2-(Trifluoromethyl)benzonitrile
CAS Registry Number®
447-60-9
CAS Name
2-(Trifluoromethyl)benzonitrileMolecular Formula
C8H4F3NMolecular Mass
171.12Cite this Page
2-(Trifluoromethyl)benzonitrile. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=447-60-9 (retrieved ) (CAS RN: 447-60-9). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Boiling Point (1)
205 °CMelting Point (1)
18 °CDensity (2)
1.2886 g/cm³ @ Temp: 20 °C
Source(s)
- (1) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)
- (2) Inukai, Kan; Kogyo Kagaku Zasshi, (1964), 67(5), 807-9, CAplus
Other Names and Identifiers
InChI
InChI=1S/C8H4F3N/c9-8(10,11)7-4-2-1-3-6(7)5-12/h1-4H
InChIKey
InChIKey=SOZGHDCEWOLLHV-UHFFFAOYSA-N
SMILES
C(#N)C1=C(C(F)(F)F)C=CC=C1
Canonical SMILES
N#CC=1C=CC=CC1C(F)(F)F
Other Names for this Substance
- Benzonitrile, 2-(trifluoromethyl)-
- o-Tolunitrile, α,α,α-trifluoro-
- 2-(Trifluoromethyl)benzonitrile
- o-(Trifluoromethyl)benzonitrile
- o-Cyanobenzotrifluoride
