ChemSpider 2D Image | 3-[2-(Trifluoromethyl)phenyl]tetrahydro-3-thiopheneol | C11H11F3OS

3-[2-(Trifluoromethyl)phenyl]tetrahydro-3-thiopheneol

  • Molecular FormulaC11H11F3OS
  • Average mass248.265 Da
  • Monoisotopic mass248.048264 Da
  • ChemSpider ID35749518

More details:

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

3-[2-(Trifluormethyl)phenyl]tetrahydro-3-thiophenol [German] [ACD/IUPAC Name]
3-[2-(Trifluoromethyl)phenyl]tetrahydro-3-thiopheneol [ACD/IUPAC Name]
3-[2-(Trifluorométhyl)phényl]tétrahydro-3-thiophèneol [French] [ACD/IUPAC Name]
3-Thiopheneol, tetrahydro-3-[2-(trifluoromethyl)phenyl]- [ACD/Index Name]
[NO NAME]
1510886-42-6 [RN]
3-(2-(Trifluoromethyl)phenyl)thiolan-3-ol

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

Density: 1.4±0.1 g/cm3
Boiling Point: 332.0±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 60.7±3.0 kJ/mol
Flash Point: 154.6±27.9 °C
Index of Refraction: 1.547
Molar Refractivity: 57.5±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.34
ACD/LogD (pH 5.5): 2.72
ACD/BCF (pH 5.5): 69.19
ACD/KOC (pH 5.5): 722.27
ACD/LogD (pH 7.4): 2.72
ACD/BCF (pH 7.4): 69.19
ACD/KOC (pH 7.4): 722.27
Polar Surface Area: 46 Å2
Polarizability: 22.8±0.5 10-24cm3
Surface Tension: 40.5±3.0 dyne/cm
Molar Volume: 181.3±3.0 cm3

Click to predict properties on the Chemicalize site


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