ChemSpider 2D Image | 3-(Tetrahydro-2H-thiopyran-4-yl)-3-thietanamine | C8H15NS2

3-(Tetrahydro-2H-thiopyran-4-yl)-3-thietanamine

  • Molecular FormulaC8H15NS2
  • Average mass189.341 Da
  • Monoisotopic mass189.064590 Da
  • ChemSpider ID37674029

More details:

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

3-(Tetrahydro-2H-thiopyran-4-yl)-3-thietanamin [German] [ACD/IUPAC Name]
3-(Tetrahydro-2H-thiopyran-4-yl)-3-thietanamine [ACD/IUPAC Name]
3-(Tétrahydro-2H-thiopyrane-4-yl)-3-thiétanamine [French] [ACD/IUPAC Name]
3-Thietanamine, 3-(tetrahydro-2H-thiopyran-4-yl)- [ACD/Index Name]
1540658-47-6 [RN]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 314.6±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 55.6±3.0 kJ/mol
Flash Point: 144.1±27.9 °C
Index of Refraction: 1.619
Molar Refractivity: 54.7±0.3 cm3
#H bond acceptors: 1
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 1.01
ACD/LogD (pH 5.5): 0.33
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 11.68
ACD/LogD (pH 7.4): 1.35
ACD/BCF (pH 7.4): 6.01
ACD/KOC (pH 7.4): 121.15
Polar Surface Area: 77 Å2
Polarizability: 21.7±0.5 10-24cm3
Surface Tension: 58.6±3.0 dyne/cm
Molar Volume: 156.0±3.0 cm3

Click to predict properties on the Chemicalize site


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