ChemSpider 2D Image | 3-{[3-Cyclopropyl-1-(2,2,2-trifluoroethyl)-1H-1,2,4-triazol-5-yl]methyl}-1-methyl-1H-indole | C17H17F3N4

3-{[3-Cyclopropyl-1-(2,2,2-trifluoroethyl)-1H-1,2,4-triazol-5-yl]methyl}-1-methyl-1H-indole

  • Molecular FormulaC17H17F3N4
  • Average mass334.339 Da
  • Monoisotopic mass334.140533 Da
  • ChemSpider ID30968938

More details:

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

1H-Indole, 3-[[3-cyclopropyl-1-(2,2,2-trifluoroethyl)-1H-1,2,4-triazol-5-yl]methyl]-1-methyl- [ACD/Index Name]
3-{[3-Cyclopropyl-1-(2,2,2-trifluorethyl)-1H-1,2,4-triazol-5-yl]methyl}-1-methyl-1H-indol [German] [ACD/IUPAC Name]
3-{[3-Cyclopropyl-1-(2,2,2-trifluoroethyl)-1H-1,2,4-triazol-5-yl]methyl}-1-methyl-1H-indole [ACD/IUPAC Name]
3-{[3-Cyclopropyl-1-(2,2,2-trifluoroéthyl)-1H-1,2,4-triazol-5-yl]méthyl}-1-méthyl-1H-indole [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: 503.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 77.3±3.0 kJ/mol
Flash Point: 258.6±32.9 °C
Index of Refraction: 1.635
Molar Refractivity: 84.7±0.5 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.02
ACD/LogD (pH 5.5): 3.43
ACD/BCF (pH 5.5): 239.98
ACD/KOC (pH 5.5): 1758.33
ACD/LogD (pH 7.4): 3.43
ACD/BCF (pH 7.4): 240.42
ACD/KOC (pH 7.4): 1761.57
Polar Surface Area: 36 Å2
Polarizability: 33.6±0.5 10-24cm3
Surface Tension: 43.5±7.0 dyne/cm
Molar Volume: 236.4±7.0 cm3

Click to predict properties on the Chemicalize site


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