ChemSpider 2D Image | 1-(4-Chlorophenyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-(trifluoromethyl)-1H-pyrazole-4-carboxamide | C19H13ClF3N3O3

1-(4-Chlorophenyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-(trifluoromethyl)-1H-pyrazole-4-carboxamide

  • Molecular FormulaC19H13ClF3N3O3
  • Average mass423.773 Da
  • Monoisotopic mass423.059753 Da
  • ChemSpider ID22575173

More details:

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

1-(4-Chlorophenyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-(trifluoromethyl)-1H-pyrazole-4-carboxamide [ACD/IUPAC Name]
1-(4-Chlorophényl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-(trifluorométhyl)-1H-pyrazole-4-carboxamide [French] [ACD/IUPAC Name]
1-(4-Chlorphenyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-(trifluormethyl)-1H-pyrazol-4-carboxamid [German] [ACD/IUPAC Name]
1H-Pyrazole-4-carboxamide, 1-(4-chlorophenyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-(trifluoromethyl)- [ACD/Index 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: 463.4±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 72.5±3.0 kJ/mol
Flash Point: 234.0±28.7 °C
Index of Refraction: 1.625
Molar Refractivity: 98.4±0.5 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.92
ACD/LogD (pH 5.5): 3.50
ACD/BCF (pH 5.5): 268.47
ACD/KOC (pH 5.5): 1906.35
ACD/LogD (pH 7.4): 3.50
ACD/BCF (pH 7.4): 268.32
ACD/KOC (pH 7.4): 1905.30
Polar Surface Area: 65 Å2
Polarizability: 39.0±0.5 10-24cm3
Surface Tension: 47.7±7.0 dyne/cm
Molar Volume: 278.1±7.0 cm3

Click to predict properties on the Chemicalize site


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