2-[1-Oxo-3-(3,4,5-trifluorophenyl)propyl]benzonitrile

CAS Registry Number®

898777-70-3
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CAS Name

2-[1-Oxo-3-(3,4,5-trifluorophenyl)propyl]benzonitrile

Molecular Formula

C16H10F3NO

Molecular Mass

289.25

Cite this Page

2-[1-Oxo-3-(3,4,5-trifluorophenyl)propyl]benzonitrile.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=898777-70-3 (retrieved 2024-09-15) (CAS RN: 898777-70-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C16H10F3NO/c17-13-7-10(8-14(18)16(13)19)5-6-15(21)12-4-2-1-3-11(12)9-20/h1-4,7-8H,5-6H2

InChIKey

InChIKey=DQVNIZCFKWOSKB-UHFFFAOYSA-N

SMILES

C(CCC1=CC(F)=C(F)C(F)=C1)(=O)C2=C(C#N)C=CC=C2

Canonical SMILES

N#CC=1C=CC=CC1C(=O)CCC2=CC(F)=C(F)C(F)=C2

Other Names for this Substance

  • Benzonitrile, 2-[1-oxo-3-(3,4,5-trifluorophenyl)propyl]-
  • 2-[1-Oxo-3-(3,4,5-trifluorophenyl)propyl]benzonitrile