ChemSpider 2D Image | (3E)-1-(1,3-Benzodioxol-5-yl)-3-(4-hydroxy-3-methoxybenzylidene)-2,5-pyrrolidinedione | C19H15NO6

(3E)-1-(1,3-Benzodioxol-5-yl)-3-(4-hydroxy-3-methoxybenzylidene)-2,5-pyrrolidinedione

  • Molecular FormulaC19H15NO6
  • Average mass353.326 Da
  • Monoisotopic mass353.089935 Da
  • ChemSpider ID27322761

  • Double-bond stereo - Double-bond stereo

More details:

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

(3E)-1-(1,3-Benzodioxol-5-yl)-3-(4-hydroxy-3-methoxybenzyliden)-2,5-pyrrolidindion [German] [ACD/IUPAC Name]
(3E)-1-(1,3-Benzodioxol-5-yl)-3-(4-hydroxy-3-methoxybenzylidene)-2,5-pyrrolidinedione [ACD/IUPAC Name]
(3E)-1-(1,3-Benzodioxol-5-yl)-3-(4-hydroxy-3-méthoxybenzylidène)-2,5-pyrrolidinedione [French] [ACD/IUPAC Name]
2,5-Pyrrolidinedione, 1-(1,3-benzodioxol-5-yl)-3-[(4-hydroxy-3-methoxyphenyl)methylene]-, (3E)- [ACD/Index Name]
(3E)-1-(1,3-benzodioxol-5-yl)-3-(4-hydroxy-3-methoxybenzylidene)pyrrolidine-2,5-dione
(3E)-1-(1,3-benzodioxol-5-yl)-3-[(4-hydroxy-3-methoxyphenyl)methylidene]pyrrolidine-2,5-dione
1324362-94-8 [RN]

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

    Density: 1.5±0.1 g/cm3
    Boiling Point: 573.2±60.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.6 mmHg at 25°C
    Enthalpy of Vaporization: 89.1±3.0 kJ/mol
    Flash Point: 300.5±32.9 °C
    Index of Refraction: 1.700
    Molar Refractivity: 92.1±0.3 cm3
    #H bond acceptors: 7
    #H bond donors: 1
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 2.02
    ACD/LogD (pH 5.5): 1.62
    ACD/BCF (pH 5.5): 9.95
    ACD/KOC (pH 5.5): 180.30
    ACD/LogD (pH 7.4): 1.61
    ACD/BCF (pH 7.4): 9.78
    ACD/KOC (pH 7.4): 177.22
    Polar Surface Area: 85 Å2
    Polarizability: 36.5±0.5 10-24cm3
    Surface Tension: 70.4±3.0 dyne/cm
    Molar Volume: 238.4±3.0 cm3

    Click to predict properties on the Chemicalize site


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