ChemSpider 2D Image | 3-Methoxy-3-methyl-1(3H)-isobenzofuranone | C10H10O3

3-Methoxy-3-methyl-1(3H)-isobenzofuranone

  • Molecular FormulaC10H10O3
  • Average mass178.185 Da
  • Monoisotopic mass178.062988 Da
  • ChemSpider ID58802531

More details:

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

1(3H)-Isobenzofuranone, 3-methoxy-3-methyl- [ACD/Index Name]
1077-59-4 [RN]
3-Methoxy-3-methyl-1(3H)-isobenzofuranone
3-Methoxy-3-methyl-2-benzofuran-1(3H)-on [German] [ACD/IUPAC Name]
3-Methoxy-3-methyl-2-benzofuran-1(3H)-one [ACD/IUPAC Name]
3-Méthoxy-3-méthyl-2-benzofuran-1(3H)-one [French] [ACD/IUPAC Name]
3-methoxy-3-methyl-1,3-dihydro-2-benzofuran-1-one
3-methoxy-3-methyl-2-benzofuran-1-one
3-Methoxy-3-Methylisobenzofuran-1(3H)-One
MFCD18452443

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 313.8±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 55.5±3.0 kJ/mol
    Flash Point: 128.4±22.5 °C
    Index of Refraction: 1.551
    Molar Refractivity: 46.8±0.4 cm3
    #H bond acceptors: 3
    #H bond donors: 0
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 1.01
    ACD/LogD (pH 5.5): 1.48
    ACD/BCF (pH 5.5): 7.83
    ACD/KOC (pH 5.5): 151.81
    ACD/LogD (pH 7.4): 1.48
    ACD/BCF (pH 7.4): 7.83
    ACD/KOC (pH 7.4): 151.81
    Polar Surface Area: 36 Å2
    Polarizability: 18.6±0.5 10-24cm3
    Surface Tension: 42.5±5.0 dyne/cm
    Molar Volume: 146.7±5.0 cm3

    Click to predict properties on the Chemicalize site


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