ChemSpider 2D Image | 1,2-Dithian-3-one | C4H6OS2

1,2-Dithian-3-one

  • Molecular FormulaC4H6OS2
  • Average mass134.220 Da
  • Monoisotopic mass133.986008 Da
  • ChemSpider ID28293929

More details:

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

1,2-Dithian-3-on [German] [ACD/IUPAC Name]
1,2-Dithian-3-one [ACD/Index Name] [ACD/IUPAC Name]
1,2-Dithian-3-one [French] [ACD/Index Name] [ACD/IUPAC Name]
3347-22-6 [RN]
Dithianon

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

Density: 1.3±0.1 g/cm3
Boiling Point: 238.3±23.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 47.5±3.0 kJ/mol
Flash Point: 107.3±12.7 °C
Index of Refraction: 1.601
Molar Refractivity: 34.9±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 0.42
ACD/LogD (pH 5.5): 1.09
ACD/BCF (pH 5.5): 3.94
ACD/KOC (pH 5.5): 92.85
ACD/LogD (pH 7.4): 1.09
ACD/BCF (pH 7.4): 3.94
ACD/KOC (pH 7.4): 92.85
Polar Surface Area: 68 Å2
Polarizability: 13.8±0.5 10-24cm3
Surface Tension: 49.7±3.0 dyne/cm
Molar Volume: 101.9±3.0 cm3

Click to predict properties on the Chemicalize site


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