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CAS Number: 395074-85-8
2-(isoquinolin-5-yl)acetic acid

Structure

2-(isoquinolin-5-yl)acetic acid
Name: 2-(isoquinolin-5-yl)acetic acid
Synonyms:
General Information
Product Number: 395074858

CAS Registry Number 395074-85-8
Name:
5-​Isoquinolineacetic acid
2-(Isoquinolin-5-yl)acetic acid
Isoquinolin-5-ylacetic acid

 

Chemical Formula: C11H9NO2
Exact Mass: 187.06
Molecular Weight: 187.19
m/z: 187.06 (100.0%), 188.07 (12.1%), 189.07 (1.1%)

 

InChI:InChI=1S/C11H9NO2/c13-11(14)6-8-2-1-3-9-7-12-5-4-10(8)9/h1-5,7H,6H2,(H,13,14)

InChI Key:RECVWFAKSIWSKR-UHFFFAOYSA-N

Canonical SMILES:C1=CC2=C(C=CN=C2)C(=C1)CC(=O)O

Specification

98%

References

PCT Int. Appl. (2010), WO 2010091310 A1 20100812.                                  

PCT Int. Appl. (2009), WO 2009040288 A1 20090402.

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