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CAS Number: 134604-07-2
2-bromo-5-nitrobenzonitrile

Structure

2-bromo-5-nitrobenzonitrile
Name: 2-bromo-5-nitrobenzonitrile
Synonyms:
General Information
Product Number: 134604072

CAS Registry Number 134604-07-2
Name:
Benzonitrile, 2-​bromo-​5-​nitro-
2-Bromo-5-nitrobenzonitrile

 

Chemical Formula: C7H3BrN2O2
Exact Mass: 225.94
Molecular Weight: 227.01
m/z: 225.94 (100.0%), 227.94 (98.0%), 226.94 (7.7%), 228.94 (7.5%)

 

InChI:InChI=1S/C7H3BrN2O2/c8-7-2-1-6(10(11)12)3-5(7)4-9/h1-3H

InChI Key:RKODNVITKISFKU-UHFFFAOYSA-N

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

 

Thermal Properties Value Condition Note
Melting Point 121 °C   (1)CAS

Specification

98%

References
  1. (1) Baudet, H. Ph.; Recueil des Travaux Chimiques des Pays-Bas et de la Belgique 1924, V43, P707-26 CAPLUS
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