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Merck
CN

125083

2-Chloro-6-methylbenzonitrile

97%

Synonym(s):

6-Chloro-o-tolunitrile

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About This Item

Linear Formula:
ClC6H3(CH3)CN
CAS Number:
Molecular Weight:
151.59
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
EC Number:
229-499-5
MDL number:
Assay:
97%
Form:
solid
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assay

97%

form

solid

bp

143 °C/38 mmHg (lit.)

mp

79-81 °C (lit.)

functional group

chloro, nitrile

SMILES string

Cc1cccc(Cl)c1C#N

InChI

1S/C8H6ClN/c1-6-3-2-4-8(9)7(6)5-10/h2-4H,1H3

InChI key

WQWQHJNUHQEGTN-UHFFFAOYSA-N

Application

FT-IR spectrum of 2-chloro-6-methylbenzonitrile has been studied in the region 400-4000cm-1 by KBr pellet technique.

Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

Eyeshields, Gloves, type N95 (US)

Regulatory Information

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Ab-initio calculations, FT-IR and FT-Raman spectra of 2-chloro-6-methyl benzonitrile.
Kumar V, et al.
Indian Journal of Pure and Applied Physics, 48, 85-94 (2010)

Global Trade Item Number

SKUGTIN
125083-5G04061832097831

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