ChemSpider 2D Image | 2-(3,4-Dimethoxyphenyl)ethyl ethyl oxalate | C14H18O6

2-(3,4-Dimethoxyphenyl)ethyl ethyl oxalate

  • Molecular FormulaC14H18O6
  • Average mass282.289 Da
  • Monoisotopic mass282.110352 Da
  • ChemSpider ID35326268

More details:






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

1443353-71-6 [RN]
2-(3,4-Dimethoxyphenyl)ethyl ethyl oxalate [ACD/IUPAC Name]
2-(3,4-Dimethoxyphenyl)ethyl-ethyloxalat [German] [ACD/IUPAC Name]
Ethanedioic acid, 2-(3,4-dimethoxyphenyl)ethyl ethyl ester [ACD/Index Name]
Oxalate de 2-(3,4-diméthoxyphényl)éthyle et d'éthyle [French] [ACD/IUPAC Name]
3,4-Dimethoxyphenethyl ethyl oxalate
atoms 20 bonds 20
MFCD15145499
O1-[2-(3,4-Dimethoxyphenyl)ethyl] O2-ethyl oxalate

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 377.7±32.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.9 mmHg at 25°C
    Enthalpy of Vaporization: 62.5±3.0 kJ/mol
    Flash Point: 165.2±25.2 °C
    Index of Refraction: 1.498
    Molar Refractivity: 71.2±0.3 cm3
    #H bond acceptors: 6
    #H bond donors: 0
    #Freely Rotating Bonds: 9
    #Rule of 5 Violations: 0
    ACD/LogP: 2.12
    ACD/LogD (pH 5.5): 2.15
    ACD/BCF (pH 5.5): 25.30
    ACD/KOC (pH 5.5): 351.56
    ACD/LogD (pH 7.4): 2.15
    ACD/BCF (pH 7.4): 25.30
    ACD/KOC (pH 7.4): 351.56
    Polar Surface Area: 71 Å2
    Polarizability: 28.2±0.5 10-24cm3
    Surface Tension: 38.5±3.0 dyne/cm
    Molar Volume: 243.2±3.0 cm3

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