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

CAS Registry Number®

898777-74-7

CAS Name

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

Molecular Formula

C16H10F3NO

Molecular Mass

289.25

Cite this Page

4-[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=898777-74-7 (retrieved 2024-11-23) (CAS RN: 898777-74-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

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

InChIKey

InChIKey=HHVHAORYTUCZIN-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

N#CC1=CC=C(C=C1)C(=O)CCC2=CC(F)=C(F)C(F)=C2

Other Names for this Substance

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

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