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414255

Sigma-Aldrich

1-Chlorobutane

anhydrous, 99.5%

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Synonym(s):
Butyl chloride
Linear Formula:
CH3(CH2)3Cl
CAS Number:
109-69-3
Molecular Weight:
92.57
Beilstein:
1730909
EC Number:
203-696-6
MDL number:
MFCD00001009
UNSPSC Code:
12352101
PubChem Substance ID:
57650058
NACRES:
NA.21

grade

anhydrous

Quality Level

100

vapor density

3.2 (vs air)

vapor pressure

80.1 mmHg ( 78.4 °C)

Assay

99.5%

form

liquid

autoignition temp.

860 °F

expl. lim.

10.1 %

impurities

<0.002% water

evapn. residue

<0.0003%

refractive index

n20/D 1.402 (lit.)

bp

77-78 °C (lit.)

mp

−123 °C (lit.)

density

0.886 g/mL at 25 °C (lit.)

SMILES string

CCCCCl

InChI

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

InChI key

VFWCMGCRMGJXDK-UHFFFAOYSA-N

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General description

1-Chlorobutane is an isomer of chlorobutane. It undergoes stoichiometric and catalytic dehydrochlorination on reacting with nanocrystalline MgO (magnesium oxide) to generate isomers of butene. Viscosities of the binary mixtures of pentyl acetate and 1-chlorobutane and 1-chlorobutane and acetonitrile has been studied. This study helps in better understanding of cosolvency in polymer system.

Application

1-Chlorobutane may be used in the synthesis of 1-butyl-3-methylimidazolium hydrogen sulfate ([BMIM][HSO4]).

Pictograms

FlameHealth hazard
GHS02,GHS08

Signal Word

Danger

Hazard Statements

H225,H304,H412

Hazard Classifications

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

WGK

WGK 2

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Regulatory Information

危险化学品

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Simultaneous Prediction of Densities and Vapor-Liquid Equilibria of Mixtures Containing an Isomeric Chlorobutane and Methyl tert-Butyl Ether Using the VTPR Model.
Montano D, et al.
Industrial & Engineering Chemistry Research, 50(24), 14193-14202 (2011)
Viscosities and excess volumes of binary mixtures formed by the liquids acetonitrile, pentyl acetate, 1-chlorobutane, and carbon tetrachloride at 25?C.
Prolongo MG, et al.
The Journal of Physical Chemistry, 88(10), 2163-2167 (1984)
Extraction and oxidative desulfurization of diesel fuel catalyzed by a Br?nsted acidic ionic liquid at room temperature.
Gao H, et al.
Green Chemistry, 12(7), 1220-1224 (2010)
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)
M E Alburges et al.
Journal of analytical toxicology, 19(6), 381-386 (1995-10-01)
Ibogaine, an indolamine derivative, is currently being investigated as a potential agent in the treatment of stimulant and opiate addiction. We developed a rapid, sensitive, and specific method for the analysis of ibogaine and its putative active metabolite, 12-hydroxy-ibogamine (12-OH-ibogamine).
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