ChemSpider 2D Image | 5-Amino-1-(4-isopropylphenyl)-1H-pyrazole-4-carbonitrile | C13H14N4

5-Amino-1-(4-isopropylphenyl)-1H-pyrazole-4-carbonitrile

  • Molecular FormulaC13H14N4
  • Average mass226.277 Da
  • Monoisotopic mass226.121841 Da
  • ChemSpider ID25470821

More details:

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

1175899-74-7 [RN]
1H-Pyrazole-4-carbonitrile, 5-amino-1-[4-(1-methylethyl)phenyl]- [ACD/Index Name]
5-Amino-1-(4-isopropylphenyl)-1H-pyrazol-4-carbonitril [German] [ACD/IUPAC Name]
5-Amino-1-(4-isopropylphenyl)-1H-pyrazole-4-carbonitrile [ACD/IUPAC Name]
5-Amino-1-(4-isopropylphényl)-1H-pyrazole-4-carbonitrile [French] [ACD/IUPAC Name]
5-AMINO-1-[4-(PROPAN-2-YL)PHENYL]-1H-PYRAZOLE-4-CARBONITRILE
5-Amino-1-(4-isopropyl-phenyl)-1H-pyrazole-4-carbonitrile
5-AMINO-1-(4-ISOPROPYLPHENYL)PYRAZOLE-4-CARBONITRILE
5-amino-1-(4-propan-2-ylphenyl)pyrazole-4-carbonitrile
AGN-PC-0NT2UZ
More...

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 407.3±40.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.9 mmHg at 25°C
    Enthalpy of Vaporization: 65.9±3.0 kJ/mol
    Flash Point: 200.1±27.3 °C
    Index of Refraction: 1.624
    Molar Refractivity: 67.8±0.5 cm3
    #H bond acceptors: 4
    #H bond donors: 2
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 3.80
    ACD/LogD (pH 5.5): 2.44
    ACD/BCF (pH 5.5): 42.44
    ACD/KOC (pH 5.5): 509.10
    ACD/LogD (pH 7.4): 2.44
    ACD/BCF (pH 7.4): 42.44
    ACD/KOC (pH 7.4): 509.10
    Polar Surface Area: 68 Å2
    Polarizability: 26.9±0.5 10-24cm3
    Surface Tension: 45.7±7.0 dyne/cm
    Molar Volume: 192.2±7.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement