ChemSpider 2D Image | N-Methyl-N-[(5-methyl-1H-pyrazol-3-yl)methyl]-1-[2-(trifluoromethyl)benzyl]-1H-1,2,3-triazole-4-carboxamide | C17H17F3N6O

N-Methyl-N-[(5-methyl-1H-pyrazol-3-yl)methyl]-1-[2-(trifluoromethyl)benzyl]-1H-1,2,3-triazole-4-carboxamide

  • Molecular FormulaC17H17F3N6O
  • Average mass378.352 Da
  • Monoisotopic mass378.141602 Da
  • ChemSpider ID22177621

More details:

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

1H-1,2,3-Triazole-4-carboxamide, N-methyl-N-[(5-methyl-1H-pyrazol-3-yl)methyl]-1-[[2-(trifluoromethyl)phenyl]methyl]- [ACD/Index Name]
N-Methyl-N-[(5-methyl-1H-pyrazol-3-yl)methyl]-1-[2-(trifluormethyl)benzyl]-1H-1,2,3-triazol-4-carboxamid [German] [ACD/IUPAC Name]
N-Methyl-N-[(5-methyl-1H-pyrazol-3-yl)methyl]-1-[2-(trifluoromethyl)benzyl]-1H-1,2,3-triazole-4-carboxamide [ACD/IUPAC Name]
N-Méthyl-N-[(5-méthyl-1H-pyrazol-3-yl)méthyl]-1-[2-(trifluorométhyl)benzyl]-1H-1,2,3-triazole-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: 593.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 88.5±3.0 kJ/mol
Flash Point: 312.9±32.9 °C
Index of Refraction: 1.611
Molar Refractivity: 94.0±0.5 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 0.51
ACD/LogD (pH 5.5): 1.73
ACD/BCF (pH 5.5): 12.11
ACD/KOC (pH 5.5): 207.29
ACD/LogD (pH 7.4): 1.73
ACD/BCF (pH 7.4): 12.14
ACD/KOC (pH 7.4): 207.82
Polar Surface Area: 80 Å2
Polarizability: 37.3±0.5 10-24cm3
Surface Tension: 44.6±7.0 dyne/cm
Molar Volume: 270.7±7.0 cm3

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