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CAS Number: 1254703-05-3
ethyl 1-chloro-8-methylisoquinoline-3-carboxylate

Structure

 ethyl 1-chloro-8-methylisoquinoline-3-carboxylate
Name: ethyl 1-chloro-8-methylisoquinoline-3-carboxylate
Synonyms:
General Information
Product Number: 1254703053

CAS Registry Number 1254703-05-3
Name:
3-?Isoquinolinecarboxyl?ic acid, 1-?chloro-?8-?methyl-?, ethyl ester

 

Chemical Formula: C13H12ClNO2
Exact Mass: 249.06
Molecular Weight: 249.69
m/z: 249.06 (100.0%), 251.05 (32.0%), 250.06 (14.3%), 252.06 (4.6%), 251.06 (1.4%)

 

InChI:InChI=1S/C13H12ClNO2/c1-3-17-13(16)10-7-9-6-4-5-8(2)11(9)12(14)15-10/h4-7H,3H2,1-2H3

InChI Key:VGXZUKNOVRMQEZ-UHFFFAOYSA-N

Canonical SMILES:CCOC(=O)C1=NC(=C2C(=CC=CC2=C1)C)Cl

Specification

98%
References

PCT Int. Appl. (2010), WO 2010129816 A2 20101111.
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