ChemSpider 2D Image | 4-Hydroxy-6-methyl-3-[(2E)-3-(3,4,5-trimethoxyphenyl)-2-propenoyl]-2H-pyran-2-one | C18H18O7

4-Hydroxy-6-methyl-3-[(2E)-3-(3,4,5-trimethoxyphenyl)-2-propenoyl]-2H-pyran-2-one

  • Molecular FormulaC18H18O7
  • Average mass346.331 Da
  • Monoisotopic mass346.105255 Da
  • ChemSpider ID22824158

  • 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-6-methyl-3-[(2E)-1-oxo-3-(3,4,5-trimethoxyphenyl)-2-propen-1-yl]- [ACD/Index Name]
4-Hydroxy-6-methyl-3-[(2E)-3-(3,4,5-trimethoxyphenyl)-2-propenoyl]-2H-pyran-2-on [German] [ACD/IUPAC Name]
4-Hydroxy-6-methyl-3-[(2E)-3-(3,4,5-trimethoxyphenyl)-2-propenoyl]-2H-pyran-2-one [ACD/IUPAC Name]
4-Hydroxy-6-méthyl-3-[(2E)-3-(3,4,5-triméthoxyphényl)-2-propenoyl]-2H-pyran-2-one [French] [ACD/IUPAC Name]
(E)-4-hydroxy-6-methyl-3-(3-(3,4,5-trimethoxyphenyl)acryloyl)-2H-pyran-2-one
1448996-92-6 [RN]
4-hydroxy-6-methyl-3-[3-(3,4,5-trimethoxyphenyl)acryloyl]-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: 503.6±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.4 mmHg at 25°C
    Enthalpy of Vaporization: 81.4±3.0 kJ/mol
    Flash Point: 179.6±23.6 °C
    Index of Refraction: 1.601
    Molar Refractivity: 90.4±0.3 cm3
    #H bond acceptors: 7
    #H bond donors: 1
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 0
    ACD/LogP: 1.98
    ACD/LogD (pH 5.5): 1.07
    ACD/BCF (pH 5.5): 2.80
    ACD/KOC (pH 5.5): 50.77
    ACD/LogD (pH 7.4): -0.67
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 91 Å2
    Polarizability: 35.8±0.5 10-24cm3
    Surface Tension: 52.6±3.0 dyne/cm
    Molar Volume: 263.7±3.0 cm3

    Click to predict properties on the Chemicalize site


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