ChemSpider 2D Image | S-Butyl ethanesulfonothioate | C6H14O2S2

S-Butyl ethanesulfonothioate

  • Molecular FormulaC6H14O2S2
  • Average mass182.304 Da
  • Monoisotopic mass182.043518 Da
  • ChemSpider ID35803915

More details:

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

Éthanesulfonothioate de S-butyle [French] [ACD/IUPAC Name]
Ethanesulfonothioic acid, S-butyl ester [ACD/Index Name]
S-Butyl ethanesulfonothioate [ACD/IUPAC Name]
S-Butyl-ethansulfonothioat [German] [ACD/IUPAC Name]
1113-19-5 [RN]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 308.9±11.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 52.8±3.0 kJ/mol
Flash Point: 140.6±19.3 °C
Index of Refraction: 1.486
Molar Refractivity: 46.7±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.38
ACD/LogD (pH 5.5): 2.17
ACD/BCF (pH 5.5): 26.07
ACD/KOC (pH 5.5): 359.16
ACD/LogD (pH 7.4): 2.17
ACD/BCF (pH 7.4): 26.07
ACD/KOC (pH 7.4): 359.16
Polar Surface Area: 68 Å2
Polarizability: 18.5±0.5 10-24cm3
Surface Tension: 38.4±3.0 dyne/cm
Molar Volume: 162.6±3.0 cm3

Click to predict properties on the Chemicalize site


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