ChemSpider 2D Image | Ethyl 2-oxo-1-(2,2,2-trifluoroethyl)-1,2-dihydro-5-pyrimidinecarboxylate | C9H9F3N2O3

Ethyl 2-oxo-1-(2,2,2-trifluoroethyl)-1,2-dihydro-5-pyrimidinecarboxylate

  • Molecular FormulaC9H9F3N2O3
  • Average mass250.175 Da
  • Monoisotopic mass250.056534 Da
  • ChemSpider ID35329357

More details:

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

1402232-92-1 [RN]
2-Oxo-1-(2,2,2-trifluoroéthyl)-1,2-dihydro-5-pyrimidinecarboxylate d'éthyle [French] [ACD/IUPAC Name]
5-Pyrimidinecarboxylic acid, 1,2-dihydro-2-oxo-1-(2,2,2-trifluoroethyl)-, ethyl ester [ACD/Index Name]
Ethyl 2-oxo-1-(2,2,2-trifluoroethyl)-1,2-dihydro-5-pyrimidinecarboxylate [ACD/IUPAC Name]
Ethyl 2-oxo-1-(2,2,2-trifluoroethyl)-1,2-dihydropyrimidine-5-carboxylate
Ethyl-2-oxo-1-(2,2,2-trifluorethyl)-1,2-dihydro-5-pyrimidincarboxylat [German] [ACD/IUPAC Name]
KS-7650
MFCD26096766

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 277.8±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.6 mmHg at 25°C
    Enthalpy of Vaporization: 51.6±3.0 kJ/mol
    Flash Point: 121.8±30.1 °C
    Index of Refraction: 1.488
    Molar Refractivity: 51.5±0.5 cm3
    #H bond acceptors: 5
    #H bond donors: 0
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 0.48
    ACD/LogD (pH 5.5): 0.59
    ACD/BCF (pH 5.5): 1.66
    ACD/KOC (pH 5.5): 49.93
    ACD/LogD (pH 7.4): 0.59
    ACD/BCF (pH 7.4): 1.66
    ACD/KOC (pH 7.4): 49.93
    Polar Surface Area: 59 Å2
    Polarizability: 20.4±0.5 10-24cm3
    Surface Tension: 36.4±7.0 dyne/cm
    Molar Volume: 178.8±7.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement