ChemSpider 2D Image | 3-(Bromoacetyl)-6-fluoro-2H-chromen-2-one | C11H6BrFO3

3-(Bromoacetyl)-6-fluoro-2H-chromen-2-one

  • Molecular FormulaC11H6BrFO3
  • Average mass285.066 Da
  • Monoisotopic mass283.948425 Da
  • ChemSpider ID30656907

More details:

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

2H-1-Benzopyran-2-one, 3-(2-bromoacetyl)-6-fluoro- [ACD/Index Name]
3-(2-Bromoacétyl)-6-fluoro-2H-chromén-2-one [French] [ACD/IUPAC Name]
3-(Bromacetyl)-6-fluor-2H-chromen-2-on [German] [ACD/IUPAC Name]
3-(Bromoacetyl)-6-fluoro-2H-chromen-2-one [ACD/IUPAC Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 426.2±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 68.1±3.0 kJ/mol
Flash Point: 211.6±28.7 °C
Index of Refraction: 1.609
Molar Refractivity: 56.7±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.67
ACD/LogD (pH 5.5): 2.37
ACD/BCF (pH 5.5): 37.49
ACD/KOC (pH 5.5): 465.86
ACD/LogD (pH 7.4): 2.37
ACD/BCF (pH 7.4): 37.49
ACD/KOC (pH 7.4): 465.86
Polar Surface Area: 43 Å2
Polarizability: 22.5±0.5 10-24cm3
Surface Tension: 55.8±3.0 dyne/cm
Molar Volume: 163.7±3.0 cm3

Click to predict properties on the Chemicalize site


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