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ChemSpider 2D Image | 5-Amino-3-(2,4-dichlorophenyl)-1-(4-methylphenyl)-1H-pyrazole-4-carbonitrile | C17H12Cl2N4

5-Amino-3-(2,4-dichlorophenyl)-1-(4-methylphenyl)-1H-pyrazole-4-carbonitrile

  • Molecular FormulaC17H12Cl2N4
  • Average mass343.210 Da
  • Monoisotopic mass342.043915 Da
  • ChemSpider ID20194647

More details:

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

1H-Pyrazole-4-carbonitrile, 5-amino-3-(2,4-dichlorophenyl)-1-(4-methylphenyl)- [ACD/Index Name]
5-Amino-3-(2,4-dichlorophenyl)-1-(4-methylphenyl)-1H-pyrazole-4-carbonitrile [ACD/IUPAC Name]
5-Amino-3-(2,4-dichlorophényl)-1-(4-méthylphényl)-1H-pyrazole-4-carbonitrile [French] [ACD/IUPAC Name]
5-Amino-3-(2,4-dichlorphenyl)-1-(4-methylphenyl)-1H-pyrazol-4-carbonitril [German] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 556.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 83.9±3.0 kJ/mol
Flash Point: 290.6±30.1 °C
Index of Refraction: 1.676
Molar Refractivity: 93.1±0.5 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 5.68
ACD/LogD (pH 5.5): 4.95
ACD/BCF (pH 5.5): 3390.99
ACD/KOC (pH 5.5): 11711.22
ACD/LogD (pH 7.4): 4.95
ACD/BCF (pH 7.4): 3390.99
ACD/KOC (pH 7.4): 11711.22
Polar Surface Area: 68 Å2
Polarizability: 36.9±0.5 10-24cm3
Surface Tension: 52.0±7.0 dyne/cm
Molar Volume: 247.5±7.0 cm3

Click to predict properties on the Chemicalize site


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