ChemSpider 2D Image | 3-Phenyl-1-(2,2,2-trifluoroethyl)-1H-pyrazol-5-amine | C11H10F3N3

3-Phenyl-1-(2,2,2-trifluoroethyl)-1H-pyrazol-5-amine

  • Molecular FormulaC11H10F3N3
  • Average mass241.212 Da
  • Monoisotopic mass241.082687 Da
  • ChemSpider ID28296683

More details:






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

1365988-18-6 [RN]
1H-Pyrazol-5-amine, 3-phenyl-1-(2,2,2-trifluoroethyl)- [ACD/Index Name]
3-Phenyl-1-(2,2,2-trifluorethyl)-1H-pyrazol-5-amin [German] [ACD/IUPAC Name]
3-Phenyl-1-(2,2,2-trifluoroethyl)-1H-pyrazol-5-amine [ACD/IUPAC Name]
3-Phényl-1-(2,2,2-trifluoroéthyl)-1H-pyrazol-5-amine [French] [ACD/IUPAC Name]
5-phenyl-2-(2,2,2-trifluoroethyl)pyrazol-3-amine
KS-7182
MFCD21602182

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 354.8±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 60.0±3.0 kJ/mol
    Flash Point: 168.4±27.9 °C
    Index of Refraction: 1.552
    Molar Refractivity: 57.2±0.5 cm3
    #H bond acceptors: 3
    #H bond donors: 2
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 2.49
    ACD/LogD (pH 5.5): 2.21
    ACD/BCF (pH 5.5): 28.33
    ACD/KOC (pH 5.5): 380.99
    ACD/LogD (pH 7.4): 2.21
    ACD/BCF (pH 7.4): 28.40
    ACD/KOC (pH 7.4): 381.83
    Polar Surface Area: 44 Å2
    Polarizability: 22.7±0.5 10-24cm3
    Surface Tension: 38.5±7.0 dyne/cm
    Molar Volume: 179.1±7.0 cm3

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