ChemSpider 2D Image | Methyl 3-(4-hydroxy-2-oxo-2H-chromen-3-yl)-3-{3-methoxy-4-[2-(4-methoxyphenyl)ethoxy]phenyl}propanoate | C29H28O8

Methyl 3-(4-hydroxy-2-oxo-2H-chromen-3-yl)-3-{3-methoxy-4-[2-(4-methoxyphenyl)ethoxy]phenyl}propanoate

  • Molecular FormulaC29H28O8
  • Average mass504.528 Da
  • Monoisotopic mass504.178406 Da
  • ChemSpider ID34496749

More details:

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

2H-1-Benzopyran-3-propanoic acid, 4-hydroxy-β-[3-methoxy-4-[2-(4-methoxyphenyl)ethoxy]phenyl]-2-oxo-, methyl ester [ACD/Index Name]
3-(4-Hydroxy-2-oxo-2H-chromén-3-yl)-3-{3-méthoxy-4-[2-(4-méthoxyphényl)éthoxy]phényl}propanoate de méthyle [French] [ACD/IUPAC Name]
Methyl 3-(4-hydroxy-2-oxo-2H-chromen-3-yl)-3-{3-methoxy-4-[2-(4-methoxyphenyl)ethoxy]phenyl}propanoate [ACD/IUPAC Name]
Methyl-3-(4-hydroxy-2-oxo-2H-chromen-3-yl)-3-{3-methoxy-4-[2-(4-methoxyphenyl)ethoxy]phenyl}propanoat [German] [ACD/IUPAC Name]
1676097-00-9 [RN]
methyl 3-(4-hydroxy-2-oxo-2H-chromen-3-yl)-3-(3-methoxy-4-(4-methoxyphenethoxy)phenyl)propanoate
methyl 3-(4-hydroxy-2-oxochromen-3-yl)-3-[3-methoxy-4-[2-(4-methoxyphenyl)ethoxy]phenyl]propanoate

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 694.9±55.0 °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: 229.5±25.0 °C
    Index of Refraction: 1.608
    Molar Refractivity: 135.3±0.3 cm3
    #H bond acceptors: 8
    #H bond donors: 1
    #Freely Rotating Bonds: 11
    #Rule of 5 Violations: 2
    ACD/LogP: 5.54
    ACD/LogD (pH 5.5): 4.23
    ACD/BCF (pH 5.5): 543.55
    ACD/KOC (pH 5.5): 1599.19
    ACD/LogD (pH 7.4): 2.47
    ACD/BCF (pH 7.4): 9.38
    ACD/KOC (pH 7.4): 27.59
    Polar Surface Area: 101 Å2
    Polarizability: 53.7±0.5 10-24cm3
    Surface Tension: 54.4±3.0 dyne/cm
    Molar Volume: 391.3±3.0 cm3

    Click to predict properties on the Chemicalize site


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