ChemSpider 2D Image | 3,3-Difluoro-1-(fluorooxy)-1-oxo-2-pentanone | C5H5F3O3

3,3-Difluoro-1-(fluorooxy)-1-oxo-2-pentanone

  • Molecular FormulaC5H5F3O3
  • Average mass170.087 Da
  • Monoisotopic mass170.019073 Da
  • ChemSpider ID35805345

More details:

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

2-Pentanone, 3,3-difluoro-1-(fluorooxy)-1-oxo- [ACD/Index Name]
3,3-Difluor-1-(fluoroxy)-1-oxo-2-pentanon [German] [ACD/IUPAC Name]
3,3-Difluoro-1-(fluorooxy)-1-oxo-2-pentanone [ACD/IUPAC Name]
3,3-Difluoro-1-(fluorooxy)-1-oxo-2-pentanone [French] [ACD/IUPAC Name]
13081-18-0 [RN]
3,3-difluoro-2-oxopentanecarboperoxoyl fluoride
Ethyl trifluoropyruvate

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

Density: 1.3±0.1 g/cm3
Boiling Point: 133.1±50.0 °C at 760 mmHg
Vapour Pressure: 8.6±0.2 mmHg at 25°C
Enthalpy of Vaporization: 37.1±3.0 kJ/mol
Flash Point: 34.2±25.0 °C
Index of Refraction: 1.349
Molar Refractivity: 27.5±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.65
ACD/LogD (pH 5.5): 1.25
ACD/BCF (pH 5.5): 5.28
ACD/KOC (pH 5.5): 114.50
ACD/LogD (pH 7.4): 1.25
ACD/BCF (pH 7.4): 5.28
ACD/KOC (pH 7.4): 114.50
Polar Surface Area: 43 Å2
Polarizability: 10.9±0.5 10-24cm3
Surface Tension: 24.4±3.0 dyne/cm
Molar Volume: 128.1±3.0 cm3

Click to predict properties on the Chemicalize site


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