ChemSpider 2D Image | 3-[2-(Methylsulfonyl)ethyl]tetrahydro-3-thiopheneol | C7H14O3S2

3-[2-(Methylsulfonyl)ethyl]tetrahydro-3-thiopheneol

  • Molecular FormulaC7H14O3S2
  • Average mass210.314 Da
  • Monoisotopic mass210.038437 Da
  • ChemSpider ID35749612

More details:

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

3-[2-(Methylsulfonyl)ethyl]tetrahydro-3-thiopheneol [ACD/IUPAC Name]
3-[2-(Méthylsulfonyl)éthyl]tétrahydro-3-thiophèneol [French] [ACD/IUPAC Name]
3-[2-(Methylsulfonyl)ethyl]tetrahydro-3-thiophenol [German] [ACD/IUPAC Name]
3-Thiopheneol, tetrahydro-3-[2-(methylsulfonyl)ethyl]- [ACD/Index Name]
1533244-63-1 [RN]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 429.0±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 79.0±6.0 kJ/mol
Flash Point: 213.3±24.6 °C
Index of Refraction: 1.553
Molar Refractivity: 50.8±0.4 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -0.88
ACD/LogD (pH 5.5): 0.02
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 24.53
ACD/LogD (pH 7.4): 0.02
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 24.53
Polar Surface Area: 88 Å2
Polarizability: 20.1±0.5 10-24cm3
Surface Tension: 55.9±3.0 dyne/cm
Molar Volume: 158.7±3.0 cm3

Click to predict properties on the Chemicalize site


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