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CAS Number: 169463-44-9
5-cyano-1H-indole-2-carboxylic acid

Structure

5-cyano-1H-indole-2-carboxylic acid
Name: 5-cyano-1H-indole-2-carboxylic acid
Synonyms:
General Information
Product Number: 169463449

CAS Registry Number 169463-44-9
Name:
1H-​Indole-​2-​carboxylic acid, 5-​cyano-
5-Cyano-1H-indole-2-carboxylic acid

 

Chemical Formula: C10H6N2O2
Exact Mass: 186.04
Molecular Weight: 186.17
m/z: 186.04 (100.0%), 187.05 (11.0%)

 

InChI:InChI=1S/C10H6N2O2/c11-5-6-1-2-8-7(3-6)4-9(12-8)10(13)14/h1-4,12H,(H,13,14)

InChI Key:AXAUNIVIEFHPSY-UHFFFAOYSA-N

Canonical SMILES:C1=CC2=C(C=C1C#N)C=C(N2)C(=O)O

Specification

98%

References

PCT Int. Appl. (2012), WO 2012006203 A1 20120112. 

PCT Int. Appl. (2012), WO 2012003829 A1 20120112.                                 

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