ChemSpider 2D Image | 2-[5-Bromo-3-(trifluoroacetyl)-1H-indol-1-yl]-N-(2-furylmethyl)acetamide | C17H12BrF3N2O3

2-[5-Bromo-3-(trifluoroacetyl)-1H-indol-1-yl]-N-(2-furylmethyl)acetamide

  • Molecular FormulaC17H12BrF3N2O3
  • Average mass429.188 Da
  • Monoisotopic mass427.998322 Da
  • ChemSpider ID21613748

More details:






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

1H-Indole-1-acetamide, 5-bromo-N-(2-furanylmethyl)-3-(2,2,2-trifluoroacetyl)- [ACD/Index Name]
2-[5-Brom-3-(trifluoracetyl)-1H-indol-1-yl]-N-(2-furylmethyl)acetamid [German] [ACD/IUPAC Name]
2-[5-Bromo-3-(2,2,2-trifluoroacétyl)-1H-indol-1-yl]-N-(2-furylméthyl)acétamide [French] [ACD/IUPAC Name]
2-[5-Bromo-3-(trifluoroacetyl)-1H-indol-1-yl]-N-(2-furylmethyl)acetamide [ACD/IUPAC Name]
2-[5-Bromo-3-(2,2,2-trifluoro-acetyl)-indol-1-yl]-N-furan-2-ylmethyl-acetamide
2-[5-bromo-3-(trifluoroacetyl)-1H-indol-1-yl]-N-(furan-2-ylmethyl)acetamide

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

Density: 1.6±0.1 g/cm3
Boiling Point: 583.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.3±3.0 kJ/mol
Flash Point: 306.9±30.1 °C
Index of Refraction: 1.606
Molar Refractivity: 91.1±0.5 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.59
ACD/LogD (pH 5.5): 3.32
ACD/BCF (pH 5.5): 195.62
ACD/KOC (pH 5.5): 1519.82
ACD/LogD (pH 7.4): 3.32
ACD/BCF (pH 7.4): 195.62
ACD/KOC (pH 7.4): 1519.82
Polar Surface Area: 64 Å2
Polarizability: 36.1±0.5 10-24cm3
Surface Tension: 46.7±7.0 dyne/cm
Molar Volume: 263.9±7.0 cm3

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