – XVI
17 heptadeca – XVII
137
Freezing mixtures
138
www.merckmillipore.com/
extran
Extran®
cleaning agents in renowned Merck quality
are the key to reliable cleaning of your
labware.
139
Particle sizes
140
DIN 4188 ASTM ASTM BS Tyler
E11–70 E161–70 410 : 1969
(D) (USA) (USA) (GB)
in mm in mesh in µm in µm in mesh
40 425 35
0.45
0.5 35 500 32
0.56
30 600 28
0.63
0.71 25 710 24
0.8
20 850 20
0.9
1 18 1000 16
1.12
1.18 16 1180 14
1.25
1.4 14 1400 12
141
NMR: Carbon (13C) chemical shifts
142
160 140 120 100 80 60 40 20 0 – 20 – 40
Cl I
aliphates – cyclopropanes
Cl I
Cl I
143
NMR: Proton chemical shifts
TMS = 0 ppm 13 12 11 10
H3C – CR3 Methyl protons
H3C – Halogen
H3C – O –
H3C – N
H3C C=C
H3C C=O
H3C – Ar
– CH2 – CR3 Methylene protons
– CH2 – Halogen
– CH2 – O –
– CH2 – N
– CH2 C=C
– CH2 C=O
– CH2 – Ar
CH – CR3 Methine protons
CH – Halogen
CH – O –
CH – N
13 12 11 10
CH C=O
CH – Ar
–C C–H Alkynes
C–C–H Alkenes, nonconjugated
C–C–H Alkenes, conjugated
Ar – H Aromatics
Ar – H Heteroaromatics
O–C–H Aldehydes
ROH* Alcohols, very dilute solution
ROH* Alcohols, 0.1 – 0.9 mol/L
RCO2H* Carboxylic acids, dimer
– SO3H Sulfonic acids
RSH* Thiols
ArSH* Thiophenols
RNH2* Amines, 0.1 – 0.9 mol/L
R2NH* Amines, 0.1 – 0.9 mol/L
ArNH-(H, R, Ar)* Aromatic amines, primary, secondary
RNH3+, R2NH2+, R3NH+ in TFA solution
ArNH3+, ArRNH2+, ArR2NH+ in TFA solution
13 12 11 10
*T
he chemical shifts of these groups are concentration-dependent and are shifted to lower
ppm values in more dilute solutions
144
9 8 7 6 5 4 3 2 1 0
F I
F I
9 8 7 6 5 4 3 2 1 0 H
9 8 7 6 5 4 3 2 1 0 H
(ppm)
145
Miscibility table
Dimethyl formamide
Carbon tetrachloride
1,2-Dichloroethane
Dichloromethane
Diethyl ether
Cyclohexane
Acetonitrile
Chloroform
Acetone Acetone
Acetonitrile
Carbon tetrachloride
Chloroform
Cyclohexane
1,2-Dichloroethane
Dichloromethane
Diethyl ether
Dimethyl formamide
Dimethyl sulfoxide
1,4-Dioxane
Ethanol
Ethyl acetate
Heptane
Hexane
Methanol
Methyl-tert-butyl ether
Pentane
1-Propanol
2-Propanol
Tetrahydrofuran
Toluene
2,2,4-Trimethylpentane
Water
miscible
immiscible
146
Dimethyl sulfoxide
1,4-Dioxane
Ethanol
Ethyl acetate
Heptane
Hexane
Methanol
Methyl-tert-butyl ether
Pentane
1-Propanol
2-Propanol
Tetrahydrofuran
Toluene
2,2,4-Trimethylpentane
Water
147
Other useful tables
