ChemSpider 2D Image | N-{2-[Cyclopropyl(methyl)amino]propyl}-5-(trifluoromethyl)-1-[3-(trifluoromethyl)phenyl]-1H-pyrazole-4-carboxamide | C19H20F6N4O

N-{2-[Cyclopropyl(methyl)amino]propyl}-5-(trifluoromethyl)-1-[3-(trifluoromethyl)phenyl]-1H-pyrazole-4-carboxamide

  • Molecular FormulaC19H20F6N4O
  • Average mass434.379 Da
  • Monoisotopic mass434.154144 Da
  • ChemSpider ID69646697

More details:






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

1H-Pyrazole-4-carboxamide, N-[2-(cyclopropylmethylamino)propyl]-5-(trifluoromethyl)-1-[3-(trifluoromethyl)phenyl]- [ACD/Index Name]
N-{2-[Cyclopropyl(methyl)amino]propyl}-5-(trifluormethyl)-1-[3-(trifluormethyl)phenyl]-1H-pyrazol-4-carboxamid [German] [ACD/IUPAC Name]
N-{2-[Cyclopropyl(methyl)amino]propyl}-5-(trifluoromethyl)-1-[3-(trifluoromethyl)phenyl]-1H-pyrazole-4-carboxamide [ACD/IUPAC Name]
N-{2-[Cyclopropyl(méthyl)amino]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: 493.8±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 76.1±3.0 kJ/mol
Flash Point: 252.5±28.7 °C
Index of Refraction: 1.545
Molar Refractivity: 97.3±0.5 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 3.90
ACD/LogD (pH 5.5): 0.68
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.16
ACD/LogD (pH 7.4): 2.30
ACD/BCF (pH 7.4): 17.73
ACD/KOC (pH 7.4): 130.65
Polar Surface Area: 50 Å2
Polarizability: 38.6±0.5 10-24cm3
Surface Tension: 36.0±7.0 dyne/cm
Molar Volume: 307.4±7.0 cm3

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