3-Fluoro-4-(trifluoromethoxy)benzeneacetonitrile

CAS Registry Number®

886761-71-3

CAS Name

3-Fluoro-4-(trifluoromethoxy)benzeneacetonitrile

Molecular Formula

C9H5F4NO

Molecular Mass

219.14

Cite this Page

3-Fluoro-4-(trifluoromethoxy)benzeneacetonitrile.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=886761-71-3 (retrieved 2024-12-19) (CAS RN: 886761-71-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C9H5F4NO/c10-7-5-6(3-4-14)1-2-8(7)15-9(11,12)13/h1-2,5H,3H2

InChIKey

InChIKey=MIDNSRCOEGRXAX-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

N#CCC1=CC=C(OC(F)(F)F)C(F)=C1

Other Names for this Substance

  • Benzeneacetonitrile, 3-fluoro-4-(trifluoromethoxy)-
  • 3-Fluoro-4-(trifluoromethoxy)benzeneacetonitrile
  • 3-Fluoro-4-(trifluoromethoxy)phenylacetonitrile
  • 2-[3-Fluoro-4-(trifluoromethoxy)phenyl]acetonitrile

CAS INSIGHTSTM
Pile of blue, green, and white color of capsule pills with modern design light.