ChemSpider 2D Image | 1-[3-Methoxy-4-(3-methylbutoxy)phenyl]-5,7-dimethyl-2-(3-pyridinylmethyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione | C31H32N2O5

1-[3-Methoxy-4-(3-methylbutoxy)phenyl]-5,7-dimethyl-2-(3-pyridinylmethyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione

  • Molecular FormulaC31H32N2O5
  • Average mass512.596 Da
  • Monoisotopic mass512.231140 Da
  • ChemSpider ID4075085

More details:

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

[1]Benzopyrano[2,3-c]pyrrole-3,9-dione, 1,2-dihydro-1-[3-methoxy-4-(3-methylbutoxy)phenyl]-5,7-dimethyl-2-(3-pyridinylmethyl)- [ACD/Index Name]
1-[3-Methoxy-4-(3-methylbutoxy)phenyl]-5,7-dimethyl-2-(3-pyridinylmethyl)-1,2-dihydrochromeno[2,3-c]pyrrol-3,9-dion [German] [ACD/IUPAC Name]
1-[3-Methoxy-4-(3-methylbutoxy)phenyl]-5,7-dimethyl-2-(3-pyridinylmethyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione [ACD/IUPAC Name]
1-[3-Méthoxy-4-(3-méthylbutoxy)phényl]-5,7-diméthyl-2-(3-pyridinylméthyl)-1,2-dihydrochroméno[2,3-c]pyrrole-3,9-dione [French] [ACD/IUPAC Name]
1-[3-methoxy-4-(3-methylbutoxy)phenyl]-5,7-dimethyl-2-(3-pyridylmethyl)chromeno[2,3-c]3-pyrroline-3,9-dione
1-[3-methoxy-4-(3-methylbutoxy)phenyl]-5,7-dimethyl-2-(pyridin-3-ylmethyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
1-[3-methoxy-4-(3-methylbutoxy)phenyl]-5,7-dimethyl-2-(pyridin-3-ylmethyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione
1-[3-Methoxy-4-(3-methyl-butoxy)-phenyl]-5,7-dimethyl-2-pyridin-3-ylmethyl-1,2-dihydro-4-oxa-2-aza-cyclopenta[b]naphthalene-3,9-dione
879951-87-8 [RN]

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 713.8±60.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.3 mmHg at 25°C
    Enthalpy of Vaporization: 104.3±3.0 kJ/mol
    Flash Point: 385.5±32.9 °C
    Index of Refraction: 1.632
    Molar Refractivity: 143.4±0.4 cm3
    #H bond acceptors: 7
    #H bond donors: 0
    #Freely Rotating Bonds: 8
    #Rule of 5 Violations: 2
    ACD/LogP: 5.40
    ACD/LogD (pH 5.5): 4.93
    ACD/BCF (pH 5.5): 3125.59
    ACD/KOC (pH 5.5): 10426.81
    ACD/LogD (pH 7.4): 5.02
    ACD/BCF (pH 7.4): 3820.04
    ACD/KOC (pH 7.4): 12743.45
    Polar Surface Area: 78 Å2
    Polarizability: 56.9±0.5 10-24cm3
    Surface Tension: 58.8±5.0 dyne/cm
    Molar Volume: 402.1±5.0 cm3

    Click to predict properties on the Chemicalize site


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