2-(Trifluoromethyl)benzeneacetonitrile

CAS Registry Number®

3038-47-9
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CAS Name

2-(Trifluoromethyl)benzeneacetonitrile

Molecular Formula

C9H6F3N

Molecular Mass

185.15

Cite this Page

2-(Trifluoromethyl)benzeneacetonitrile.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=3038-47-9 (retrieved 2024-04-27) (CAS RN: 3038-47-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    33 °C

Source(s)

  • (1) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)

Other Names and Identifiers

InChI

InChI=1S/C9H6F3N/c10-9(11,12)8-4-2-1-3-7(8)5-6-13/h1-4H,5H2

InChIKey

InChIKey=QXDCZSJGEUSERL-UHFFFAOYSA-N

SMILES

C(F)(F)(F)C1=C(CC#N)C=CC=C1

Canonical SMILES

N#CCC=1C=CC=CC1C(F)(F)F

Other Names for this Substance

  • Benzeneacetonitrile, 2-(trifluoromethyl)-
  • Acetonitrile, (α,α,α-trifluoro-o-tolyl)-
  • 2-(Trifluoromethyl)benzeneacetonitrile
  • (α,α,α-Trifluoro-o-tolyl)acetonitrile
  • 2-(Trifluoromethyl)phenylacetonitrile

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