ChemSpider 2D Image | 3-(4-Bromo-2-fluorophenoxy)-1-methyl-2-pyrrolidinone | C11H11BrFNO2

3-(4-Bromo-2-fluorophenoxy)-1-methyl-2-pyrrolidinone

  • Molecular FormulaC11H11BrFNO2
  • Average mass288.113 Da
  • Monoisotopic mass286.995697 Da
  • ChemSpider ID30225203

More details:

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

2-Pyrrolidinone, 3-(4-bromo-2-fluorophenoxy)-1-methyl- [ACD/Index Name]
3-(4-Brom-2-fluorphenoxy)-1-methyl-2-pyrrolidinon [German] [ACD/IUPAC Name]
3-(4-Bromo-2-fluorophenoxy)-1-methyl-2-pyrrolidinone [ACD/IUPAC Name]
3-(4-Bromo-2-fluorophénoxy)-1-méthyl-2-pyrrolidinone [French] [ACD/IUPAC 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: 400.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 65.2±3.0 kJ/mol
Flash Point: 196.3±28.7 °C
Index of Refraction: 1.567
Molar Refractivity: 60.8±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.86
ACD/LogD (pH 5.5): 2.31
ACD/BCF (pH 5.5): 33.25
ACD/KOC (pH 5.5): 427.45
ACD/LogD (pH 7.4): 2.31
ACD/BCF (pH 7.4): 33.25
ACD/KOC (pH 7.4): 427.45
Polar Surface Area: 30 Å2
Polarizability: 24.1±0.5 10-24cm3
Surface Tension: 45.2±3.0 dyne/cm
Molar Volume: 186.1±3.0 cm3

Click to predict properties on the Chemicalize site


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