ChemSpider 2D Image | 4,5-Dimethyl-1,2,4-triazolidine-3-thione | C4H9N3S

4,5-Dimethyl-1,2,4-triazolidine-3-thione

  • Molecular FormulaC4H9N3S
  • Average mass131.199 Da
  • Monoisotopic mass131.051712 Da
  • ChemSpider ID24005886

More details:

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

1,2,4-Triazolidine-3-thione, 4,5-dimethyl- [ACD/Index Name]
4,5-Dimethyl-1,2,4-triazolidin-3-thion [German] [ACD/IUPAC Name]
4,5-Dimethyl-1,2,4-triazolidine-3-thione [ACD/IUPAC Name]
4,5-Diméthyl-1,2,4-triazolidine-3-thione [French] [ACD/IUPAC Name]
1,2,4-Triazolidine-3-thione, 4,5-dimethyl- (9CI)
1,2,4-Triazolidine-3-thione,4,5-dimethyl-(9CI)
150743-77-4 [RN]
38942-50-6 [RN]
4,5-dimethyl-4H-1,2,4-triazole-3-thiol [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: 152.9±23.0 °C at 760 mmHg
Vapour Pressure: 3.4±0.3 mmHg at 25°C
Enthalpy of Vaporization: 39.0±3.0 kJ/mol
Flash Point: 46.2±22.6 °C
Index of Refraction: 1.624
Molar Refractivity: 36.8±0.4 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: -0.05
ACD/LogD (pH 5.5): -0.24
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 17.70
ACD/LogD (pH 7.4): -0.24
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 17.70
Polar Surface Area: 59 Å2
Polarizability: 14.6±0.5 10-24cm3
Surface Tension: 58.3±5.0 dyne/cm
Molar Volume: 104.2±5.0 cm3

Click to predict properties on the Chemicalize site


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