ChemSpider 2D Image | (4E)-4-[2,3-Dihydro-1,4-benzodioxin-6-yl(hydroxy)methylene]-5-(2,3-dimethoxyphenyl)-1-[3-(4-morpholinyl)propyl]-2,3-pyrrolidinedione | C28H32N2O8

(4E)-4-[2,3-Dihydro-1,4-benzodioxin-6-yl(hydroxy)methylene]-5-(2,3-dimethoxyphenyl)-1-[3-(4-morpholinyl)propyl]-2,3-pyrrolidinedione

  • Molecular FormulaC28H32N2O8
  • Average mass524.562 Da
  • Monoisotopic mass524.215881 Da
  • ChemSpider ID21355077

  • Double-bond stereo - Double-bond stereo

More details:

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

(4E)-4-[2,3-Dihydro-1,4-benzodioxin-6-yl(hydroxy)methylen]-5-(2,3-dimethoxyphenyl)-1-[3-(4-morpholinyl)propyl]-2,3-pyrrolidindion [German] [ACD/IUPAC Name]
(4E)-4-[2,3-Dihydro-1,4-benzodioxin-6-yl(hydroxy)methylene]-5-(2,3-dimethoxyphenyl)-1-[3-(4-morpholinyl)propyl]-2,3-pyrrolidinedione [ACD/IUPAC Name]
(4E)-4-[2,3-Dihydro-1,4-benzodioxin-6-yl(hydroxy)méthylène]-5-(2,3-diméthoxyphényl)-1-[3-(4-morpholinyl)propyl]-2,3-pyrrolidinedione [French] [ACD/IUPAC Name]
(4E)-4-[2,3-Dihydro-1,4-benzodioxin-6-yl(hydroxy)methylene]-5-(2,3-dimethoxyphenyl)-1-[3-(morpholin-4-yl)propyl]pyrrolidine-2,3-dione
2,3-Pyrrolidinedione, 4-[(2,3-dihydro-1,4-benzodioxin-6-yl)hydroxymethylene]-5-(2,3-dimethoxyphenyl)-1-[3-(4-morpholinyl)propyl]-, (4E)- [ACD/Index Name]
(4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-5-(2,3-dimethoxyphenyl)-1-(3-morpholin-4-ylpropyl)pyrrolidine-2,3-dione
(4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-5-(2,3-dimethoxyphenyl)-1-[3-(morpholin-4-yl)propyl]pyrrolidine-2,3-dione

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 687.3±65.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.2 mmHg at 25°C
    Enthalpy of Vaporization: 105.8±3.0 kJ/mol
    Flash Point: 369.5±34.3 °C
    Index of Refraction: 1.600
    Molar Refractivity: 137.3±0.3 cm3
    #H bond acceptors: 10
    #H bond donors: 1
    #Freely Rotating Bonds: 8
    #Rule of 5 Violations: 2
    ACD/LogP: 2.53
    ACD/LogD (pH 5.5): 0.21
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 5.91
    ACD/LogD (pH 7.4): 1.47
    ACD/BCF (pH 7.4): 6.52
    ACD/KOC (pH 7.4): 108.44
    Polar Surface Area: 107 Å2
    Polarizability: 54.4±0.5 10-24cm3
    Surface Tension: 53.1±3.0 dyne/cm
    Molar Volume: 401.2±3.0 cm3

    Click to predict properties on the Chemicalize site


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