ChemSpider 2D Image | 4-Hydroxy-3-[(2E)-3-(3-methoxyphenyl)-2-propenoyl]-6-methyl-2H-pyran-2-one | C16H14O5

4-Hydroxy-3-[(2E)-3-(3-methoxyphenyl)-2-propenoyl]-6-methyl-2H-pyran-2-one

  • Molecular FormulaC16H14O5
  • Average mass286.279 Da
  • Monoisotopic mass286.084137 Da
  • ChemSpider ID22824206

  • Double-bond stereo - Double-bond stereo

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

2H-Pyran-2-one, 4-hydroxy-3-[(2E)-3-(3-methoxyphenyl)-1-oxo-2-propen-1-yl]-6-methyl- [ACD/Index Name]
4-Hydroxy-3-[(2E)-3-(3-methoxyphenyl)-2-propenoyl]-6-methyl-2H-pyran-2-on [German] [ACD/IUPAC Name]
4-Hydroxy-3-[(2E)-3-(3-methoxyphenyl)-2-propenoyl]-6-methyl-2H-pyran-2-one [ACD/IUPAC Name]
4-Hydroxy-3-[(2E)-3-(3-méthoxyphényl)-2-propenoyl]-6-méthyl-2H-pyran-2-one [French] [ACD/IUPAC Name]
(E)-4-hydroxy-3-(3-(3-methoxyphenyl)acryloyl)-6-methyl-2H-pyran-2-one
1006372-31-1 [RN]
4-HYDROXY-3-[(2E)-3-(3-METHOXYPHENYL)PROP-2-ENOYL]-6-METHYL-2H-PYRAN-2-ONE
4-HYDROXY-3-[(2E)-3-(3-METHOXYPHENYL)PROP-2-ENOYL]-6-METHYLPYRAN-2-ONE
4-hydroxy-3-[3-(3-methoxyphenyl)acryloyl]-6-methyl-2H-pyran-2-one [ACD/IUPAC Name]

    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.3±0.1 g/cm3
    Boiling Point: 447.5±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.1 mmHg at 25°C
    Enthalpy of Vaporization: 74.4±3.0 kJ/mol
    Flash Point: 165.4±22.2 °C
    Index of Refraction: 1.633
    Molar Refractivity: 77.0±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 1
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 2.37
    ACD/LogD (pH 5.5): 1.18
    ACD/BCF (pH 5.5): 3.46
    ACD/KOC (pH 5.5): 59.62
    ACD/LogD (pH 7.4): -0.55
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.12
    Polar Surface Area: 73 Å2
    Polarizability: 30.5±0.5 10-24cm3
    Surface Tension: 57.1±3.0 dyne/cm
    Molar Volume: 215.6±3.0 cm3

    Click to predict properties on the Chemicalize site


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