ChemSpider 2D Image | 1-(4-Bromophenyl)-N-[1-(2,4-difluorophenyl)ethyl]-5-(trifluoromethyl)-1H-1,2,3-triazole-4-carboxamide | C18H12BrF5N4O

1-(4-Bromophenyl)-N-[1-(2,4-difluorophenyl)ethyl]-5-(trifluoromethyl)-1H-1,2,3-triazole-4-carboxamide

  • Molecular FormulaC18H12BrF5N4O
  • Average mass475.210 Da
  • Monoisotopic mass474.011444 Da
  • ChemSpider ID48303359

More details:

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

1-(4-Bromophenyl)-N-[1-(2,4-difluorophenyl)ethyl]-5-(trifluoromethyl)-1H-1,2,3-triazole-4-carboxamide [ACD/IUPAC Name]
1-(4-Bromophényl)-N-[1-(2,4-difluorophényl)éthyl]-5-(trifluorométhyl)-1H-1,2,3-triazole-4-carboxamide [French] [ACD/IUPAC Name]
1-(4-Bromphenyl)-N-[1-(2,4-difluorphenyl)ethyl]-5-(trifluormethyl)-1H-1,2,3-triazol-4-carboxamid [German] [ACD/IUPAC Name]
1H-1,2,3-Triazole-4-carboxamide, 1-(4-bromophenyl)-N-[1-(2,4-difluorophenyl)ethyl]-5-(trifluoromethyl)- [ACD/Index Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.598
Molar Refractivity: 99.1±0.5 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.76
ACD/LogD (pH 5.5): 3.63
ACD/BCF (pH 5.5): 335.45
ACD/KOC (pH 5.5): 2234.49
ACD/LogD (pH 7.4): 3.56
ACD/BCF (pH 7.4): 285.82
ACD/KOC (pH 7.4): 1903.88
Polar Surface Area: 60 Å2
Polarizability: 39.3±0.5 10-24cm3
Surface Tension: 41.2±7.0 dyne/cm
Molar Volume: 290.4±7.0 cm3

Click to predict properties on the Chemicalize site


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