ChemSpider 2D Image | 4-Chloro-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-5-[(Z)-(4-methylbenzylidene)amino]-1H-pyrazole-3-carbonitrile | C19H10Cl3F3N4

4-Chloro-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-5-[(Z)-(4-methylbenzylidene)amino]-1H-pyrazole-3-carbonitrile

  • Molecular FormulaC19H10Cl3F3N4
  • Average mass457.664 Da
  • Monoisotopic mass455.992310 Da
  • ChemSpider ID30654967

  • Double-bond stereo - Double-bond stereo

More details:

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

1H-Pyrazole-3-carbonitrile, 4-chloro-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-5-[[(1Z)-(4-methylphenyl)methylene]amino]- [ACD/Index Name]
4-Chlor-1-[2,6-dichlor-4-(trifluormethyl)phenyl]-5-[(Z)-(4-methylbenzyliden)amino]-1H-pyrazol-3-carbonitril [German] [ACD/IUPAC Name]
4-Chloro-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-5-[(Z)-(4-methylbenzylidene)amino]-1H-pyrazole-3-carbonitrile [ACD/IUPAC Name]
4-Chloro-1-[2,6-dichloro-4-(trifluorométhyl)phényl]-5-[(Z)-(4-méthylbenzylidène)amino]-1H-pyrazole-3-carbonitrile [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 564.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.8±3.0 kJ/mol
Flash Point: 295.0±30.1 °C
Index of Refraction: 1.613
Molar Refractivity: 108.2±0.5 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 6.77
ACD/LogD (pH 5.5): 6.45
ACD/BCF (pH 5.5): 46827.43
ACD/KOC (pH 5.5): 76687.76
ACD/LogD (pH 7.4): 6.45
ACD/BCF (pH 7.4): 46827.68
ACD/KOC (pH 7.4): 76688.18
Polar Surface Area: 54 Å2
Polarizability: 42.9±0.5 10-24cm3
Surface Tension: 43.6±7.0 dyne/cm
Molar Volume: 310.9±7.0 cm3

Click to predict properties on the Chemicalize site


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