3,5-Bis(trifluoromethyl)benzeneacetonitrile

CAS Registry Number®

85068-32-2
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CAS Name

3,5-Bis(trifluoromethyl)benzeneacetonitrile

Molecular Formula

C10H5F6N

Molecular Mass

253.14

Cite this Page

3,5-Bis(trifluoromethyl)benzeneacetonitrile.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=85068-32-2 (retrieved 2024-04-30) (CAS RN: 85068-32-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C10H5F6N/c11-9(12,13)7-3-6(1-2-17)4-8(5-7)10(14,15)16/h3-5H,1H2

InChIKey

InChIKey=YXGWYBUKRTYHJM-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

N#CCC=1C=C(C=C(C1)C(F)(F)F)C(F)(F)F

Other Names for this Substance

  • Benzeneacetonitrile, 3,5-bis(trifluoromethyl)-
  • 3,5-Bis(trifluoromethyl)benzeneacetonitrile
  • [3,5-Bis(trifluoromethyl)phenyl]acetonitrile
  • 1-(Cyanomethyl)-3,5-bis(trifluoromethyl)benzene
  • 2-(3,5-Bis(trifluoromethyl)phenyl)acetonitrile

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