ChemSpider 2D Image | 6,7,8,9,10,11,12,13-Octahydro-5H-[1,3]dithiolo[4,5-b][1,4]dithiacyclotridecine-2-thione | C12H18S5

6,7,8,9,10,11,12,13-Octahydro-5H-[1,3]dithiolo[4,5-b][1,4]dithiacyclotridecine-2-thione

  • Molecular FormulaC12H18S5
  • Average mass322.596 Da
  • Monoisotopic mass322.001190 Da
  • ChemSpider ID21119280

More details:

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

5H-1,3-Dithiolo[4,5-b][1,4]dithiacyclotridecin-2-thione, 6,7,8,9,10,11,12,13-octahydro- [ACD/Index Name]
6,7,8,9,10,11,12,13-Octahydro-5H-[1,3]dithiolo[4,5-b][1,4]dithiacyclotridecin-2-thion [German] [ACD/IUPAC Name]
6,7,8,9,10,11,12,13-Octahydro-5H-[1,3]dithiolo[4,5-b][1,4]dithiacyclotridecine-2-thione [ACD/IUPAC Name]
6,7,8,9,10,11,12,13-Octahydro-5H-[1,3]dithiolo[4,5-b][1,4]dithiacyclotridécine-2-thione [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 448.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 68.0±3.0 kJ/mol
Flash Point: 225.2±31.5 °C
Index of Refraction: 1.681
Molar Refractivity: 92.2±0.4 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 1
ACD/LogP: 5.96
ACD/LogD (pH 5.5): 5.33
ACD/BCF (pH 5.5): 6606.38
ACD/KOC (pH 5.5): 18876.47
ACD/LogD (pH 7.4): 5.33
ACD/BCF (pH 7.4): 6606.38
ACD/KOC (pH 7.4): 18876.47
Polar Surface Area: 133 Å2
Polarizability: 36.5±0.5 10-24cm3
Surface Tension: 63.7±5.0 dyne/cm
Molar Volume: 243.6±5.0 cm3

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