ChemSpider 2D Image | 2-Cyclohexyl-2-(3-thietanyl)ethanol | C11H20OS

2-Cyclohexyl-2-(3-thietanyl)ethanol

  • Molecular FormulaC11H20OS
  • Average mass200.341 Da
  • Monoisotopic mass200.123489 Da
  • ChemSpider ID45621859

More details:

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

2-Cyclohexyl-2-(3-thietanyl)ethanol [German] [ACD/IUPAC Name]
2-Cyclohexyl-2-(3-thietanyl)ethanol [ACD/IUPAC Name]
2-Cyclohexyl-2-(3-thiétanyl)éthanol [French] [ACD/IUPAC Name]
3-Thietaneethanol, β-cyclohexyl- [ACD/Index Name]
1780004-97-8 [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: 321.7±15.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 65.3±6.0 kJ/mol
Flash Point: 156.7±19.1 °C
Index of Refraction: 1.553
Molar Refractivity: 58.4±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.49
ACD/LogD (pH 5.5): 2.78
ACD/BCF (pH 5.5): 76.43
ACD/KOC (pH 5.5): 775.60
ACD/LogD (pH 7.4): 2.78
ACD/BCF (pH 7.4): 76.43
ACD/KOC (pH 7.4): 775.60
Polar Surface Area: 46 Å2
Polarizability: 23.2±0.5 10-24cm3
Surface Tension: 45.8±3.0 dyne/cm
Molar Volume: 182.6±3.0 cm3

Click to predict properties on the Chemicalize site


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