ChemSpider 2D Image | 1,1,1,3-Tetrafluoro-3-methyl-2-butanone | C5H6F4O

1,1,1,3-Tetrafluoro-3-methyl-2-butanone

  • Molecular FormulaC5H6F4O
  • Average mass158.094 Da
  • Monoisotopic mass158.035477 Da
  • ChemSpider ID65447534

More details:

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

1,1,1,3-Tetrafluor-3-methyl-2-butanon [German] [ACD/IUPAC Name]
1,1,1,3-Tetrafluoro-3-methyl-2-butanone [ACD/IUPAC Name]
1,1,1,3-Tétrafluoro-3-méthyl-2-butanone [French] [ACD/IUPAC Name]
2-Butanone, 1,1,1,3-tetrafluoro-3-methyl- [ACD/Index Name]
1,1,1,3-tetrafluoro-3-methylbutan-2-one
2228871-32-5 [RN]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 82.3±35.0 °C at 760 mmHg
Vapour Pressure: 78.9±0.1 mmHg at 25°C
Enthalpy of Vaporization: 32.3±3.0 kJ/mol
Flash Point: 20.4±20.1 °C
Index of Refraction: 1.320
Molar Refractivity: 25.8±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.21
ACD/LogD (pH 5.5): 1.31
ACD/BCF (pH 5.5): 5.82
ACD/KOC (pH 5.5): 122.80
ACD/LogD (pH 7.4): 1.31
ACD/BCF (pH 7.4): 5.82
ACD/KOC (pH 7.4): 122.80
Polar Surface Area: 17 Å2
Polarizability: 10.2±0.5 10-24cm3
Surface Tension: 17.1±3.0 dyne/cm
Molar Volume: 130.1±3.0 cm3

Click to predict properties on the Chemicalize site


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