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CAS Number: 160521-46-0
3'-bromo-[1,1'-biphenyl]-4-carbonitrile

Structure

3'-bromo-[1,1'-biphenyl]-4-carbonitrile
Name: 3'-bromo-[1,1'-biphenyl]-4-carbonitrile
Synonyms:
General Information
Product Number: 160521460

CAS Registry Number 160521-46-0
Name:
[1,​1'-​Biphenyl]​-​4-​carbonitrile, 3'-​bromo-
3'-Bromobiphenyl-4-carbonitrile

 

Chemical Formula: C13H8BrN
Exact Mass: 256.98
Molecular Weight: 258.11
m/z: 256.98 (100.0%), 258.98 (97.3%), 257.99 (14.2%), 259.99 (13.8%)

 

InChI:InChI=1S/C13H8BrN/c14-13-3-1-2-12(8-13)11-6-4-10(9-15)5-7-11/h1-8H

InChI Key:ZGHLPFNAHBELBC-UHFFFAOYSA-N

Canonical SMILES:C1=CC(=CC(=C1)Br)C2=CC=C(C=C2)C#N

 

Thermal Properties Value Condition Note
Melting Point 48.6-49.8 °C   (1)CAS

Specification

98%

References

(1) Rasmussen, L. Kyhn; Journal of Organic Chemistry 2006, V71(3), P1230-1232 CAPLUS

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