ChemSpider 2D Image | 1-(1-Naphthyl)ethyl trifluoromethanesulfonate | C13H11F3O3S

1-(1-Naphthyl)ethyl trifluoromethanesulfonate

  • Molecular FormulaC13H11F3O3S
  • Average mass304.285 Da
  • Monoisotopic mass304.038086 Da
  • ChemSpider ID51450365

More details:

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

1-(1-Naphthyl)ethyl trifluoromethanesulfonate [ACD/IUPAC Name]
1-(1-Naphthyl)ethyl-trifluormethansulfonat [German] [ACD/IUPAC Name]
Methanesulfonic acid, 1,1,1-trifluoro-, 1-(1-naphthalenyl)ethyl ester [ACD/Index Name]
Trifluorométhanesulfonate de 1-(1-naphtyl)éthyle [French] [ACD/IUPAC 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: 360.1±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 58.2±3.0 kJ/mol
Flash Point: 171.6±27.9 °C
Index of Refraction: 1.548
Molar Refractivity: 69.1±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.51
ACD/LogD (pH 5.5): 4.77
ACD/BCF (pH 5.5): 2484.65
ACD/KOC (pH 5.5): 9374.04
ACD/LogD (pH 7.4): 4.77
ACD/BCF (pH 7.4): 2484.65
ACD/KOC (pH 7.4): 9374.04
Polar Surface Area: 52 Å2
Polarizability: 27.4±0.5 10-24cm3
Surface Tension: 41.7±3.0 dyne/cm
Molar Volume: 217.4±3.0 cm3

Click to predict properties on the Chemicalize site


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