ChemSpider 2D Image | 2-Thioxo-3-(4H-1,2,4-triazol-4-yl)-1,3-thiazolidin-4-one | C5H4N4OS2

2-Thioxo-3-(4H-1,2,4-triazol-4-yl)-1,3-thiazolidin-4-one

  • Molecular FormulaC5H4N4OS2
  • Average mass200.242 Da
  • Monoisotopic mass199.982651 Da
  • ChemSpider ID58541043

More details:

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

2-Thioxo-3-(4H-1,2,4-triazol-4-yl)-1,3-thiazolidin-4-on [German] [ACD/IUPAC Name]
2-Thioxo-3-(4H-1,2,4-triazol-4-yl)-1,3-thiazolidin-4-one [ACD/IUPAC Name]
2-Thioxo-3-(4H-1,2,4-triazol-4-yl)-1,3-thiazolidin-4-one [French] [ACD/IUPAC Name]
4-Thiazolidinone, 2-thioxo-3-(4H-1,2,4-triazol-4-yl)- [ACD/Index Name]

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

Density: 1.9±0.1 g/cm3
Boiling Point: 375.1±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 62.3±3.0 kJ/mol
Flash Point: 180.7±23.2 °C
Index of Refraction: 1.913
Molar Refractivity: 50.5±0.5 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -0.87
ACD/LogD (pH 5.5): -0.41
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 14.27
ACD/LogD (pH 7.4): -0.41
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 14.28
Polar Surface Area: 108 Å2
Polarizability: 20.0±0.5 10-24cm3
Surface Tension: 88.4±7.0 dyne/cm
Molar Volume: 107.5±7.0 cm3

Click to predict properties on the Chemicalize site


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