CAS Registry Number®
778-94-9
CAS Name
2-Nitro-4-(trifluoromethyl)benzonitrile
Molecular Formula
C8H3F3N2O2
Molecular Mass
216.12
Compound Properties
-
Boiling Point (1)
156-158 °C @ Press: 18-19 Torr
-
Melting Point (1)
47-48 °C
Source(s)
- (1) FR828202, 1938, CAplus
Other Names and Identifiers
InChI
InChI=1S/C8H3F3N2O2/c9-8(10,11)6-2-1-5(4-12)7(3-6)13(14)15/h1-3H
InChIKey
InChIKey=BQCWLXXZTCLGSZ-UHFFFAOYSA-N
SMILES
N(=O)(=O)C1=C(C#N)C=CC(C(F)(F)F)=C1
Canonical SMILES
N#CC1=CC=C(C=C1N(=O)=O)C(F)(F)F
Other Names for this Substance
- Benzonitrile, 2-nitro-4-(trifluoromethyl)-
- p-Tolunitrile, α,α,α-trifluoro-2-nitro-
- 2-Nitro-4-(trifluoromethyl)benzonitrile
- 2-Nitro-4-trifluoromethylbenzonitrile
- NSC 88323
- 2-Nitro-4-(trifluoromethyl)benzenecarbonitrile
