ChemSpider 2D Image | (4E)-5-[3-Ethoxy-4-(3-methylbutoxy)phenyl]-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylene]-1-(2-methoxyethyl)-2,3-pyrrolidinedione | C30H37NO7

(4E)-5-[3-Ethoxy-4-(3-methylbutoxy)phenyl]-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylene]-1-(2-methoxyethyl)-2,3-pyrrolidinedione

  • Molecular FormulaC30H37NO7
  • Average mass523.617 Da
  • Monoisotopic mass523.257019 Da
  • ChemSpider ID4854242

  • Double-bond stereo - Double-bond stereo

More details:

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

(4E)-5-[3-Ethoxy-4-(3-methylbutoxy)phenyl]-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylen]-1-(2-methoxyethyl)-2,3-pyrrolidindion [German] [ACD/IUPAC Name]
(4E)-5-[3-Ethoxy-4-(3-methylbutoxy)phenyl]-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylene]-1-(2-methoxyethyl)-2,3-pyrrolidinedione [ACD/IUPAC Name]
(4E)-5-[3-Éthoxy-4-(3-méthylbutoxy)phényl]-4-[hydroxy(2-méthyl-2,3-dihydro-1-benzofuran-5-yl)méthylène]-1-(2-méthoxyéthyl)-2,3-pyrrolidinedione [French] [ACD/IUPAC Name]
2,3-Pyrrolidinedione, 4-[(2,3-dihydro-2-methyl-5-benzofuranyl)hydroxymethylene]-5-[3-ethoxy-4-(3-methylbutoxy)phenyl]-1-(2-methoxyethyl)-, (4E)- [ACD/Index Name]
(4E)-5-[3-ethoxy-4-(3-methylbutoxy)phenyl]-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-1-(2-methoxyethyl)pyrrolidine-2,3-dione
(4E)-5-[3-ethoxy-4-(3-methylbutoxy)phenyl]-4-[hydroxy-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-1-(2-methoxyethyl)pyrrolidine-2,3-dione

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 660.5±65.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.1 mmHg at 25°C
    Enthalpy of Vaporization: 102.1±3.0 kJ/mol
    Flash Point: 353.2±34.3 °C
    Index of Refraction: 1.571
    Molar Refractivity: 143.6±0.3 cm3
    #H bond acceptors: 8
    #H bond donors: 1
    #Freely Rotating Bonds: 11
    #Rule of 5 Violations: 2
    ACD/LogP: 5.81
    ACD/LogD (pH 5.5): 4.53
    ACD/BCF (pH 5.5): 1618.09
    ACD/KOC (pH 5.5): 6888.23
    ACD/LogD (pH 7.4): 4.41
    ACD/BCF (pH 7.4): 1231.46
    ACD/KOC (pH 7.4): 5242.33
    Polar Surface Area: 95 Å2
    Polarizability: 56.9±0.5 10-24cm3
    Surface Tension: 46.5±3.0 dyne/cm
    Molar Volume: 437.1±3.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement