ChemSpider 2D Image | 6-Fluoro-2-oxabicyclo[2.2.2]octa-5,7-dien-3-one | C7H5FO2

6-Fluoro-2-oxabicyclo[2.2.2]octa-5,7-dien-3-one

  • Molecular FormulaC7H5FO2
  • Average mass140.112 Da
  • Monoisotopic mass140.027359 Da
  • ChemSpider ID28671923

More details:

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

2-Oxabicyclo[2.2.2]octa-5,7-dien-3-one, 6-fluoro- [ACD/Index Name]
6-Fluor-2-oxabicyclo[2.2.2]octa-5,7-dien-3-on [German] [ACD/IUPAC Name]
6-Fluoro-2-oxabicyclo[2.2.2]octa-5,7-dien-3-one [ACD/IUPAC Name]
6-Fluoro-2-oxabicyclo[2.2.2]octa-5,7-dién-3-one [French] [ACD/IUPAC Name]
112158-72-2 [RN]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 290.4±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 53.0±3.0 kJ/mol
Flash Point: 125.4±22.2 °C
Index of Refraction: 1.529
Molar Refractivity: 31.9±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 0.62
ACD/LogD (pH 5.5): 0.53
ACD/BCF (pH 5.5): 1.50
ACD/KOC (pH 5.5): 46.41
ACD/LogD (pH 7.4): 0.53
ACD/BCF (pH 7.4): 1.50
ACD/KOC (pH 7.4): 46.41
Polar Surface Area: 26 Å2
Polarizability: 12.6±0.5 10-24cm3
Surface Tension: 36.0±5.0 dyne/cm
Molar Volume: 103.4±5.0 cm3

Click to predict properties on the Chemicalize site


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