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Search term: WISGKSDSSHIRLS (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 2-Sulfanyl-1-(4-thiomorpholinyl)ethanone | C6H11NOS2

2-Sulfanyl-1-(4-thiomorpholinyl)ethanone

  • Molecular FormulaC6H11NOS2
  • Average mass177.288 Da
  • Monoisotopic mass177.028198 Da
  • ChemSpider ID48217386

More details:

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

2-Sulfanyl-1-(4-thiomorpholinyl)ethanon [German] [ACD/IUPAC Name]
2-Sulfanyl-1-(4-thiomorpholinyl)ethanone [ACD/IUPAC Name]
2-Sulfanyl-1-(4-thiomorpholinyl)éthanone [French] [ACD/IUPAC Name]
Ethanone, 2-mercapto-1-(4-thiomorpholinyl)- [ACD/Index Name]
2-sulfanyl-1-(thiomorpholin-4-yl)ethan-1-one
856939-99-6 [RN]
MFCD21273700

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

Density: 1.2±0.1 g/cm3
Boiling Point: 345.6±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 59.0±3.0 kJ/mol
Flash Point: 162.8±26.5 °C
Index of Refraction: 1.579
Molar Refractivity: 47.3±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 0.54
ACD/LogD (pH 5.5): 1.13
ACD/BCF (pH 5.5): 4.22
ACD/KOC (pH 5.5): 97.50
ACD/LogD (pH 7.4): 1.08
ACD/BCF (pH 7.4): 3.79
ACD/KOC (pH 7.4): 87.59
Polar Surface Area: 84 Å2
Polarizability: 18.7±0.5 10-24cm3
Surface Tension: 49.6±3.0 dyne/cm
Molar Volume: 142.3±3.0 cm3

Click to predict properties on the Chemicalize site


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