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1-[4-(allyloxy)phenyl]ethanone
Weight176.215 g/mol
FormulaC11H12O2
Hydrogen Acceptors2
Hydrogen Donors0
Aromatic Rings1
Rotatable Bonds4

1-[4-(allyloxy)phenyl]ethanone (2079-53-0)

2079-53-0

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Alternate Names

  • 2079-53-0
  • SMILES
    CC(=O)C1=CC=C(C=C1)OCC=C
  • InChIKey
    BLAHXQHYMANQBP-UHFFFAOYSA-N

Estimated Properties

Boiling Point 272.5 C EPA T.E.S.T.
Boiling Point 263.45 C EPI Suite
Density 1.04 g/cm3 EPA T.E.S.T.
Flash Point 120.82 C EPA T.E.S.T.
Melting Point 45.04 C EPI Suite
Water Solubility 577.86 mg/L EPA T.E.S.T.
Water Solubility 370.23 mg/L EPI Suite

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Synthesis

Acetonitrile  +  13997-70-1 (Grignard carbonyl)
4'-Hydroxyacetophenone  +  ALLYL CHLORIDE (Williamson ether)
Allyl phenyl ether  +  ACETYL CHLORIDE (Friedel-Crafts acylation)
Reactant  +  dimethyl sulfide (Corey-Kim oxidation of secondary alcohols)
Reactant  +  1-Hydroxy-1,2-benziodoxol-3(1H)-one 1-oxide (Nicolaou IBX dehydrogenation)
Synthesis of 1-[4-(allyloxy)phenyl]ethanone ›

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