ChemSpider 2D Image | N-[2-(3-Bromo-4-methoxyphenyl)-1,3-benzoxazol-6-yl]-2,2,2-trifluoro-N-methylacetamide | C17H12BrF3N2O3

N-[2-(3-Bromo-4-methoxyphenyl)-1,3-benzoxazol-6-yl]-2,2,2-trifluoro-N-methylacetamide

  • Molecular FormulaC17H12BrF3N2O3
  • Average mass429.188 Da
  • Monoisotopic mass427.998322 Da
  • ChemSpider ID44262762

More details:

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

Acetamide, N-[2-(3-bromo-4-methoxyphenyl)-6-benzoxazolyl]-2,2,2-trifluoro-N-methyl- [ACD/Index Name]
N-[2-(3-Brom-4-methoxyphenyl)-1,3-benzoxazol-6-yl]-2,2,2-trifluor-N-methylacetamid [German] [ACD/IUPAC Name]
N-[2-(3-Bromo-4-methoxyphenyl)-1,3-benzoxazol-6-yl]-2,2,2-trifluoro-N-methylacetamide [ACD/IUPAC Name]
N-[2-(3-Bromo-4-méthoxyphényl)-1,3-benzoxazol-6-yl]-2,2,2-trifluoro-N-méthylacétamide [French] [ACD/IUPAC 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: 434.6±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 69.1±3.0 kJ/mol
Flash Point: 216.7±28.7 °C
Index of Refraction: 1.596
Molar Refractivity: 92.9±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 5.33
ACD/LogD (pH 5.5): 4.11
ACD/BCF (pH 5.5): 786.87
ACD/KOC (pH 5.5): 4116.14
ACD/LogD (pH 7.4): 4.11
ACD/BCF (pH 7.4): 786.87
ACD/KOC (pH 7.4): 4116.14
Polar Surface Area: 56 Å2
Polarizability: 36.8±0.5 10-24cm3
Surface Tension: 45.8±3.0 dyne/cm
Molar Volume: 273.0±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement