ChemSpider 2D Image | 1-(2-Aminoethyl)-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide | C7H9F3N4O

1-(2-Aminoethyl)-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide

  • Molecular FormulaC7H9F3N4O
  • Average mass222.168 Da
  • Monoisotopic mass222.072845 Da
  • ChemSpider ID53618102

More details:

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

1-(2-Aminoethyl)-3-(trifluormethyl)-1H-pyrazol-5-carboxamid [German] [ACD/IUPAC Name]
1-(2-Aminoethyl)-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide [ACD/IUPAC Name]
1-(2-Aminoéthyl)-3-(trifluorométhyl)-1H-pyrazole-5-carboxamide [French] [ACD/IUPAC Name]
1H-Pyrazole-5-carboxamide, 1-(2-aminoethyl)-3-(trifluoromethyl)- [ACD/Index Name]
2098069-53-3 [RN]
MFCD30005782

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

    Density: 1.6±0.1 g/cm3
    Boiling Point: 346.0±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 59.0±3.0 kJ/mol
    Flash Point: 163.1±27.9 °C
    Index of Refraction: 1.556
    Molar Refractivity: 44.1±0.5 cm3
    #H bond acceptors: 5
    #H bond donors: 4
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: -0.63
    ACD/LogD (pH 5.5): -3.56
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -1.91
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 87 Å2
    Polarizability: 17.5±0.5 10-24cm3
    Surface Tension: 46.9±7.0 dyne/cm
    Molar Volume: 137.2±7.0 cm3

    Click to predict properties on the Chemicalize site


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