4-Nitrobenzotrifluoride

Catalog Number	ACM402540-1
CAS Number	402-54-0
Structure
Synonyms	1-Nitro-4-(trifluoromethyl)benzene
IUPAC Name	1-nitro-4-(trifluoromethyl)benzene
Molecular Weight	191.11
Molecular Formula	C7H4F3NO2
Canonical SMILES	C1=CC(=CC=C1C(F)(F)F)[N+](=O)[O-]
InChI	InChI=1S/C7H4F3NO2/c8-7(9,10)5-1-3-6(4-2-5)11(12)13/h1-4H
InChI Key	XKYLCLMYQDFGKO-UHFFFAOYSA-N
Boiling Point	81-83 ºC 10mmHg
Melting Point	38-40 ºC (lit.)
Purity	98%+
Density	1.391 g/ml