ChemSpider 2D Image | [2-(4-Methoxyphenyl)-2-oxoethyl]malononitrile | C12H10N2O2

[2-(4-Methoxyphenyl)-2-oxoethyl]malononitrile

  • Molecular FormulaC12H10N2O2
  • Average mass214.220 Da
  • Monoisotopic mass214.074234 Da
  • ChemSpider ID25652437

More details:

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

[2-(4-Methoxyphenyl)-2-oxoethyl]malononitril [German] [ACD/IUPAC Name]
[2-(4-Methoxyphenyl)-2-oxoethyl]malononitrile [ACD/IUPAC Name]
[2-(4-Méthoxyphényl)-2-oxoéthyl]malononitrile [French] [ACD/IUPAC Name]
Propanedinitrile, 2-[2-(4-methoxyphenyl)-2-oxoethyl]- [ACD/Index Name]
2-(2-(4-Methoxyphenyl)-2-oxoethyl)malononitrile
2-(2-OXO-2-(4-METHOXYPHENYL)ETHYL)MALONONITRILE
2-[2-(4-methoxy-phenyl)-2-oxo-ethyl]-malononitrile
2-[2-(4-methoxyphenyl)-2-oxoethyl]propanedinitrile
26454-79-5 [RN]
MFCD09835069

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 459.3±40.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.1 mmHg at 25°C
    Enthalpy of Vaporization: 72.0±3.0 kJ/mol
    Flash Point: 200.2±17.6 °C
    Index of Refraction: 1.536
    Molar Refractivity: 56.6±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 0
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 0
    ACD/LogP: 1.84
    ACD/LogD (pH 5.5): 1.80
    ACD/BCF (pH 5.5): 13.76
    ACD/KOC (pH 5.5): 227.26
    ACD/LogD (pH 7.4): 1.80
    ACD/BCF (pH 7.4): 13.76
    ACD/KOC (pH 7.4): 227.26
    Polar Surface Area: 74 Å2
    Polarizability: 22.5±0.5 10-24cm3
    Surface Tension: 49.8±3.0 dyne/cm
    Molar Volume: 181.6±3.0 cm3

    Click to predict properties on the Chemicalize site


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