Periodic table of
the elements
Periodensystem der Elemente
11
1 11 –259.1
1.0079
–252.76
1.0079
11 1
H
2.20
–259.1
–252.76
11
H
2.20
–1, 1
–1, 1
1s11 2
4 22
6.941 9.0122
3 1s11
180.5
6.941
1287
9.0122
1342 2471
3 180.5 4 12871.47
22
Li Be
0.97
1342 2471
22
Li Be
0.97 1.47
1 2
[He] 2s11 [He] 2s22
1 2
[He]22.990
2s11 [He]24.305
2s22
11 97.80
22.990 12 24.305650
11 97.80883 12 1090
650
3
Na Mg
1.01
883 10901.23
3
Na Mg
1.01 1.23
1
[Ne]1 3s11 [Ne]
2
2 3s 2
2 3 4 5 6 7 8 9
[Ne]39.098
3s11 [Ne]40.078
3s22 3 44.956
4 47.867
5 50.942
6 51.996
7 54.938
8 55.845
9 58.933
1
19 63.5
39.098 20 40.078842 21 44.9561541 22 47.867 1668 23 50.942 1910 24 51.996 1907 25 54.938 1246 2655.845 1538 2758.933 1495
19 63.5759 20 1484
842 21 1541283622 1668 328723 1910 340724 1907 25
2671 1246 26
2061 1538 272861 1495 282927
Rb Sr
0.89 0.99 1.11 1.22 1.23 1.30 1.36 1.42 1.45
1 2 3 4 3, 5 0, 2, 3, 4, 5, 6 7 -2, 0, 2, 3, 4, 6, 8 0, 1, 2, 3, 4, 5
1 2 3 4 3, 5 4 1 0, 2, 3, 4, 5, 6 7
[Kr] 5s11 [Kr] 5s22 [Kr] 4d15s2 [Kr] 4d25s2 [Kr] 4d 5s [Kr] 4d55s1 [Kr] 4d55s-2,
2 0, 2, 3, 4, 6, 8
[Kr] 4d75s1
0, 1, 2, 3, 4, 5
[Kr] 4d85s1
[Kr] 5s11 [Kr] 5s22 [Kr] 4d15s2 [Kr] 4d25s2 [Kr] 4d45s1 [Kr] 4d55s1 [Kr] 4d55s2 [Kr] 4d75s1 [Kr] 4d85s1
132.91 137.33 178.49 180.95 183.84 186.21 190.23 192.22
55
55
132.91
28.44
28.44 5656
137.33727
727 57–71 7272
57–71
178.49 2233
2233 73 73
180.95 3017
3017 74 74 3422 75
183.84 3422
75 186.21
3185 76 76 3033 77
3185 190.23 3033
77192.22
2446 78
2446
671671 1897
1897 Lanthanides
Lanthanides 4603 4603 5455 5455 5555 5555 5596 5012 5596 4428 5012 4428
6666 Cs Ba HfHf TaTa WW ReRe OsOs Ir Ir Pt
0.86 0.970.97 1.23 1.23 1.33 1.33 1.40 1.46 1.52 1.55
Cs Ba
0.86 Lanthanoide
Lanthanoide 1.40 1.46 1.52 1.55
1 1 2 2 4 4 5 5 0, 2, 3, 0,
4, 2, 6 4, 5, 6 0, 2, 4, 6,
5, 3, 7 0, 2, 3,-2,
0, 72, 4, 6, -2, 4, 0, 8 3, 4, 6,-1,8 0, 1, 2, -1,
6, 2, 3, 4,0,61, 2, 3, 4, 6
[Xe][Xe]
6s116s [Xe][Xe]
6s22 6s [Xe] 4f[Xe]5d4f6s25d 6s [Xe] 4f[Xe] 4f14
2 5d 6s
[Xe] 4f14[Xe]
5d46s4f2 5d 6s [Xe] 4f145d
[Xe]
5 4f
6s2 5d 6s [Xe] 4f145d [Xe]6s24f 5d 6s[Xe] 4f145d[Xe] 6s2 4f 5d 6s[Xe
11 22 14 2 2 3 2 14 4 2 14 5 2 14 6 2 14 7 2
14 2 14
5d36s 6 7
*223.02
*223.02 *226.03
*226.03 *261.11 *262.11 *266.12 *264.12 *277 *268.14
87
87 27 27 8888 696696 89–103 104104*261.11 105105*262.11 106106*266.12 107 107
89–103
