ChemSpider 2D Image | 1,4-Dithiacycloundecane-5,11-dione | C9H14O2S2

1,4-Dithiacycloundecane-5,11-dione

  • Molecular FormulaC9H14O2S2
  • Average mass218.336 Da
  • Monoisotopic mass218.043518 Da
  • ChemSpider ID28705591

More details:

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

1,4-Dithiacycloundecan-5,11-dion [German] [ACD/IUPAC Name]
1,4-Dithiacycloundecane-5,11-dione [ACD/Index Name] [ACD/IUPAC Name]
1,4-Dithiacycloundécane-5,11-dione [French] [ACD/IUPAC Name]
89863-24-1 [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: 415.3±38.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 66.8±3.0 kJ/mol
Flash Point: 190.4±16.8 °C
Index of Refraction: 1.533
Molar Refractivity: 58.1±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 2.24
ACD/LogD (pH 5.5): 2.13
ACD/BCF (pH 5.5): 24.58
ACD/KOC (pH 5.5): 344.30
ACD/LogD (pH 7.4): 2.13
ACD/BCF (pH 7.4): 24.58
ACD/KOC (pH 7.4): 344.30
Polar Surface Area: 85 Å2
Polarizability: 23.0±0.5 10-24cm3
Surface Tension: 41.9±3.0 dyne/cm
Molar Volume: 187.1±3.0 cm3

Click to predict properties on the Chemicalize site


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