ChemSpider 2D Image | 5-(sec-Butylsulfanyl)-1,3,4-thiadiazolidine-2-thione | C6H12N2S3

5-(sec-Butylsulfanyl)-1,3,4-thiadiazolidine-2-thione

  • Molecular FormulaC6H12N2S3
  • Average mass208.368 Da
  • Monoisotopic mass208.016251 Da
  • ChemSpider ID113461123

More details:

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

1,3,4-Thiadiazolidine-2-thione, 5-[(1-methylpropyl)thio]- [ACD/Index Name]
5-(sec-Butylsulfanyl)-1,3,4-thiadiazolidin-2-thion [German] [ACD/IUPAC Name]
5-(sec-Butylsulfanyl)-1,3,4-thiadiazolidine-2-thione [ACD/IUPAC Name]
5-(sec-Butylsulfanyl)-1,3,4-thiadiazolidine-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: 298.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 53.9±3.0 kJ/mol
Flash Point: 134.6±30.1 °C
Index of Refraction: 1.649
Molar Refractivity: 58.2±0.4 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.51
ACD/LogD (pH 5.5): 2.06
ACD/BCF (pH 5.5): 21.72
ACD/KOC (pH 5.5): 315.07
ACD/LogD (pH 7.4): 2.04
ACD/BCF (pH 7.4): 20.47
ACD/KOC (pH 7.4): 296.97
Polar Surface Area: 107 Å2
Polarizability: 23.1±0.5 10-24cm3
Surface Tension: 60.2±5.0 dyne/cm
Molar Volume: 159.6±5.0 cm3

Click to predict properties on the Chemicalize site


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