ChemSpider 2D Image | Methyl 3-(2-oxo-1,2-dihydro-3-quinolinyl)-3-(5,6,7-trihydroxy-4-oxo-2-phenyl-4H-chromen-8-yl)propanoate | C28H21NO8

Methyl 3-(2-oxo-1,2-dihydro-3-quinolinyl)-3-(5,6,7-trihydroxy-4-oxo-2-phenyl-4H-chromen-8-yl)propanoate

  • Molecular FormulaC28H21NO8
  • Average mass499.468 Da
  • Monoisotopic mass499.126709 Da
  • ChemSpider ID30717194

More details:

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

3-(2-Oxo-1,2-dihydro-3-quinoléinyl)-3-(5,6,7-trihydroxy-4-oxo-2-phényl-4H-chromén-8-yl)propanoate de méthyle [French] [ACD/IUPAC Name]
3-Quinolinepropanoic acid, 1,2-dihydro-2-oxo-β-(5,6,7-trihydroxy-4-oxo-2-phenyl-4H-1-benzopyran-8-yl)-, methyl ester [ACD/Index Name]
Methyl 3-(2-oxo-1,2-dihydro-3-quinolinyl)-3-(5,6,7-trihydroxy-4-oxo-2-phenyl-4H-chromen-8-yl)propanoate [ACD/IUPAC Name]
Methyl-3-(2-oxo-1,2-dihydro-3-chinolinyl)-3-(5,6,7-trihydroxy-4-oxo-2-phenyl-4H-chromen-8-yl)propanoat [German] [ACD/IUPAC Name]
1574345-37-1 [RN]
methyl 3-(2-oxo-1,2-dihydroquinolin-3-yl)-3-(5,6,7-trihydroxy-4-oxo-2-phenyl-4H-chromen-8-yl)propanoate
methyl 3-(2-oxo-1H-quinolin-3-yl)-3-(5,6,7-trihydroxy-4-oxo-2-phenylchromen-8-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: 853.2±65.0 °C at 760 mmHg
    Vapour Pressure: 0.0±3.3 mmHg at 25°C
    Enthalpy of Vaporization: 128.2±3.0 kJ/mol
    Flash Point: 469.8±34.3 °C
    Index of Refraction: 1.697
    Molar Refractivity: 129.9±0.3 cm3
    #H bond acceptors: 9
    #H bond donors: 4
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 0
    ACD/LogP: 4.49
    ACD/LogD (pH 5.5): 3.90
    ACD/BCF (pH 5.5): 490.93
    ACD/KOC (pH 5.5): 2619.61
    ACD/LogD (pH 7.4): 2.16
    ACD/BCF (pH 7.4): 8.90
    ACD/KOC (pH 7.4): 47.48
    Polar Surface Area: 142 Å2
    Polarizability: 51.5±0.5 10-24cm3
    Surface Tension: 72.3±3.0 dyne/cm
    Molar Volume: 337.3±3.0 cm3

    Click to predict properties on the Chemicalize site


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