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Merck

34958

1-Chlorobutane

suitable for HPLC, ≥99.8%

Synonym(s):

Butyl chloride

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About This Item

Linear Formula:
CH3(CH2)3Cl
CAS Number:
109-69-3
Molecular Weight:
92.57
UNSPSC Code:
41116105
NACRES:
NA.04
PubChem Substance ID:
329755099
EC Number:
203-696-6
Beilstein/REAXYS Number:
1730909
MDL number:
MFCD00001009
Assay:
≥99.8%
Grade:
HPLC grade
Technique(s):
HPLC: suitable
Vapor pressure:
80.1 mmHg ( 78.4 °C)

Key Documents

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InChI

1S/C4H9Cl/c1-2-3-4-5/h2-4H2,1H3

InChI key

VFWCMGCRMGJXDK-UHFFFAOYSA-N

SMILES string

CCCCCl

grade

HPLC grade

vapor density

3.2 (vs air)

vapor pressure

80.1 mmHg ( 78.4 °C)

assay

≥99.8%

form

liquid

autoignition temp.

860 °F

expl. lim.

10.1 %

technique(s)

HPLC: suitable

impurities

≤0.0002% free alkali (as NH3), ≤0.001% free acid (as HCl), ≤0.001% non-volatile matter, ≤0.01% water (Karl Fischer)

transmittance

230 nm, ≥65%, 240 nm, ≥95%, 250 nm, ≥98%

Quality Level

100

mp

−123 °C (lit.)

density

0.886 g/mL at 25 °C (lit.)

application(s)

food and beverages

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General description

1-Chlorobutane is an alkyl halide. It undergoes reaction with nanocrystalline MgO at 200-350°C to afford butane isomers and MgCl2, via dehydrochlorination.

Application

1-Chlorobutane may be used in the synthesis of ionic liquids, 1-butyl-3-methylimidazolium hydrogen sulfate ([Bmim]+[HSO4]-) and 1-butyl-3-methylimidazolium dihydrogen phosphate ([Bmim]+[H2PO4]-).

Packaging

M-Bottle for Solvents
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Other Notes

Discover LiChropur reagents ideal for HPLC or LC-MS analysis

pictograms

FlameHealth hazard
GHS02,GHS08

signalword

Danger

Hazard Classifications

Aquatic Chronic 3 - Asp. Tox. 1 - Flam. Liq. 2

Storage Class

3 - Flammable liquids

wgk

WGK 2

flash_point_f

10.4 °F - closed cup

flash_point_c

-12 °C - closed cup

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Certificates of Analysis (COA)

Lot/Batch Number
MKCX1310
MKCX6886
MKCX6887
MKCX6885
MKCX6884

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Mannich reaction using acidic ionic liquids as catalysts and solvents.
Zhao G, et al.
Green Chemistry, 6(2), 75-77 (2004)
Changes in texture and catalytic activity of nanocrystalline MgO during its transformation to MgCl2 in the reaction with 1-chlorobutane.
Fenelonov VB, et al.
The Journal of Physical Chemistry B, 105(18), 3937-3941 (2001)
Hazel M Rivera et al.
European journal of mass spectrometry (Chichester, England), 9(6), 599-607 (2004-04-22)
A sensitive and selective high-performance liquid chromatography/atmospheric pressure chemical ionisation tandem mass spectrometry (HPLC/APCI-MS/MS) method for the simultaneous detection of 18 benzodiazepines and metabolites in human blood is described. The procedure utilises butyl chloride extraction at alkaline pH followed by
D E Moody et al.
Journal of analytical toxicology, 19(6), 343-351 (1995-10-01)
l-alpha-Acetylmethadol (LAAM) is approved as a substitute for methadone for the treatment of opiate addiction. Analytical methods are needed to quantitate LAAM and its two psychoactive metabolites, norLAAM and dinorLAAM, to support pharmacokinetic and other studies. We developed a gas
Antonio García Martínez et al.
The Journal of organic chemistry, 70(25), 10238-10246 (2005-12-06)
[structure: see text] The activation energy in the gas phase (deltaE(double dagger)) and the free energy of activation (deltaG(double dagger)) in water solution for the hydrolysis of the monohydrates of methyl chloride (MeCl), tert-butyl chloride (t-BuCl), and 1-adamantyl chloride (AdCl)
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