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CAS Number: 189161-09-9
3-chloro-5-methylbenzonitrile

Structure

3-chloro-5-methylbenzonitrile
Name: 3-chloro-5-methylbenzonitrile
Synonyms:
General Information
Product Number: 189161099

CAS Registry Number 189161-09-9
Name:
Benzonitrile, 3-​chloro-​5-​methyl-

 

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

InChI Key:VQMCGWDQAVDACL-UHFFFAOYSA-N

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

 

Thermal Properties Value Condition Note
Melting Point 61-63 °C   (1)CAS

Specification

98%

References

(1) Guo, Ning; Applied Radiation and Isotopes 2008, V66(10), P1396-1402 CAPLUS

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