ChemSpider 2D Image | Methyl 3-(3-hydroxy-6-methyl-4-oxo-4H-pyran-2-yl)-3-(8-methoxy-2,3-dihydro-1,4-benzodioxin-6-yl)propanoate | C19H20O8

Methyl 3-(3-hydroxy-6-methyl-4-oxo-4H-pyran-2-yl)-3-(8-methoxy-2,3-dihydro-1,4-benzodioxin-6-yl)propanoate

  • Molecular FormulaC19H20O8
  • Average mass376.357 Da
  • Monoisotopic mass376.115814 Da
  • ChemSpider ID29771030

More details:

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

1,4-Benzodioxin-6-propanoic acid, 2,3-dihydro-β-(3-hydroxy-6-methyl-4-oxo-4H-pyran-2-yl)-8-methoxy-, methyl ester [ACD/Index Name]
3-(3-Hydroxy-6-méthyl-4-oxo-4H-pyran-2-yl)-3-(8-méthoxy-2,3-dihydro-1,4-benzodioxin-6-yl)propanoate de méthyle [French] [ACD/IUPAC Name]
Methyl 3-(3-hydroxy-6-methyl-4-oxo-4H-pyran-2-yl)-3-(8-methoxy-2,3-dihydro-1,4-benzodioxin-6-yl)propanoate [ACD/IUPAC Name]
Methyl-3-(3-hydroxy-6-methyl-4-oxo-4H-pyran-2-yl)-3-(8-methoxy-2,3-dihydro-1,4-benzodioxin-6-yl)propanoat [German] [ACD/IUPAC Name]
1574406-56-6 [RN]
methyl 3-(3-hydroxy-6-methyl-4-oxopyran-2-yl)-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)propanoate

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 569.6±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.6 mmHg at 25°C
    Enthalpy of Vaporization: 89.9±3.0 kJ/mol
    Flash Point: 203.5±23.6 °C
    Index of Refraction: 1.584
    Molar Refractivity: 92.6±0.3 cm3
    #H bond acceptors: 8
    #H bond donors: 1
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 0
    ACD/LogP: 2.02
    ACD/LogD (pH 5.5): 1.71
    ACD/BCF (pH 5.5): 11.65
    ACD/KOC (pH 5.5): 201.54
    ACD/LogD (pH 7.4): 1.59
    ACD/BCF (pH 7.4): 8.93
    ACD/KOC (pH 7.4): 154.44
    Polar Surface Area: 101 Å2
    Polarizability: 36.7±0.5 10-24cm3
    Surface Tension: 54.5±3.0 dyne/cm
    Molar Volume: 276.5±3.0 cm3

    Click to predict properties on the Chemicalize site


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