ChemSpider 2D Image | 4-Ethyl-5-methyl-2-[4-(trifluoromethyl)phenyl]-2,4-dihydroimidazo[4,5-d][1,2,3]triazole | C13H12F3N5

4-Ethyl-5-methyl-2-[4-(trifluoromethyl)phenyl]-2,4-dihydroimidazo[4,5-d][1,2,3]triazole

  • Molecular FormulaC13H12F3N5
  • Average mass295.263 Da
  • Monoisotopic mass295.104492 Da
  • ChemSpider ID21142781

More details:

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

4-Ethyl-5-methyl-2-[4-(trifluormethyl)phenyl]-2,4-dihydroimidazo[4,5-d][1,2,3]triazol [German] [ACD/IUPAC Name]
4-Ethyl-5-methyl-2-[4-(trifluoromethyl)phenyl]-2,4-dihydroimidazo[4,5-d][1,2,3]triazole [ACD/IUPAC Name]
4-Éthyl-5-méthyl-2-[4-(trifluorométhyl)phényl]-2,4-dihydroimidazo[4,5-d][1,2,3]triazole [French] [ACD/IUPAC Name]
Imidazo[4,5-d]-1,2,3-triazole, 4-ethyl-2,4-dihydro-5-methyl-2-[4-(trifluoromethyl)phenyl]- [ACD/Index Name]
4-ethyl-5-methyl-2-(4-trifluoromethylphenyl)-2H,4H-imidazo[4,5-d][1,2,3]triazole

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

Density: 1.4±0.1 g/cm3
Boiling Point: 420.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.4±3.0 kJ/mol
Flash Point: 207.9±31.5 °C
Index of Refraction: 1.618
Molar Refractivity: 71.7±0.5 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.72
ACD/LogD (pH 5.5): 3.71
ACD/BCF (pH 5.5): 388.99
ACD/KOC (pH 5.5): 2485.86
ACD/LogD (pH 7.4): 3.71
ACD/BCF (pH 7.4): 389.00
ACD/KOC (pH 7.4): 2485.95
Polar Surface Area: 49 Å2
Polarizability: 28.4±0.5 10-24cm3
Surface Tension: 41.8±7.0 dyne/cm
Molar Volume: 204.4±7.0 cm3

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