ChemSpider 2D Image | 2-(3,4-DIHYDROXYPHENYL)-6-ETHYL-3-HYDROXYCHROMEN-4-ONE | C17H14O5

2-(3,4-DIHYDROXYPHENYL)-6-ETHYL-3-HYDROXYCHROMEN-4-ONE

  • Molecular FormulaC17H14O5
  • Average mass298.290 Da
  • Monoisotopic mass298.084137 Da
  • ChemSpider ID26232024

More details:

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

1313738-76-9 [RN]
2-(3,4-Dihydroxyphenyl)-6-ethyl-3-hydroxy-4H-1-benzopyran-4-one
2-(3,4-Dihydroxyphenyl)-6-ethyl-3-hydroxy-4H-chromen-4-on [German] [ACD/IUPAC Name]
2-(3,4-Dihydroxyphenyl)-6-ethyl-3-hydroxy-4H-chromen-4-one [ACD/IUPAC Name]
2-(3,4-Dihydroxyphényl)-6-éthyl-3-hydroxy-4H-chromén-4-one [French] [ACD/IUPAC Name]
2-(3,4-DIHYDROXYPHENYL)-6-ETHYL-3-HYDROXYCHROMEN-4-ONE
4H-1-Benzopyran-4-one, 2-(3,4-dihydroxyphenyl)-6-ethyl-3-hydroxy- [ACD/Index Name]
[1313738-76-9] [RN]
131373-87-0 [RN]
CS-0547
More...

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

    Density: 1.5±0.1 g/cm3
    Boiling Point: 533.2±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.5 mmHg at 25°C
    Enthalpy of Vaporization: 85.2±3.0 kJ/mol
    Flash Point: 200.7±23.6 °C
    Index of Refraction: 1.703
    Molar Refractivity: 79.1±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 3
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 3.99
    ACD/LogD (pH 5.5): 2.94
    ACD/BCF (pH 5.5): 100.99
    ACD/KOC (pH 5.5): 946.54
    ACD/LogD (pH 7.4): 2.91
    ACD/BCF (pH 7.4): 94.10
    ACD/KOC (pH 7.4): 881.98
    Polar Surface Area: 87 Å2
    Polarizability: 31.4±0.5 10-24cm3
    Surface Tension: 73.9±3.0 dyne/cm
    Molar Volume: 203.9±3.0 cm3

    Click to predict properties on the Chemicalize site


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