1-[3,5-Bis(trifluoromethyl)phenyl]-1-pentanone

CAS Registry Number®

30071-94-4
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CAS Name

1-[3,5-Bis(trifluoromethyl)phenyl]-1-pentanone

Molecular Formula

C13H12F6O

Molecular Mass

298.22

Cite this Page

1-[3,5-Bis(trifluoromethyl)phenyl]-1-pentanone.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=30071-94-4 (retrieved 2024-08-20) (CAS RN: 30071-94-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C13H12F6O/c1-2-3-4-11(20)8-5-9(12(14,15)16)7-10(6-8)13(17,18)19/h5-7H,2-4H2,1H3

InChIKey

InChIKey=JPABTPNXCBHZNS-UHFFFAOYSA-N

SMILES

C(F)(F)(F)C1=CC(C(F)(F)F)=CC(C(CCCC)=O)=C1

Canonical SMILES

O=C(C=1C=C(C=C(C1)C(F)(F)F)C(F)(F)F)CCCC

Other Names for this Substance

  • 1-Pentanone, 1-[3,5-bis(trifluoromethyl)phenyl]-
  • Valerophenone, 3′,5′-bis(trifluoromethyl)-
  • 1-[3,5-Bis(trifluoromethyl)phenyl]-1-pentanone
  • 3,5-Bis(trifluoromethyl)phenyl n-butyl ketone