1-Propanone, 3-[4-(methylthio)phenyl]-1-(3,4,5-trifluorophenyl)-

CAS Registry Number®

898781-83-4

CAS Name

1-Propanone, 3-[4-(methylthio)phenyl]-1-(3,4,5-trifluorophenyl)-

Molecular Formula

C16H13F3OS

Molecular Mass

310.33

Cite this Page

1-Propanone, 3-[4-(methylthio)phenyl]-1-(3,4,5-trifluorophenyl)-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=898781-83-4 (retrieved 2024-11-22) (CAS RN: 898781-83-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C16H13F3OS/c1-21-12-5-2-10(3-6-12)4-7-15(20)11-8-13(17)16(19)14(18)9-11/h2-3,5-6,8-9H,4,7H2,1H3

InChIKey

InChIKey=NNTRQGBJPFDAAB-UHFFFAOYSA-N

SMILES

C(CCC1=CC=C(SC)C=C1)(=O)C2=CC(F)=C(F)C(F)=C2

Canonical SMILES

O=C(C1=CC(F)=C(F)C(F)=C1)CCC2=CC=C(SC)C=C2

Other Names for this Substance

  • 1-Propanone, 3-[4-(methylthio)phenyl]-1-(3,4,5-trifluorophenyl)-
  • 3-[4-(Methylsulfanyl)phenyl]-1-(3,4,5-trifluorophenyl)-1-propanone