1-(4-Methylphenyl)-4,4,4-trifluorobutane-1,3-dione

CAS Registry Number®

720-94-5

CAS Name

1-(4-Methylphenyl)-4,4,4-trifluorobutane-1,3-dione

Molecular Formula

C11H9F3O2

Molecular Mass

230.18

Cite this Page

1-(4-Methylphenyl)-4,4,4-trifluorobutane-1,3-dione.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=720-94-5 (retrieved 2024-11-23) (CAS RN: 720-94-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    44-45 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C11H9F3O2/c1-7-2-4-8(5-3-7)9(15)6-10(16)11(12,13)14/h2-5H,6H2,1H3

InChIKey

InChIKey=WRZMHTIRFOFFPY-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • 1,3-Butanedione, 4,4,4-trifluoro-1-(4-methylphenyl)-
  • 1,3-Butanedione, 4,4,4-trifluoro-1-p-tolyl-
  • 4,4,4-Trifluoro-1-(4-methylphenyl)-1,3-butanedione
  • 1,1,1-Trifluoro-4-(4-methylphenyl)-2,4-butanedione
  • 4-(4-Methylphenyl)-1,1,1-trifluorobutane-2,4-dione

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