ChemSpider 2D Image | 5,7-Dihydroxy-6-[4-(5-hydroxy-7-methoxy-4-oxo-4H-chromen-2-yl)phenoxy]-2-(4-hydroxyphenyl)-4H-chromen-4-one | C31H20O10

5,7-Dihydroxy-6-[4-(5-hydroxy-7-methoxy-4-oxo-4H-chromen-2-yl)phenoxy]-2-(4-hydroxyphenyl)-4H-chromen-4-one

  • Molecular FormulaC31H20O10
  • Average mass552.484 Da
  • Monoisotopic mass552.105652 Da
  • ChemSpider ID4478234

More details:






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

4H-1-Benzopyran-4-one, 5,7-dihydroxy-6-[4-(5-hydroxy-7-methoxy-4-oxo-4H-1-benzopyran-2-yl)phenoxy]-2-(4-hydroxyphenyl)- [ACD/Index Name]
5,7-Dihydroxy-6-[4-(5-hydroxy-7-methoxy-4-oxo-4H-chromen-2-yl)phenoxy]-2-(4-hydroxyphenyl)-4H-chromen-4-on [German] [ACD/IUPAC Name]
5,7-Dihydroxy-6-[4-(5-hydroxy-7-methoxy-4-oxo-4H-chromen-2-yl)phenoxy]-2-(4-hydroxyphenyl)-4H-chromen-4-one [ACD/IUPAC Name]
5,7-Dihydroxy-6-[4-(5-hydroxy-7-méthoxy-4-oxo-4H-chromén-2-yl)phénoxy]-2-(4-hydroxyphényl)-4H-chromén-4-one [French] [ACD/IUPAC Name]
20931-36-6 [RN]
5,7-dihydroxy-6-[4-(5-hydroxy-7-methoxy-4-oxochromen-2-yl)phenoxy]-2-(4-hydroxyphenyl)chromen-4-one
Neocryptomerin

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

    Density: 1.5±0.1 g/cm3
    Boiling Point: 816.4±65.0 °C at 760 mmHg
    Vapour Pressure: 0.0±3.0 mmHg at 25°C
    Enthalpy of Vaporization: 122.8±3.0 kJ/mol
    Flash Point: 273.3±27.8 °C
    Index of Refraction: 1.731
    Molar Refractivity: 142.8±0.3 cm3
    #H bond acceptors: 10
    #H bond donors: 4
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 2
    ACD/LogP: 4.59
    ACD/LogD (pH 5.5): 4.31
    ACD/BCF (pH 5.5): 920.47
    ACD/KOC (pH 5.5): 3660.28
    ACD/LogD (pH 7.4): 1.29
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 3.45
    Polar Surface Area: 152 Å2
    Polarizability: 56.6±0.5 10-24cm3
    Surface Tension: 76.8±3.0 dyne/cm
    Molar Volume: 357.4±3.0 cm3

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