ChemSpider 2D Image | Methyl 3-(5,7-dihydroxy-4-oxo-2-phenyl-4H-chromen-8-yl)-3-[4-methoxy-3-(2-methoxy-2-oxoethoxy)phenyl]propanoate | C29H26O10

Methyl 3-(5,7-dihydroxy-4-oxo-2-phenyl-4H-chromen-8-yl)-3-[4-methoxy-3-(2-methoxy-2-oxoethoxy)phenyl]propanoate

  • Molecular FormulaC29H26O10
  • Average mass534.511 Da
  • Monoisotopic mass534.152588 Da
  • ChemSpider ID29771974

More details:

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

3-(5,7-Dihydroxy-4-oxo-2-phényl-4H-chromén-8-yl)-3-[4-méthoxy-3-(2-méthoxy-2-oxoéthoxy)phényl]propanoate de méthyle [French] [ACD/IUPAC Name]
4H-1-Benzopyran-8-propanoic acid, 5,7-dihydroxy-β-[4-methoxy-3-(2-methoxy-2-oxoethoxy)phenyl]-4-oxo-2-phenyl-, methyl ester [ACD/Index Name]
Methyl 3-(5,7-dihydroxy-4-oxo-2-phenyl-4H-chromen-8-yl)-3-[4-methoxy-3-(2-methoxy-2-oxoethoxy)phenyl]propanoate [ACD/IUPAC Name]
Methyl-3-(5,7-dihydroxy-4-oxo-2-phenyl-4H-chromen-8-yl)-3-[4-methoxy-3-(2-methoxy-2-oxoethoxy)phenyl]propanoat [German] [ACD/IUPAC Name]
1574477-70-5 [RN]
methyl 3-(5,7-dihydroxy-4-oxo-2-phenylchromen-8-yl)-3-[4-methoxy-3-(2-methoxy-2-oxoethoxy)phenyl]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: 705.5±60.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.3 mmHg at 25°C
    Enthalpy of Vaporization: 106.9±3.0 kJ/mol
    Flash Point: 232.0±26.4 °C
    Index of Refraction: 1.615
    Molar Refractivity: 137.4±0.3 cm3
    #H bond acceptors: 10
    #H bond donors: 2
    #Freely Rotating Bonds: 11
    #Rule of 5 Violations: 2
    ACD/LogP: 3.43
    ACD/LogD (pH 5.5): 3.60
    ACD/BCF (pH 5.5): 309.30
    ACD/KOC (pH 5.5): 2043.86
    ACD/LogD (pH 7.4): 2.62
    ACD/BCF (pH 7.4): 32.97
    ACD/KOC (pH 7.4): 217.88
    Polar Surface Area: 138 Å2
    Polarizability: 54.5±0.5 10-24cm3
    Surface Tension: 57.6±3.0 dyne/cm
    Molar Volume: 393.8±3.0 cm3

    Click to predict properties on the Chemicalize site


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