ChemSpider 2D Image | N-(4-Bromo-3-fluorophenyl)-1-pyrrolidinecarboxamide | C11H12BrFN2O

N-(4-Bromo-3-fluorophenyl)-1-pyrrolidinecarboxamide

  • Molecular FormulaC11H12BrFN2O
  • Average mass287.128 Da
  • Monoisotopic mass286.011688 Da
  • ChemSpider ID30460268

More details:

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

1-Pyrrolidinecarboxamide, N-(4-bromo-3-fluorophenyl)- [ACD/Index Name]
N-(4-Brom-3-fluorphenyl)-1-pyrrolidincarboxamid [German] [ACD/IUPAC Name]
N-(4-Bromo-3-fluorophenyl)-1-pyrrolidinecarboxamide [ACD/IUPAC Name]
N-(4-Bromo-3-fluorophényl)-1-pyrrolidinecarboxamide [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: 417.7±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.1±3.0 kJ/mol
Flash Point: 206.4±28.7 °C
Index of Refraction: 1.628
Molar Refractivity: 63.5±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 2.86
ACD/LogD (pH 5.5): 2.81
ACD/BCF (pH 5.5): 79.73
ACD/KOC (pH 5.5): 799.48
ACD/LogD (pH 7.4): 2.80
ACD/BCF (pH 7.4): 79.65
ACD/KOC (pH 7.4): 798.62
Polar Surface Area: 32 Å2
Polarizability: 25.2±0.5 10-24cm3
Surface Tension: 57.7±3.0 dyne/cm
Molar Volume: 178.8±3.0 cm3

Click to predict properties on the Chemicalize site


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