ChemSpider 2D Image | Methyl 3,3,4,4,4-pentafluorobutanoate | C5H5F5O2

Methyl 3,3,4,4,4-pentafluorobutanoate

  • Molecular FormulaC5H5F5O2
  • Average mass192.084 Da
  • Monoisotopic mass192.020966 Da
  • ChemSpider ID50644940

More details:

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

3,3,4,4,4-Pentafluorobutanoate de méthyle [French] [ACD/IUPAC Name]
Butanoic acid, 3,3,4,4,4-pentafluoro-, methyl ester [ACD/Index Name]
Methyl 3,3,4,4,4-pentafluorobutanoate [ACD/IUPAC Name]
Methyl-3,3,4,4,4-pentafluorbutanoat [German] [ACD/IUPAC Name]
378-75-6 [RN]
Methyl pentafluoropropionate

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

Density: 1.4±0.1 g/cm3
Boiling Point: 76.0±35.0 °C at 760 mmHg
Vapour Pressure: 102.5±0.1 mmHg at 25°C
Enthalpy of Vaporization: 31.7±3.0 kJ/mol
Flash Point: 5.9±28.2 °C
Index of Refraction: 1.315
Molar Refractivity: 27.7±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.05
ACD/LogD (pH 5.5): 2.13
ACD/BCF (pH 5.5): 24.65
ACD/KOC (pH 5.5): 345.02
ACD/LogD (pH 7.4): 2.13
ACD/BCF (pH 7.4): 24.65
ACD/KOC (pH 7.4): 345.02
Polar Surface Area: 26 Å2
Polarizability: 11.0±0.5 10-24cm3
Surface Tension: 18.3±3.0 dyne/cm
Molar Volume: 141.9±3.0 cm3

Click to predict properties on the Chemicalize site


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