ChemSpider 2D Image | Methyl 4,4-difluoro-5-(fluorosulfonyl)pentanoate | C6H9F3O4S

Methyl 4,4-difluoro-5-(fluorosulfonyl)pentanoate

  • Molecular FormulaC6H9F3O4S
  • Average mass234.193 Da
  • Monoisotopic mass234.017365 Da
  • ChemSpider ID97190722

More details:

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

4,4-Difluoro-5-(fluorosulfonyl)pentanoate de méthyle [French] [ACD/IUPAC Name]
Methyl 4,4-difluoro-5-(fluorosulfonyl)pentanoate [ACD/IUPAC Name]
Methyl-4,4-difluor-5-(fluorsulfonyl)pentanoat [German] [ACD/IUPAC Name]
Pentanoic acid, 4,4-difluoro-5-(fluorosulfonyl)-, methyl ester [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 245.4±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 48.3±3.0 kJ/mol
Flash Point: 102.2±27.3 °C
Index of Refraction: 1.400
Molar Refractivity: 40.9±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 1.89
ACD/LogD (pH 5.5): 1.55
ACD/BCF (pH 5.5): 8.88
ACD/KOC (pH 5.5): 166.14
ACD/LogD (pH 7.4): 1.55
ACD/BCF (pH 7.4): 8.88
ACD/KOC (pH 7.4): 166.14
Polar Surface Area: 69 Å2
Polarizability: 16.2±0.5 10-24cm3
Surface Tension: 32.5±3.0 dyne/cm
Molar Volume: 168.5±3.0 cm3

Click to predict properties on the Chemicalize site


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