ChemSpider 2D Image | 3-[3-Hydroxy-6-(methoxymethyl)-4-oxo-4H-pyran-2-yl]-3-(6-oxo-5,6-dihydro[1,3]dioxolo[4,5-g]quinolin-7-yl)propanamide | C20H18N2O8

3-[3-Hydroxy-6-(methoxymethyl)-4-oxo-4H-pyran-2-yl]-3-(6-oxo-5,6-dihydro[1,3]dioxolo[4,5-g]quinolin-7-yl)propanamide

  • Molecular FormulaC20H18N2O8
  • Average mass414.366 Da
  • Monoisotopic mass414.106323 Da
  • ChemSpider ID32512145

More details:

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

1,3-Dioxolo[4,5-g]quinoline-7-propanamide, 5,6-dihydro-β-[3-hydroxy-6-(methoxymethyl)-4-oxo-4H-pyran-2-yl]-6-oxo- [ACD/Index Name]
3-[3-Hydroxy-6-(methoxymethyl)-4-oxo-4H-pyran-2-yl]-3-(6-oxo-5,6-dihydro[1,3]dioxolo[4,5-g]chinolin-7-yl)propanamid [German] [ACD/IUPAC Name]
3-[3-Hydroxy-6-(méthoxyméthyl)-4-oxo-4H-pyran-2-yl]-3-(6-oxo-5,6-dihydro[1,3]dioxolo[4,5-g]quinoléin-7-yl)propanamide [French] [ACD/IUPAC Name]
3-[3-Hydroxy-6-(methoxymethyl)-4-oxo-4H-pyran-2-yl]-3-(6-oxo-5,6-dihydro[1,3]dioxolo[4,5-g]quinolin-7-yl)propanamide [ACD/IUPAC Name]
1630870-55-1 [RN]
3-[3-hydroxy-6-(methoxymethyl)-4-oxopyran-2-yl]-3-(6-oxo-5H-[1,3]dioxolo[4,5-g]quinolin-7-yl)propanamide

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

    Density: 1.5±0.1 g/cm3
    Boiling Point: 754.8±60.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.7 mmHg at 25°C
    Enthalpy of Vaporization: 115.4±3.0 kJ/mol
    Flash Point: 410.3±32.9 °C
    Index of Refraction: 1.654
    Molar Refractivity: 99.7±0.3 cm3
    #H bond acceptors: 10
    #H bond donors: 4
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 1
    ACD/LogP: 0.87
    ACD/LogD (pH 5.5): 0.06
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 25.68
    ACD/LogD (pH 7.4): -0.08
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 18.65
    Polar Surface Area: 146 Å2
    Polarizability: 39.5±0.5 10-24cm3
    Surface Tension: 70.4±3.0 dyne/cm
    Molar Volume: 272.2±3.0 cm3

    Click to predict properties on the Chemicalize site


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