*264.12 *277 *268.14
108 108 109 109 110
677677 1140
1140 Actinides
Actinides
7777
Fr
Fr Ra RfRf DbDb SgSg BhBh Hs Hs Mt Mt Ds
0.86
Ra
0.86 0.970.97 Actinoide
Actinoide
1 1 2 2
[Rn]
[Rn] 7s117s11 [Rn][Rn]
7s22 7s22 [Rn]
[Rn] 5f14
6d5f
7s 6d27s2
2 142
[Rn] 5f[Rn]
14
5f14
6d37s2
6d37s2 [Rn] 5f14[Rn]
6d47s5f2 146d47s2 [Rn] 5f14[Rn]
6d57s5f
2 14
6d57s2[Rn] 5f146d
[Rn]
6
7s25f146d67s[Rn]
2
5f146d[Rn]
7
7s2 5f146d77s[Rn
2
3 3 3, 4 3, 4 3, 4 3, 4 3 3 3 3 2, 3 2, 3
[Xe] 5d16s2 [Xe] 5d [Xe]
6s2 4f15d16s[Xe] 4f15d16s2 [Xe] 4f36s2 [Xe] 4f36s2 [Xe] 4f46s2[Xe] 4f46s2 [Xe] 4f56s[Xe] 4f56s2 [Xe] 4f66s[Xe] 4f66s2
1
2 2 2
*227.03 *232.04 *232.04 *231.04 *231.04 *238.03 *238.03 *237.05 *237.05 *244.06*244.06
Actinides
89 89 90
*227.03
1050
1050 90
1750 91 1750 91
1572
1572
92 92 1135 93 93
1135
644 3902 94 94
644
95 9
640
640 3228
3198 4788 4131
Actinoide 3198 4788 4131 3902 3228 1.22
Ac Ac Th Th Pa Pa U U NpNp Pu Pu AmA
1.00 1.11 1.14 1.22 1.22
1.00 1.11 1.14 1.22 1.22 1.22
3 4 4, 5 3, 4, 5, 6 3, 4, 5, 6 3, 4, 5, 6
3 [Rn] 6d17s2 4 [Rn] 6d27s2 5 5f26d17s2 3, 4, 5,[Rn]
4,[Rn] 6 5f 36d17s2 3, 4, 5, [Rn]6 5f 46d17s2 3, 4, 5,[Rn]
6 5f 67s2
[Rn] 6d17s2 [Rn] 6d27s2 [Rn] 5f26d17s2 [Rn] 5f 36d17s2 [Rn] 5f 46d17s2 [Rn] 5f 67s2
148
www.merckmillipore.com/periodictable
11
1.0079
1 –259.1 18
–252.76 4.0026
2
H
2.20 –272.2
–268.93
–1, 1
1s 11
22 He
3
6.941
180.5 4
9.0122
1287 13 14 15 16 17 1s2
1342 2471 10.811 12.011 14.007 15.999 18.998 20.1797
5 6 7 8 9 10
Li Be
0.97 1.47 2075 3550 –210 –218.79 –219.67 –248.609
4000 4827 –195.798 –182.95 –188.12 –246.053
B C N O F Ne
2.01 2.50 3.07 3.50 4.10
1 2
[He] 2s11 [He] 2s22
3 –4, 2, 4 –3, 2, 3, 4, 5 –2, –1 –1
22.990 24.305
11 97.80 12 650
[He] 2s22p1
26.982
[He] 2s22p2
28.086
[He] 2s22p3
30.974
[He] 2s22p4
32.065
[He] 2s22p5
35.453
[He] 2s22p6
39.948
883 1090
13 660.32 14 1414 15 44.15 16 115.21 17 –101.5 18 –189.36
Na Mg
1.01 1.23
2519 3265 280,5 444.61 –34.04 –185.85
Al Si P6 S7 Cl8 Ar9
1.47 1.74 2.06 2.44 2.83
1
[Ne] 3s11
2
[Ne] 3s22 3 4 5 1
9 39.09810 11
40.078 1244.956 47.867
[Ne] 3s23p1
3
50.942
-4, 4
[Ne] 3s23p2 51.996
–3, 3, 5
[Ne] 3s23p3
–2, 2, 4, 6
54.938
[Ne] 3s23p4
–1, 1, 3, 5, 7
55.845
[Ne] 3s23p5 58.933
[Ne] 3s23p6
19
58.933 63.5 20
58.693 842 63.54621 1541
65.409 22 23
1668 69.723 24
1910 72.64 190774.92225 124678.9626 1538
