3-(Trifluoromethyl)benzonitrile

Catalog Number	ACM368774
CAS Number	368-77-4
Structure
Synonyms	1-(Trifluoromethyl)-3-cyanobenzene
IUPAC Name	3-(trifluoromethyl)benzonitrile
Molecular Weight	171.12
Molecular Formula	C8H4F3N
Canonical SMILES	C1=CC(=CC(=C1)C(F)(F)F)C#N
InChI	InChI=1S/C8H4F3N/c9-8(10,11)7-3-1-2-6(4-7)5-12/h1-4H
InChI Key	OGOBINRVCUWLGN-UHFFFAOYSA-N
Boiling Point	189 °C (lit.)
Melting Point	16-20 °C (lit.)
Purity	98%+
Density	1.281 g/ml