ChemSpider 2D Image | 3-[2-(Allylsulfanyl)ethyl]thietane 1,1-dioxide | C8H14O2S2

3-[2-(Allylsulfanyl)ethyl]thietane 1,1-dioxide

  • Molecular FormulaC8H14O2S2
  • Average mass206.326 Da
  • Monoisotopic mass206.043518 Da
  • ChemSpider ID71044666

More details:






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

1,1-Dioxyde de 3-[2-(allylsulfanyl)éthyl]thiétane [French] [ACD/IUPAC Name]
1878955-64-6 [RN]
3-[2-(Allylsulfanyl)ethyl]thietan-1,1-dioxid [German] [ACD/IUPAC Name]
3-[2-(Allylsulfanyl)ethyl]thietane 1,1-dioxide [ACD/IUPAC Name]
3-[2-(prop-2-en-1-ylsulfanyl)ethyl]-1??-thietane-1,1-dione
Thietane, 3-[2-(2-propen-1-ylthio)ethyl]-, 1,1-dioxide [ACD/Index Name]
3-(2-(Allylthio)ethyl)thietane 1,1-dioxide

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 379.7±15.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 60.3±3.0 kJ/mol
Flash Point: 183.5±20.4 °C
Index of Refraction: 1.530
Molar Refractivity: 53.6±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 0.45
ACD/LogD (pH 5.5): 0.71
ACD/BCF (pH 5.5): 2.04
ACD/KOC (pH 5.5): 57.89
ACD/LogD (pH 7.4): 0.71
ACD/BCF (pH 7.4): 2.04
ACD/KOC (pH 7.4): 57.89
Polar Surface Area: 68 Å2
Polarizability: 21.3±0.5 10-24cm3
Surface Tension: 39.6±3.0 dyne/cm
Molar Volume: 173.7±3.0 cm3

Click to predict properties on the Chemicalize site






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