ChemSpider 2D Image | Methyl 3-[7-hydroxy-3-(4-hydroxyphenyl)-4-oxo-4H-chromen-8-yl]-3-[3-(2-methoxy-2-oxoethoxy)phenyl]propanoate | C28H24O9

Methyl 3-[7-hydroxy-3-(4-hydroxyphenyl)-4-oxo-4H-chromen-8-yl]-3-[3-(2-methoxy-2-oxoethoxy)phenyl]propanoate

  • Molecular FormulaC28H24O9
  • Average mass504.485 Da
  • Monoisotopic mass504.142029 Da
  • ChemSpider ID30718317

More details:

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

3-[7-Hydroxy-3-(4-hydroxyphényl)-4-oxo-4H-chromén-8-yl]-3-[3-(2-méthoxy-2-oxoéthoxy)phényl]propanoate de méthyle [French] [ACD/IUPAC Name]
4H-1-Benzopyran-8-propanoic acid, 7-hydroxy-3-(4-hydroxyphenyl)-β-[3-(2-methoxy-2-oxoethoxy)phenyl]-4-oxo-, methyl ester [ACD/Index Name]
Methyl 3-[7-hydroxy-3-(4-hydroxyphenyl)-4-oxo-4H-chromen-8-yl]-3-[3-(2-methoxy-2-oxoethoxy)phenyl]propanoate [ACD/IUPAC Name]
Methyl-3-[7-hydroxy-3-(4-hydroxyphenyl)-4-oxo-4H-chromen-8-yl]-3-[3-(2-methoxy-2-oxoethoxy)phenyl]propanoat [German] [ACD/IUPAC Name]
1574353-26-6 [RN]
methyl 3-(7-hydroxy-3-(4-hydroxyphenyl)-4-oxo-4H-chromen-8-yl)-3-(3-(2-methoxy-2-oxoethoxy)phenyl)propanoate
methyl 3-[7-hydroxy-3-(4-hydroxyphenyl)-4-oxochromen-8-yl]-3-[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: 711.4±60.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.4 mmHg at 25°C
    Enthalpy of Vaporization: 107.7±3.0 kJ/mol
    Flash Point: 238.0±26.4 °C
    Index of Refraction: 1.625
    Molar Refractivity: 130.7±0.3 cm3
    #H bond acceptors: 9
    #H bond donors: 2
    #Freely Rotating Bonds: 10
    #Rule of 5 Violations: 1
    ACD/LogP: 3.51
    ACD/LogD (pH 5.5): 4.00
    ACD/BCF (pH 5.5): 635.47
    ACD/KOC (pH 5.5): 3469.10
    ACD/LogD (pH 7.4): 3.23
    ACD/BCF (pH 7.4): 108.91
    ACD/KOC (pH 7.4): 594.57
    Polar Surface Area: 129 Å2
    Polarizability: 51.8±0.5 10-24cm3
    Surface Tension: 59.3±3.0 dyne/cm
    Molar Volume: 369.8±3.0 cm3

    Click to predict properties on the Chemicalize site


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