ChemSpider 2D Image | 3-(3,4-Dimethoxyphenyl)-2-methyl-4-oxo-4H-chromen-7-yl 3,4,5-trimethoxybenzoate | C28H26O9

3-(3,4-Dimethoxyphenyl)-2-methyl-4-oxo-4H-chromen-7-yl 3,4,5-trimethoxybenzoate

  • Molecular FormulaC28H26O9
  • Average mass506.501 Da
  • Monoisotopic mass506.157684 Da
  • ChemSpider ID1385109

More details:

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

3-(3,4-Dimethoxyphenyl)-2-methyl-4-oxo-4H-chromen-7-yl 3,4,5-trimethoxybenzoate [ACD/IUPAC Name]
3-(3,4-Dimethoxyphenyl)-2-methyl-4-oxo-4H-chromen-7-yl-3,4,5-trimethoxybenzoat [German] [ACD/IUPAC Name]
3,4,5-Triméthoxybenzoate de 3-(3,4-diméthoxyphényl)-2-méthyl-4-oxo-4H-chromén-7-yle [French] [ACD/IUPAC Name]
Benzoic acid, 3,4,5-trimethoxy-, 3-(3,4-dimethoxyphenyl)-2-methyl-4-oxo-4H-1-benzopyran-7-yl ester [ACD/Index Name]
[3-(3,4-dimethoxyphenyl)-2-methyl-4-oxochromen-7-yl] 3,4,5-trimethoxybenzoate
3-(3,4-dimethoxyphenyl)-2-methyl-4-oxochromen-7-yl 3,4,5-trimethoxybenzoate
3,4,5-Trimethoxy-benzoic acid 3-(3,4-dimethoxy-phenyl)-2-methyl-4-oxo-4H-chromen-7-yl ester
618389-12-1 [RN]
AC1LWJ98
AGN-PC-0K8UZJ
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.3±0.1 g/cm3
    Boiling Point: 626.7±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.8 mmHg at 25°C
    Enthalpy of Vaporization: 92.8±3.0 kJ/mol
    Flash Point: 266.3±31.5 °C
    Index of Refraction: 1.583
    Molar Refractivity: 133.9±0.3 cm3
    #H bond acceptors: 9
    #H bond donors: 0
    #Freely Rotating Bonds: 9
    #Rule of 5 Violations: 2
    ACD/LogP: 5.55
    ACD/LogD (pH 5.5): 4.25
    ACD/BCF (pH 5.5): 992.96
    ACD/KOC (pH 5.5): 4861.89
    ACD/LogD (pH 7.4): 4.25
    ACD/BCF (pH 7.4): 992.96
    ACD/KOC (pH 7.4): 4861.89
    Polar Surface Area: 99 Å2
    Polarizability: 53.1±0.5 10-24cm3
    Surface Tension: 45.9±3.0 dyne/cm
    Molar Volume: 400.7±3.0 cm3

    Click to predict properties on the Chemicalize site


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