3-(Trifluoromethyl)benzonitrile
CAS Registry Number®
368-77-4
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CAS Name
3-(Trifluoromethyl)benzonitrileMolecular Formula
C8H4F3NMolecular Mass
171.12Cite this Page
3-(Trifluoromethyl)benzonitrile. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=368-77-4 (retrieved ) (CAS RN: 368-77-4). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Boiling Point (1)
189 °CMelting Point (1)
14.5 °CDensity (2)
1.2821 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)7-3-1-2-6(4-7)5-12/h1-4H
InChIKey
InChIKey=OGOBINRVCUWLGN-UHFFFAOYSA-N
SMILES
C(F)(F)(F)C1=CC(C#N)=CC=C1
Canonical SMILES
N#CC1=CC=CC(=C1)C(F)(F)F
Other Names for this Substance
- Benzonitrile, 3-(trifluoromethyl)-
- m-Tolunitrile, α,α,α-trifluoro-
- 3-(Trifluoromethyl)benzonitrile
- m-(Trifluoromethyl)benzonitrile
- α,α,α-Trifluoro-m-tolunitrile
