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CAS Number: 853331-52-9
2-chloro-3-methoxybenzonitrile

Structure

 2-chloro-3-methoxybenzonitrile
Name: 2-chloro-3-methoxybenzonitrile
Synonyms:
General Information
Product Number: 853331529

CAS Registry Number 853331-52-9
Name:
Benzonitrile, 2-?chloro-?3-?methoxy-
2-Chloro-3-methoxybenzonitrile

 

Chemical Formula: C8H6ClNO
Exact Mass: 167.01
Molecular Weight: 167.59
m/z: 167.01 (100.0%), 169.01 (32.0%), 168.02 (8.8%), 170.01 (2.9%)

 

InChI:InChI=1S/C8H6ClNO/c1-11-7-4-2-3-6(5-10)8(7)9/h2-4H,1H3

InChI Key:QZCKPEQQNFBXHZ-UHFFFAOYSA-N

Canonical SMILES:COC1=CC=CC(=C1Cl)C#N

Specification

98%
References

PCT Int. Appl. (2014), WO 2014057435 A1 20140417.

PCT Int. Appl. (2011), WO 2011121350 A1 20111006. 
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