3,3-Bis[[3-(trifluoromethyl)phenyl]methyl]-2,4-pentanedione

CAS Registry Number®

477847-82-8
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CAS Name

3,3-Bis[[3-(trifluoromethyl)phenyl]methyl]-2,4-pentanedione

Molecular Formula

C21H18F6O2

Molecular Mass

416.36

Cite this Page

3,3-Bis[[3-(trifluoromethyl)phenyl]methyl]-2,4-pentanedione.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=477847-82-8 (retrieved 2024-07-08) (CAS RN: 477847-82-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C21H18F6O2/c1-13(28)19(14(2)29,11-15-5-3-7-17(9-15)20(22,23)24)12-16-6-4-8-18(10-16)21(25,26)27/h3-10H,11-12H2,1-2H3

InChIKey

InChIKey=XDMLTYLOJMGAOS-UHFFFAOYSA-N

SMILES

C(CC1=CC(C(F)(F)F)=CC=C1)(CC2=CC(C(F)(F)F)=CC=C2)(C(C)=O)C(C)=O

Canonical SMILES

O=C(C)C(C(=O)C)(CC1=CC=CC(=C1)C(F)(F)F)CC2=CC=CC(=C2)C(F)(F)F

Other Names for this Substance

  • 2,4-Pentanedione, 3,3-bis[[3-(trifluoromethyl)phenyl]methyl]-
  • 3,3-Bis[[3-(trifluoromethyl)phenyl]methyl]-2,4-pentanedione