ChemSpider 2D Image | 5-Bromo-N-{[2-(2,2,2-trifluoroethoxy)-4-pyridinyl]methyl}-1-benzofuran-2-carboxamide | C17H12BrF3N2O3

5-Bromo-N-{[2-(2,2,2-trifluoroethoxy)-4-pyridinyl]methyl}-1-benzofuran-2-carboxamide

  • Molecular FormulaC17H12BrF3N2O3
  • Average mass429.188 Da
  • Monoisotopic mass427.998322 Da
  • ChemSpider ID33415220

More details:






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

2-Benzofurancarboxamide, 5-bromo-N-[[2-(2,2,2-trifluoroethoxy)-4-pyridinyl]methyl]- [ACD/Index Name]
5-Brom-N-{[2-(2,2,2-trifluorethoxy)-4-pyridinyl]methyl}-1-benzofuran-2-carboxamid [German] [ACD/IUPAC Name]
5-Bromo-N-{[2-(2,2,2-trifluoroethoxy)-4-pyridinyl]methyl}-1-benzofuran-2-carboxamide [ACD/IUPAC Name]
5-Bromo-N-{[2-(2,2,2-trifluoroéthoxy)-4-pyridinyl]méthyl}-1-benzofurane-2-carboxamide [French] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.6±0.1 g/cm3
Boiling Point: 555.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 83.7±3.0 kJ/mol
Flash Point: 290.0±30.1 °C
Index of Refraction: 1.588
Molar Refractivity: 92.1±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.64
ACD/LogD (pH 5.5): 3.58
ACD/BCF (pH 5.5): 308.44
ACD/KOC (pH 5.5): 2104.23
ACD/LogD (pH 7.4): 3.58
ACD/BCF (pH 7.4): 309.08
ACD/KOC (pH 7.4): 2108.59
Polar Surface Area: 64 Å2
Polarizability: 36.5±0.5 10-24cm3
Surface Tension: 46.6±3.0 dyne/cm
Molar Volume: 273.7±3.0 cm3

Click to predict properties on the Chemicalize site






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