ChemSpider 2D Image | 3-Methoxycyclobutyl trifluoromethanesulfonate | C6H9F3O4S

3-Methoxycyclobutyl trifluoromethanesulfonate

  • Molecular FormulaC6H9F3O4S
  • Average mass234.193 Da
  • Monoisotopic mass234.017365 Da
  • ChemSpider ID53495425

More details:

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

3-Methoxycyclobutyl trifluoromethanesulfonate [ACD/IUPAC Name]
3-Methoxycyclobutyl-trifluormethansulfonat [German] [ACD/IUPAC Name]
Methanesulfonic acid, 1,1,1-trifluoro-, 3-methoxycyclobutyl ester [ACD/Index Name]
Trifluorométhanesulfonate de 3-méthoxycyclobutyle [French] [ACD/IUPAC Name]
1698827-48-3 [RN]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 212.3±40.0 °C at 760 mmHg
Vapour Pressure: 0.3±0.4 mmHg at 25°C
Enthalpy of Vaporization: 43.0±3.0 kJ/mol
Flash Point: 82.2±27.3 °C
Index of Refraction: 1.421
Molar Refractivity: 40.4±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.08
ACD/LogD (pH 5.5): 1.94
ACD/BCF (pH 5.5): 17.62
ACD/KOC (pH 5.5): 271.33
ACD/LogD (pH 7.4): 1.94
ACD/BCF (pH 7.4): 17.62
ACD/KOC (pH 7.4): 271.33
Polar Surface Area: 61 Å2
Polarizability: 16.0±0.5 10-24cm3
Surface Tension: 32.7±5.0 dyne/cm
Molar Volume: 159.2±5.0 cm3

Click to predict properties on the Chemicalize site


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