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CAS Number: 5159-60-4
6-cyano-2-naphthoic acid

Structure

 6-cyano-2-naphthoic acid
Name: 6-cyano-2-naphthoic acid
Synonyms:
General Information
Product Number: 5159604

CAS Registry Number 5159-60-4
Name:
2-?Naphthalenecarboxyli?c acid, 6-?cyano-
2-Naphthoic acid, 6-cyano- (7CI,8CI)
6-Cyano-2-naphthalenecarboxylic acid
6-Cyano-2-naphthoic acid
6-Cyano-2-naphthylacetic acid

 

Chemical Formula: C12H7NO2
Exact Mass: 197.05
Molecular Weight: 197.19
m/z: 197.05 (100.0%), 198.05 (13.1%), 199.05 (1.2%)

 

InChI:InChI=1S/C12H7NO2/c13-7-8-1-2-10-6-11(12(14)15)4-3-9(10)5-8/h1-6H,(H,14,15)

InChI Key:OZXBANYHKBTOIN-UHFFFAOYSA-N

Canonical SMILES:C1=CC2=C(C=CC(=C2)C(=O)O)C=C1C#N

 

Thermal Properties Value Condition Note
Melting Point 288-290 °C   (1)CAS
Melting Point 285-287 °C Solv: methanol (67-56-1); water (7732-18-5) (2)IC

Specification

98%
References
  1. (1) Adcock, W.; Australian Journal of Chemistry 1965, V18(9), P1351-64 CAPLUS
  2. (2) Wagner, G.; Pharmazie 1978, V33(9), P568-72 CAPLUS
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