79.904 27 1495
83.798 28
1495 280.91
759 1455 29 1484 1084.62 30 2836
419.53 31 3287 29.76 32 3407938.25 33 2671
subl. 616 34 2061 221 35 2861–7.2 36 2927
–157.36
K Ni Ca Cu Sc Ti Ga V Ge CrAs Mn FeBr Co Ni
2927 2913 1.04 2562 1.20
907 1.32 2204 1.45 2833 1.56
subl. 616 1.60 685 1.6458.8 1.70
–153.34
Zn Se Kr
1.70 1.75 1.75 1.66 1.82 2.02 2.20 2.48 2.74
1 2 3 3, 4 0, 2, 3, 4, 5 0, 2, 3, 6 -1, 0, 2, 3, 4, 6, 7 -2, 0, 2, 3, 6 -1, 0, 2, 3
-1, 0, 2, 3 [Ar] 4s11 0, 2, 3 [Ar] 4s22 1, 2 [Ar] 3d14s22 [Ar] 3d24s2 3 [Ar] 3d34s2 4 [Ar] 3d54s–3,
1
3, 5 [Ar] 3d54s–2,2 4, 6 [Ar]
–13d
, 1,64s
3,2 5, 7 [Ar] 3d74s22
,4
[Ar] 3d74s2 85.468 [Ar] 3d 4s
8 2
87.62[Ar] 3d104s1 [Ar] 3d104s2 [Ar] 3d104s24p1 [Ar] 3d104s24p2 [Ar] 3d104s24p3 [Ar] 3d104s24p4 [Ar] 3d104s24p5 [Ar] 3d104s24p6
85.468 88.906 91.224 92.906 95.94 *97.907 101.07 102.91
37
102.91 39.3 38
106.42 777 107.87 39 1522
112.41 40 41
1855 114.82 42
2477118.71 2623121.7643 2157
127.60 44 2334
126.90 45 1964
131.29 46
1964 46 688 1554.8 47 1377 961.78 48 3345
321.07 49 4409 156.6 50 4744231.93 51 4639630.63 52 449.51
4262 53 113.7
4150 54 –111.74
3695
Xe
1.45 1.30 1.42 1.46 1.49 1.72 1.82 2.01 2.21
1 2 3 4 3, 5 0, 2, 3, 4, 5, 6 7 -2, 0, 2, 3, 4, 6, 8 0, 1, 2, 3, 4, 5
1, 2, 3, 4, 5 [Kr] 5s11 0, 2, 4 [Kr] 5s22 1, 2 [Kr] 4d15s22 [Kr] 4d25s2 3 [Kr] 4d45s1 2, 4 [Kr] 4d55s–3,
1 3, 5 –2,2 4, 6
[Kr] 4d55s –14d
[Kr] , 1,75s
3,1 5, 7 [Kr] 4d10825s, 14, 6
[Kr] 4d85s1 [Kr] 4d10 [Kr] 4d105s1 [Kr] 4d105s2 [Kr] 4d105s25p1 [Kr] 4d105s25p2 [Kr] 4d105s25p3 [Kr] 4d105s25p4 [Kr] 4d105s25p5 [Kr] 4d 5s25p6
132.91 137.33 178.49 180.95 183.84 186.21 190.23 192.22
55 192.22
78 28.44 56195.08
79 727 196.97 57–71
80
200.59 72 81 73 82
2233 204.38 74 83
3017 207.2 3422208.9875 84 *208.98
3185 7685 *209.99
3033 7786 *222.02
2446 78
2446 671 1768.2 1897 1064,18 –38.83
Lanthanides 4603 304 5455327.46 5555 271.4 5596 254 5012 302 4428–71
Quellen
4428 3825 2856 356.62 1.23 1473 1.33 1749 1.40 1564 1.46 962 336.95 –61.7
Hg
1.55 1.42 1.42 1.44 1.55 1.67 1.76 1.96
1 2 4 5 2, 4 0, 2, 3, 4, 5, 6 3, 5 0, 2, 4, 6, 7 3, 4,
-2, 0, 2,–1 6, 8 -1, 0, 1, 2, 3, 4, 6 2
0, 1, 2, 3, 4, 6 0, 2, 4 1, 3 1, 2 1, 3 2,2 4, 6 , 1,6 3,2 5, 7
e] 4f145d76s2
[Xe] [Xe]
6s11 4f145d96s1 [Xe][Xe]
6s224f145d106s1 [Xe] 4f145d106s2 [Xe] 4f
[Xe]5d4f6s
14 2
14
5d106s26p1 [Xe][Xe]
2
