ChemSpider 2D Image | 2H-1,3,4-Thiadiazine-2-thiol | C3H4N2S2

2H-1,3,4-Thiadiazine-2-thiol

  • Molecular FormulaC3H4N2S2
  • Average mass132.207 Da
  • Monoisotopic mass131.981583 Da
  • ChemSpider ID67030978

More details:






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

2H-1,3,4-Thiadiazin-2-thiol [German] [ACD/IUPAC Name]
2H-1,3,4-Thiadiazine-2-thiol [ACD/Index Name] [ACD/IUPAC Name]
2H-1,3,4-Thiadiazine-2-thiol [French] [ACD/Index Name] [ACD/IUPAC Name]
2-mercapto-1,3,4-thiadiazine

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.6±0.1 g/cm3
Boiling Point: 243.5±40.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.5 mmHg at 25°C
Enthalpy of Vaporization: 46.1±3.0 kJ/mol
Flash Point: 101.1±27.3 °C
Index of Refraction: 1.769
Molar Refractivity: 35.1±0.5 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 0.87
ACD/LogD (pH 5.5): 1.57
ACD/BCF (pH 5.5): 8.67
ACD/KOC (pH 5.5): 153.30
ACD/LogD (pH 7.4): 0.34
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 9.18
Polar Surface Area: 89 Å2
Polarizability: 13.9±0.5 10-24cm3
Surface Tension: 58.1±7.0 dyne/cm
Molar Volume: 84.4±7.0 cm3

Click to predict properties on the Chemicalize site






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