4-Bromo-3-(trifluoromethyl)benzonitrile

Catalog Number	ACM1735531
CAS Number	1735-53-1
Structure
Synonyms	2-Bromo-5-cyanobenzotrifluoride
IUPAC Name	4-bromo-3-(trifluoromethyl)benzonitrile
Molecular Weight	250.02
Molecular Formula	C8H3BrF3N
Canonical SMILES	C1=CC(=C(C=C1C#N)C(F)(F)F)Br
InChI	InChI=1S/C8H3BrF3N/c9-7-2-1-5(4-13)3-6(7)8(10,11)12/h1-3H
InChI Key	KSXUIQQDHHFSRN-UHFFFAOYSA-N
Boiling Point	235.6±35.0 °C
Melting Point	80-84 °C
Purity	98%+
Density	1.71±0.1 g/ml