ChemSpider 2D Image | Methyl 3-[2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-4-oxo-4H-chromen-8-yl]-3-(4-methoxy-1-naphthyl)propanoate | C30H24O10

Methyl 3-[2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-4-oxo-4H-chromen-8-yl]-3-(4-methoxy-1-naphthyl)propanoate

  • Molecular FormulaC30H24O10
  • Average mass544.506 Da
  • Monoisotopic mass544.136963 Da
  • ChemSpider ID29771465

More details:

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

3-[2-(3,4-Dihydroxyphényl)-3,5,7-trihydroxy-4-oxo-4H-chromén-8-yl]-3-(4-méthoxy-1-naphtyl)propanoate de méthyle [French] [ACD/IUPAC Name]
4H-1-Benzopyran-8-propanoic acid, 2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-β-(4-methoxy-1-naphthalenyl)-4-oxo-, methyl ester [ACD/Index Name]
Methyl 3-[2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-4-oxo-4H-chromen-8-yl]-3-(4-methoxy-1-naphthyl)propanoate [ACD/IUPAC Name]
Methyl-3-[2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-4-oxo-4H-chromen-8-yl]-3-(4-methoxy-1-naphthyl)propanoat [German] [ACD/IUPAC Name]
1574470-74-8 [RN]
methyl 3-[2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-4-oxochromen-8-yl]-3-(4-methoxynaphthalen-1-yl)propanoate

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

    Density: 1.5±0.1 g/cm3
    Boiling Point: 814.9±65.0 °C at 760 mmHg
    Vapour Pressure: 0.0±3.0 mmHg at 25°C
    Enthalpy of Vaporization: 122.5±3.0 kJ/mol
    Flash Point: 271.8±27.8 °C
    Index of Refraction: 1.726
    Molar Refractivity: 142.8±0.3 cm3
    #H bond acceptors: 10
    #H bond donors: 5
    #Freely Rotating Bonds: 7
    #Rule of 5 Violations: 3
    ACD/LogP: 4.76
    ACD/LogD (pH 5.5): 4.34
    ACD/BCF (pH 5.5): 1110.56
    ACD/KOC (pH 5.5): 4912.73
    ACD/LogD (pH 7.4): 2.85
    ACD/BCF (pH 7.4): 35.58
    ACD/KOC (pH 7.4): 157.40
    Polar Surface Area: 163 Å2
    Polarizability: 56.6±0.5 10-24cm3
    Surface Tension: 78.5±3.0 dyne/cm
    Molar Volume: 359.2±3.0 cm3

    Click to predict properties on the Chemicalize site


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