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CAS Number: 153775-42-9
4-cyano-3-nitrobenzoic acid

Structure

4-cyano-3-nitrobenzoic acid
Name: 4-cyano-3-nitrobenzoic acid
Synonyms:
General Information
Product Number: 153775429

CAS Registry Number 153775-42-9
Name:
Benzoic acid, 4-​cyano-​3-​nitro-
4-Cyano-3-nitrobenzoic acid

 

Chemical Formula: C8H4N2O4
Exact Mass: 192.02
Molecular Weight: 192.13
m/z: 192.02 (100.0%), 193.02 (8.9%), 194.02 (1.2%)

 

InChI:InChI=1S/C8H4N2O4/c9-4-6-2-1-5(8(11)12)3-7(6)10(13)14/h1-3H,(H,11,12)

InChI Key:JVPRJKPSKHSUDO-UHFFFAOYSA-N

Canonical SMILES:C1=CC(=C(C=C1C(=O)O)[N+](=O)[O-])C#N

 

Thermal Properties Value Condition Note
Melting Point 205-206 °C   (1)CAS

Specification

98%

References
  1. (1) FR 828202 1938 CAPLUS
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