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Merck
CN

277029

2-Chloro-2-methylbutane

98%

Synonym(s):

2-Methyl-2-chlorobutane, tert-Amyl chloride, tert-Pentyl chloride

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About This Item

Linear Formula:
C2H5C(CH3)2Cl
CAS Number:
594-36-5
Molecular Weight:
106.59
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
24856728
EC Number:
209-836-2
Beilstein/REAXYS Number:
1696930
MDL number:
MFCD00000818
Assay:
98%
Form:
liquid

Key Documents

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InChI key

CRNIHJHMEQZAAS-UHFFFAOYSA-N

InChI

1S/C5H11Cl/c1-4-5(2,3)6/h4H2,1-3H3

SMILES string

CCC(C)(C)Cl

assay

98%

form

liquid

refractive index

n20/D 1.405 (lit.)

bp

85-86 °C (lit.)

mp

−73 °C (lit.)

density

0.866 g/mL at 25 °C (lit.)

functional group

alkyl halide, chloro

General description

The influence of carbon-carbon multiple bonds on the solvolyses of 2-chloro-2-methylbutane has been critically evaluated through the extended Grunwald-Winstein equation. The rate constant for the SN 1 hydrolysis of 2-chloro-2-methylbutane has been measured near the consolute point of the liquid mixture of isobutyric acid and water.

pictograms

FlameExclamation mark
GHS02,GHS07

signalword

Danger

Hazard Classifications

Eye Irrit. 2 - Flam. Liq. 2 - Skin Irrit. 2 - STOT SE 3

target_organs

Respiratory system

Storage Class

3 - Flammable liquids

wgk

WGK 3

flash_point_f

14.0 °F - closed cup

flash_point_c

-10 °C - closed cup

ppe

Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter

Regulatory Information

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Certificates of Analysis (COA)

Lot/Batch Number
MKCJ1850
MKCF8719
MKBX0508V
MKBS4020V
MKBQ8850V

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Effect of the consolute point of isobutyric acid+ water on the rate of an SN1 hydrolysis reaction.
Kim YW and Baird JK.
International Journal of Thermophysics, 22(5), 1449-1461 (2001)
Marina C Reis et al.
International journal of molecular sciences, 9(9), 1704-1716 (2009-03-28)
The influence of carbon-carbon multiple bonds on the solvolyses of 3-chloro-3-methylbutyne (1), 2-chloro-2-phenylpropane (2), 2-bromo-2-methyl-1-phenylpropane (3), 4-chloro-4-methyl-2-pentyne (4) and 2-chloro-2-methylbutane (5) is critically evaluated through the extended Grunwald-Winstein equation. Substrates 1, 3 and 5 lead to correlations with unexpected negative

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