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CAS Number: 160892-07-9
5-bromoisophthalonitrile

Structure

5-bromoisophthalonitrile
Name: 5-bromoisophthalonitrile
Synonyms:
General Information
Product Number: 160892079

CAS Registry Number 160892-07-9
Name:
1,​3-​Benzenedicarbonitril​e, 5-​bromo-
1-Bromo-3,5-dicyanobenzene
5-Bromo-1,3-benzenedicarbonitrile
5-Bromoisophthalonitrile

 

Chemical Formula: C8H3BrN2
Exact Mass: 205.95
Molecular Weight: 207.03
m/z: 205.95 (100.0%), 207.95 (97.7%), 206.95 (8.7%), 208.95 (8.5%)

 

InChI:InChI=1S/C8H3BrN2/c9-8-2-6(4-10)1-7(3-8)5-11/h1-3H

InChI Key:KEODZYDOBHDZOT-UHFFFAOYSA-N

Canonical SMILES:C1=C(C=C(C=C1C#N)Br)C#N

Specification

98%

References

(1) Seidel, Nadine; Acta Crystallographica, Section E: Structure Reports Online 2013, V69(12), Po1732-o1733 CAPLUS

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