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n-(2-fluorophenyl)-3-oxobutanamide
Weight195.193 g/mol
FormulaC10H10FNO2
Hydrogen Acceptors2
Hydrogen Donors1
Aromatic Rings1
Rotatable Bonds3

n-(2-fluorophenyl)-3-oxobutanamide (5279-85-6)

5279-85-6

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Alternate Names

  • 5279-85-6
  • SMILES
    CC(=O)CC(=O)NC1=CC=CC=C1F
  • InChIKey
    SNNJOLBZQNBODQ-UHFFFAOYSA-N

Estimated Properties

Boiling Point 306.77 C EPA T.E.S.T.
Boiling Point 349.14 C EPI Suite
Density 1.21 g/cm3 EPA T.E.S.T.
Flash Point 159.29 C EPA T.E.S.T.
Melting Point 125.77 C EPI Suite
Water Solubility 1680.23 mg/L EPA T.E.S.T.
Water Solubility 30891 mg/L EPI Suite

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Synthesis

3-OXOBUTANOYL CHLORIDE  +  2-FLUOROANILINE (Schotten-Baumann amide from acid)
Reactant  +  dimethyl sulfide (Corey-Kim oxidation of secondary alcohols)
Synthesis of n-(2-fluorophenyl)-3-oxobutanamide ›

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