ChemSpider 2D Image | Methyl 5-(2-acetyl-2-{[5-(methoxycarbonyl)-2-furyl]methyl}-3-oxobutyl)-2-furoate | C19H20O8

Methyl 5-(2-acetyl-2-{[5-(methoxycarbonyl)-2-furyl]methyl}-3-oxobutyl)-2-furoate

  • Molecular FormulaC19H20O8
  • Average mass376.357 Da
  • Monoisotopic mass376.115814 Da
  • ChemSpider ID21588335

More details:

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

2-Furancarboxylic acid, 5,5'-(2,2-diacetyl-1,3-propanediyl)bis-, dimethyl ester [ACD/Index Name]
5-(2-Acétyl-2-{[5-(méthoxycarbonyl)-2-furyl]méthyl}-3-oxobutyl)-2-furoate de méthyle [French] [ACD/IUPAC Name]
Methyl 5-(2-acetyl-2-{[5-(methoxycarbonyl)-2-furyl]methyl}-3-oxobutyl)-2-furoate [ACD/IUPAC Name]
Methyl-5-(2-acetyl-2-{[5-(methoxycarbonyl)-2-furyl]methyl}-3-oxobutyl)-2-furoat [German] [ACD/IUPAC Name]
73219-38-2 [RN]
dimethyl 5,5'-(2,2-diacetylpropane-1,3-diyl)bis(furan-2-carboxylate)
methyl 5-(2-acetyl-2-{[5-(methoxycarbonyl)-2-furyl]methyl}-3-oxobutyl)-2-furoate (non-preferred name)
methyl 5-(2-acetyl-2-{[5-(methoxycarbonyl)furan-2-yl]methyl}-3-oxobutyl)furan-2-carboxylate

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 511.9±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.3 mmHg at 25°C
    Enthalpy of Vaporization: 78.3±3.0 kJ/mol
    Flash Point: 263.4±30.1 °C
    Index of Refraction: 1.520
    Molar Refractivity: 91.6±0.3 cm3
    #H bond acceptors: 8
    #H bond donors: 0
    #Freely Rotating Bonds: 10
    #Rule of 5 Violations: 0
    ACD/LogP: 0.93
    ACD/LogD (pH 5.5): 1.88
    ACD/BCF (pH 5.5): 15.83
    ACD/KOC (pH 5.5): 251.33
    ACD/LogD (pH 7.4): 1.88
    ACD/BCF (pH 7.4): 15.83
    ACD/KOC (pH 7.4): 251.33
    Polar Surface Area: 113 Å2
    Polarizability: 36.3±0.5 10-24cm3
    Surface Tension: 44.5±3.0 dyne/cm
    Molar Volume: 301.1±3.0 cm3

    Click to predict properties on the Chemicalize site


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