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CAS Number: 21423-81-4
3-chloro-4-methylbenzonitrile

Structure

 3-chloro-4-methylbenzonitrile
Name: 3-chloro-4-methylbenzonitrile
Synonyms:
General Information
Product Number: 21423814

CAS Registry Number 21423-81-4
Name:
Benzonitrile, 3-?chloro-?4-?methyl-
p-Tolunitrile, 3-chloro- (8CI)
3-Chloro-4-methylbenzonitrile
2-Chloro-4-cyanotoluene
3-Chloro-4-methylaminobenzoate
3-Chloro-p-tolunitrile

 

Chemical Formula: C8H6ClN
Exact Mass: 151.02
Molecular Weight: 151.59
m/z: 151.02 (100.0%), 153.02 (32.0%), 152.02 (9.0%), 154.02 (2.8%)

 

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

InChI Key:INEMHABDFCKBID-UHFFFAOYSA-N

Canonical SMILES:CC1=C(C=C(C=C1)C#N)Cl

 

Thermal Properties Value Condition Note
Boiling Point 90 °C Press: 2 Torr (1)CAS

Specification

98%
References

(1) Becke, Friedrich; DE 1286001 1969 CAPLUS
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