4f145d
4f146s
3
5d106s26p2 [Xe][Xe]
2
4f144f
5d1445d
6s102 6s26p3 [Xe] 4f4f
[Xe]
14
5d
14 6s
5
5d106s26p4 [Xe]
[Xe]4f4f145d
14
5d6s10
6s26p5 [Xe]
[Xe] 4f
14
4f145d5d1076s 2
6s26p6 [Xe
*268.14 *223.02 *226.03 *261.11 *262.11 *287 *266.12 *288 *264.12*291 *277*294 *268.14
87 27110 88 *281
111 696
*280
89–103
112
*285
104 113 105 114
*284
106115 107116 108117 109
118
*294
110
677 1140 Actinides
1 2 2
n] 5f146d77s2 [Rn] [Rn]
7s11 5f146d87s2 [Rn][Rn]
7s22 5f146d97s2 [Rn] 5f146d107s2 [Rn] [Rn]
5f146d5f27s6d 7s27p1 [Rn][Rn]
14 2 10 5f146d
5f14
3
7s
6d2107s27p2 [Rn][Rn]
5f145f
6d1446d
7s102 7s27p3 [Rn] 5f5f
[Rn] 6d6d7s7s 7p4
14 14 5 102 2
[Rn]
[Rn]5f5f14146d
6d67s7s 7p5
10 2 2 [Rn]
[Rn] 5f14
14
6d1077s
7s227p6 [Rn
Ho Tm Yb Lu
1.11 1.11 1.11 1.06 1.14
2, 3 2, 3 2, 3 2,7 32 3 3 3, 4 3, 4 3 10 32 3 3 3 3 3 32
2,2, 2,2,332 3
32
[Xe] 4f66s[Xe] 4f66s2 [Xe] 4f 6s [Xe] 4f7[Xe] 4f275d16s2 [Xe] 4f[Xe]
6s2 4f 6s [Xe]
10 4f
6s2 6s [Xe][Xe] 4f2116s2 [Xe][Xe]
4f124f
6s26s [Xe]
4f4f
13 6s [Xe]4f4f14146s
6s2 [Xe] 4f
4f14 5d116s
9 2 12 2 13 14
2
[Xe] 4f76s 2
5d16s 9
[Xe] 4f 4f116s [Xe] 6s2 [Xe] [Xe] 5d 6s2
*244.06 *243.06 *247.07 *247.07 *251.08 *252.08 *257.095 *258.10 *259.10 *262.11
94*244.06 640 95
640 95
*243.06
1176 96
1176 96
*247.07
97 97 996 996
1345 1345
*247.07
98 98
*251.08
900 900 9999
*252.08
860860 100 *257.095
100 1527 101
1527 101
*258.10
827
827 102
102
*259.10
103
103
*262.11
3228 2011
3228 2011 1.20
Pu AmAm Cm
Cm BkBk CfCf EsEs Fm Md No Lr
1.22 1.20 1.20 1.20 1.20 1.20 1.20 1.20
Fm Md No Lr
1.22 1.20 1.20 1.20 1.20 1.20 1.20 1.20 1.20
3, 4, 5, 6 3, 4, 5, 6 3, 4 3, 4 3, 4 3 3 3 2, 3 3
3, 4, 5,[Rn]
6 5f 67s2 3, 4, 5,[Rn]
6 5f 77s2 3,5f476d17s2
[Rn] 3, 45f 97s2
[Rn] 3, 5f
[Rn] 4 107s2 [Rn] 5f3117s2 [Rn] 5f312
7s2 [Rn] 5f 1337s2 [Rn] 5f2,
14 3 2
7s [Rn] 5f 147s27p31
[Rn] 5f 67s2 [Rn] 5f 77s2 [Rn] 5f 76d17s2 [Rn] 5f 97s2 [Rn] 5f 107s2 [Rn] 5f 117s2 [Rn] 5f 127s2 [Rn] 5f 137s2 [Rn] 5f 147s2 [Rn] 5f 147s27p1
149
Notes
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all cases by our customers. This also applies in respect to any
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the suitability of our products for the envisaged purpose.
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64293 Darmstadt
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04/17