ChemSpider 2D Image | 1-(1,1-Dioxidotetrahydro-3-thiophenyl)-2-(methylsulfonyl)ethanol | C7H14O5S2

1-(1,1-Dioxidotetrahydro-3-thiophenyl)-2-(methylsulfonyl)ethanol

  • Molecular FormulaC7H14O5S2
  • Average mass242.313 Da
  • Monoisotopic mass242.028259 Da
  • ChemSpider ID61803933

More details:

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

1-(1,1-Dioxidotetrahydro-3-thiophenyl)-2-(methylsulfonyl)ethanol [German] [ACD/IUPAC Name]
1-(1,1-Dioxidotetrahydro-3-thiophenyl)-2-(methylsulfonyl)ethanol [ACD/IUPAC Name]
1-(1,1-Dioxydotétrahydro-3-thiophényl)-2-(méthylsulfonyl)éthanol [French] [ACD/IUPAC Name]
3-Thiophenemethanol, tetrahydro-α-[(methylsulfonyl)methyl]-, 1,1-dioxide [ACD/Index Name]
1891343-09-1 [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: 574.7±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.6 mmHg at 25°C
Enthalpy of Vaporization: 98.9±6.0 kJ/mol
Flash Point: 301.3±23.2 °C
Index of Refraction: 1.533
Molar Refractivity: 51.5±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -2.47
ACD/LogD (pH 5.5): -1.67
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.94
ACD/LogD (pH 7.4): -1.67
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.93
Polar Surface Area: 105 Å2
Polarizability: 20.4±0.5 10-24cm3
Surface Tension: 55.6±3.0 dyne/cm
Molar Volume: 165.9±3.0 cm3

Click to predict properties on the Chemicalize site


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