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4,4,4-trifluorobutan-2-one
Weight126.077 g/mol
FormulaC4H5F3O
Hydrogen Acceptors1
Hydrogen Donors0
Aromatic Rings0
Rotatable Bonds1

4,4,4-trifluorobutan-2-one (2366-70-3)

4,4,4-trifluoro-2-butanone  ·  2366-70-3

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Alternate Names

  • 4,4,4-trifluoro-2-butanone
  • 2366-70-3
  • SMILES
    CC(=O)CC(F)(F)F
  • InChIKey
    BTXXTMOWISPQSJ-UHFFFAOYSA-N

Estimated Properties

Boiling Point 67.18 C EPA T.E.S.T.
Boiling Point 52.42 C EPI Suite
Density 1.18 g/cm3 EPA T.E.S.T.
Flash Point 31.25 C EPA T.E.S.T.
Melting Point -83.63 C EPI Suite
Water Solubility 14231.7 mg/L EPA T.E.S.T.
Water Solubility 10534 mg/L EPI Suite

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Synthesis

Acetonitrile  +  2-Chloro-1,1,1-trifluoroethane (Grignard carbonyl)
Reactant  +  dimethyl sulfide (Corey-Kim oxidation of secondary alcohols)
Synthesis of 4,4,4-trifluorobutan-2-one ›

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