ChemSpider 2D Image | 2-[(2,6-Dimethyl-4-thiomorpholinyl)methyl]-2-propyl-1-pentanethiol | C15H31NS2

2-[(2,6-Dimethyl-4-thiomorpholinyl)methyl]-2-propyl-1-pentanethiol

  • Molecular FormulaC15H31NS2
  • Average mass289.543 Da
  • Monoisotopic mass289.189789 Da
  • ChemSpider ID35577963

More details:

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

2-[(2,6-Dimethyl-4-thiomorpholinyl)methyl]-2-propyl-1-pentanethiol [ACD/IUPAC Name]
2-[(2,6-Diméthyl-4-thiomorpholinyl)méthyl]-2-propyl-1-pentanethiol [French] [ACD/IUPAC Name]
2-[(2,6-Dimethyl-4-thiomorpholinyl)methyl]-2-propyl-1-pentanthiol [German] [ACD/IUPAC Name]
4-Thiomorpholinepropanethiol, 2,6-dimethyl-β,β-dipropyl- [ACD/Index Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 379.9±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 62.8±3.0 kJ/mol
Flash Point: 183.6±26.5 °C
Index of Refraction: 1.498
Molar Refractivity: 89.2±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 5.42
ACD/LogD (pH 5.5): 3.29
ACD/BCF (pH 5.5): 64.58
ACD/KOC (pH 5.5): 197.35
ACD/LogD (pH 7.4): 4.88
ACD/BCF (pH 7.4): 2512.88
ACD/KOC (pH 7.4): 7679.39
Polar Surface Area: 67 Å2
Polarizability: 35.4±0.5 10-24cm3
Surface Tension: 32.3±3.0 dyne/cm
Molar Volume: 304.2±3.0 cm3

Click to predict properties on the Chemicalize site


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