ChemSpider 2D Image | 1-(4-Nitrophenyl)-4-(trifluoromethyl)-1H-pyrazole | C10H6F3N3O2

1-(4-Nitrophenyl)-4-(trifluoromethyl)-1H-pyrazole

  • Molecular FormulaC10H6F3N3O2
  • Average mass257.169 Da
  • Monoisotopic mass257.041199 Da
  • ChemSpider ID31023827

More details:

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

1-(4-Nitrophenyl)-4-(trifluormethyl)-1H-pyrazol [German] [ACD/IUPAC Name]
1-(4-Nitrophenyl)-4-(trifluoromethyl)-1H-pyrazole [ACD/IUPAC Name]
1-(4-Nitrophényl)-4-(trifluorométhyl)-1H-pyrazole [French] [ACD/IUPAC Name]
1393125-56-8 [RN]
1H-Pyrazole, 1-(4-nitrophenyl)-4-(trifluoromethyl)- [ACD/Index Name]
1-(4-nitrophenyl)-4-(trifluoromethyl)pyrazole
DK-0728
MFCD28023542 [MDL number]

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

    Density: 1.5±0.1 g/cm3
    Boiling Point: 335.0±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 55.5±3.0 kJ/mol
    Flash Point: 156.4±27.9 °C
    Index of Refraction: 1.571
    Molar Refractivity: 56.3±0.5 cm3
    #H bond acceptors: 5
    #H bond donors: 0
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 3.22
    ACD/LogD (pH 5.5): 2.70
    ACD/BCF (pH 5.5): 66.21
    ACD/KOC (pH 5.5): 699.92
    ACD/LogD (pH 7.4): 2.70
    ACD/BCF (pH 7.4): 66.21
    ACD/KOC (pH 7.4): 699.92
    Polar Surface Area: 64 Å2
    Polarizability: 22.3±0.5 10-24cm3
    Surface Tension: 45.5±7.0 dyne/cm
    Molar Volume: 171.6±7.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement