ChemSpider 2D Image | 4-(2-Hydroxy-1-phenylethyl)-3-thiomorpholinone | C12H15NO2S

4-(2-Hydroxy-1-phenylethyl)-3-thiomorpholinone

  • Molecular FormulaC12H15NO2S
  • Average mass237.318 Da
  • Monoisotopic mass237.082352 Da
  • ChemSpider ID26285777

More details:

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

3-Thiomorpholinone, 4-(2-hydroxy-1-phenylethyl)- [ACD/Index Name]
4-(2-Hydroxy-1-phenylethyl)-3-thiomorpholinon [German] [ACD/IUPAC Name]
4-(2-Hydroxy-1-phenylethyl)-3-thiomorpholinone [ACD/IUPAC Name]
4-(2-Hydroxy-1-phényléthyl)-3-thiomorpholinone [French] [ACD/IUPAC Name]
(R)-4-(2-hydroxy-1-phenylethyl)thiomorpholin-3-one
627064-71-5 [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: 469.0±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 77.0±3.0 kJ/mol
Flash Point: 237.4±28.7 °C
Index of Refraction: 1.621
Molar Refractivity: 65.6±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.76
ACD/LogD (pH 5.5): 1.24
ACD/BCF (pH 5.5): 5.12
ACD/KOC (pH 5.5): 112.09
ACD/LogD (pH 7.4): 1.24
ACD/BCF (pH 7.4): 5.12
ACD/KOC (pH 7.4): 112.09
Polar Surface Area: 66 Å2
Polarizability: 26.0±0.5 10-24cm3
Surface Tension: 57.4±3.0 dyne/cm
Molar Volume: 186.6±3.0 cm3

Click to predict properties on the Chemicalize site


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