ChemSpider 2D Image | N-{[1-(2-Methyl-2-propanyl)-1H-1,2,3-triazol-4-yl]methyl}-4-[3-(trifluoromethyl)phenyl]tetrahydro-2H-pyran-4-amine | C19H25F3N4O

N-{[1-(2-Methyl-2-propanyl)-1H-1,2,3-triazol-4-yl]methyl}-4-[3-(trifluoromethyl)phenyl]tetrahydro-2H-pyran-4-amine

  • Molecular FormulaC19H25F3N4O
  • Average mass382.423 Da
  • Monoisotopic mass382.198059 Da
  • ChemSpider ID64943863

More details:

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

1H-1,2,3-Triazole-4-methanamine, 1-(1,1-dimethylethyl)-N-[tetrahydro-4-[3-(trifluoromethyl)phenyl]-2H-pyran-4-yl]- [ACD/Index Name]
N-{[1-(2-Methyl-2-propanyl)-1H-1,2,3-triazol-4-yl]methyl}-4-[3-(trifluormethyl)phenyl]tetrahydro-2H-pyran-4-amin [German] [ACD/IUPAC Name]
N-{[1-(2-Methyl-2-propanyl)-1H-1,2,3-triazol-4-yl]methyl}-4-[3-(trifluoromethyl)phenyl]tetrahydro-2H-pyran-4-amine [ACD/IUPAC Name]
N-{[1-(2-Méthyl-2-propanyl)-1H-1,2,3-triazol-4-yl]méthyl}-4-[3-(trifluorométhyl)phényl]tétrahydro-2H-pyran-4-amine [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 454.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 71.4±3.0 kJ/mol
Flash Point: 228.8±31.5 °C
Index of Refraction: 1.550
Molar Refractivity: 97.6±0.5 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.75
ACD/LogD (pH 5.5): 3.27
ACD/BCF (pH 5.5): 157.50
ACD/KOC (pH 5.5): 1115.02
ACD/LogD (pH 7.4): 3.50
ACD/BCF (pH 7.4): 268.90
ACD/KOC (pH 7.4): 1903.67
Polar Surface Area: 52 Å2
Polarizability: 38.7±0.5 10-24cm3
Surface Tension: 37.6±7.0 dyne/cm
Molar Volume: 306.4±7.0 cm3

Click to predict properties on the Chemicalize site


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