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

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

  • Molecular FormulaC19H20O8
  • Average mass376.357 Da
  • Monoisotopic mass376.115814 Da
  • ChemSpider ID34497630

More details:

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

1,4-Benzodioxin-6-propanoic acid, 2,3-dihydro-β-(4-hydroxy-6-methyl-2-oxo-2H-pyran-3-yl)-8-methoxy-, methyl ester [ACD/Index Name]
3-(4-Hydroxy-6-méthyl-2-oxo-2H-pyran-3-yl)-3-(8-méthoxy-2,3-dihydro-1,4-benzodioxin-6-yl)propanoate de méthyle [French] [ACD/IUPAC Name]
Methyl 3-(4-hydroxy-6-methyl-2-oxo-2H-pyran-3-yl)-3-(8-methoxy-2,3-dihydro-1,4-benzodioxin-6-yl)propanoate [ACD/IUPAC Name]
Methyl-3-(4-hydroxy-6-methyl-2-oxo-2H-pyran-3-yl)-3-(8-methoxy-2,3-dihydro-1,4-benzodioxin-6-yl)propanoat [German] [ACD/IUPAC Name]
1676083-07-0 [RN]
methyl 3-(4-hydroxy-6-methyl-2-oxo-2H-pyran-3-yl)-3-(8-methoxy-2,3-dihydrobenzo[b][1,4]dioxin-6-yl)propanoate
methyl 3-(4-hydroxy-6-methyl-2-oxopyran-3-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: 546.2±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.5 mmHg at 25°C
    Enthalpy of Vaporization: 86.8±3.0 kJ/mol
    Flash Point: 194.1±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: 1.89
    ACD/LogD (pH 5.5): 1.27
    ACD/BCF (pH 5.5): 3.94
    ACD/KOC (pH 5.5): 64.08
    ACD/LogD (pH 7.4): -0.47
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.17
    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


    Advertisement