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CAS Number: 14123-76-3
6-chloro-3-methylisoquinoline

Structure

 6-chloro-3-methylisoquinoline
Name: 6-chloro-3-methylisoquinoline
Synonyms:
General Information
Product Number: 14123763

CAS Registry Number 14123-76-3
Name:
Isoquinoline, 6-?chloro-?3-?methyl-
6-Chloro-3-methylisoquinoline

 

Chemical Formula: C10H8ClN
Exact Mass: 177.03
Molecular Weight: 177.63
m/z: 177.03 (100.0%), 179.03 (32.0%), 178.04 (10.9%), 180.03 (3.6%)

 

InChI:InChI=1S/C10H8ClN/c1-7-4-9-5-10(11)3-2-8(9)6-12-7/h2-6H,1H3

InChI Key:VLPNHJHAQSABQP-UHFFFAOYSA-N

Canonical SMILES:CC1=NC=C2C=CC(=CC2=C1)Cl

Specification

98%
References

PCT Int. Appl. (2007), WO 2007006533 A2 20070118.

Journal of Medicinal Chemistry (2015), 58(9), 4086.
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