ChemSpider 2D Image | 3-(4-Bromo-2-fluorophenyl)-N-(3-cyano-4-fluorophenyl)propanamide | C16H11BrF2N2O

3-(4-Bromo-2-fluorophenyl)-N-(3-cyano-4-fluorophenyl)propanamide

  • Molecular FormulaC16H11BrF2N2O
  • Average mass365.172 Da
  • Monoisotopic mass364.002289 Da
  • ChemSpider ID31822954

More details:

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

3-(4-Brom-2-fluorphenyl)-N-(3-cyan-4-fluorphenyl)propanamid [German] [ACD/IUPAC Name]
3-(4-Bromo-2-fluorophenyl)-N-(3-cyano-4-fluorophenyl)propanamide [ACD/IUPAC Name]
3-(4-Bromo-2-fluorophényl)-N-(3-cyano-4-fluorophényl)propanamide [French] [ACD/IUPAC Name]
Benzenepropanamide, 4-bromo-N-(3-cyano-4-fluorophenyl)-2-fluoro- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 517.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 79.0±3.0 kJ/mol
Flash Point: 267.0±30.1 °C
Index of Refraction: 1.608
Molar Refractivity: 81.6±0.4 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.39
ACD/LogD (pH 5.5): 4.01
ACD/BCF (pH 5.5): 663.04
ACD/KOC (pH 5.5): 3641.32
ACD/LogD (pH 7.4): 4.01
ACD/BCF (pH 7.4): 663.04
ACD/KOC (pH 7.4): 3641.31
Polar Surface Area: 53 Å2
Polarizability: 32.4±0.5 10-24cm3
Surface Tension: 55.7±5.0 dyne/cm
Molar Volume: 236.0±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement