ChemSpider 2D Image | N-[3-(4-Methyl-1H-pyrazol-1-yl)propyl]-5-(trifluoromethyl)-1-[3-(trifluoromethyl)phenyl]-1H-pyrazole-4-carboxamide | C19H17F6N5O

N-[3-(4-Methyl-1H-pyrazol-1-yl)propyl]-5-(trifluoromethyl)-1-[3-(trifluoromethyl)phenyl]-1H-pyrazole-4-carboxamide

  • Molecular FormulaC19H17F6N5O
  • Average mass445.362 Da
  • Monoisotopic mass445.133728 Da
  • ChemSpider ID78224106

More details:

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

1H-Pyrazole-4-carboxamide, N-[3-(4-methyl-1H-pyrazol-1-yl)propyl]-5-(trifluoromethyl)-1-[3-(trifluoromethyl)phenyl]- [ACD/Index Name]
N-[3-(4-Methyl-1H-pyrazol-1-yl)propyl]-5-(trifluormethyl)-1-[3-(trifluormethyl)phenyl]-1H-pyrazol-4-carboxamid [German] [ACD/IUPAC Name]
N-[3-(4-Methyl-1H-pyrazol-1-yl)propyl]-5-(trifluoromethyl)-1-[3-(trifluoromethyl)phenyl]-1H-pyrazole-4-carboxamide [ACD/IUPAC Name]
N-[3-(4-Méthyl-1H-pyrazol-1-yl)propyl]-5-(trifluorométhyl)-1-[3-(trifluorométhyl)phényl]-1H-pyrazole-4-carboxamide [French] [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: 542.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 82.0±3.0 kJ/mol
Flash Point: 281.6±30.1 °C
Index of Refraction: 1.555
Molar Refractivity: 100.5±0.5 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 4.06
ACD/LogD (pH 5.5): 3.57
ACD/BCF (pH 5.5): 303.32
ACD/KOC (pH 5.5): 2079.55
ACD/LogD (pH 7.4): 3.57
ACD/BCF (pH 7.4): 303.61
ACD/KOC (pH 7.4): 2081.52
Polar Surface Area: 65 Å2
Polarizability: 39.8±0.5 10-24cm3
Surface Tension: 38.6±7.0 dyne/cm
Molar Volume: 312.9±7.0 cm3

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