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CAS Number: 31835-63-9
4'-nitro-[1,1'-biphenyl]-4-carbonitrile

Structure

 4'-nitro-[1,1'-biphenyl]-4-carbonitrile
Name: 4'-nitro-[1,1'-biphenyl]-4-carbonitrile
Synonyms:
General Information
Product Number: 31835639

CAS Registry Number 31835-63-9
Name:
[1,?1'-?Biphenyl]?-?4-?carbonitrile, 4'-?nitro-
4-Biphenylcarbonitrile, 4'-nitro- (8CI)
4'-Nitro[1,1'-biphenyl]-4-carbonitrile
4-(4-Nitrophenyl)benzonitrile
4-Cyano-4'-nitrobiphenyl
4-Nitro-4'-cyanobiphenyl

 

Chemical Formula: C13H8N2O2
Exact Mass: 224.06
Molecular Weight: 224.21
m/z: 224.06 (100.0%), 225.06 (15.0%)

 

InChI:InChI=1S/C13H8N2O2/c14-9-10-1-3-11(4-2-10)12-5-7-13(8-6-12)15(16)17/h1-8H

InChI Key:QHWXJDVNOZETQM-UHFFFAOYSA-N

Canonical SMILES:C1=CC(=CC=C1C#N)C2=CC=C(C=C2)[N+](=O)[O-]

 

Thermal Properties Value Condition Note
Melting Point 200-201 °C   (5)IC
Melting Point 180-181 °C Solv: tetrahydrofuran (109-99-9) (2)CAS

Specification

98%
References
  1. (2) Standaert, Robert F.; Journal of Organic Chemistry 2006, V71(21), P7952-7966 CAPLUS
  2. (5) Ruoliene, J.; Zhurnal Organicheskoi Khimii 1984, V20(6), P1310-14 CAPLUS
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