ChemSpider 2D Image | 4-Methyl-1,3-diazetidine-2-thione | C3H6N2S

4-Methyl-1,3-diazetidine-2-thione

  • Molecular FormulaC3H6N2S
  • Average mass102.158 Da
  • Monoisotopic mass102.025169 Da
  • ChemSpider ID32975602

More details:

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

1,3-Diazetidine-2-thione, 4-methyl- [ACD/Index Name]
4-Methyl-1,3-diazetidin-2-thion [German] [ACD/IUPAC Name]
4-Methyl-1,3-diazetidine-2-thione [ACD/IUPAC Name]
4-Méthyl-1,3-diazétidine-2-thione [French] [ACD/IUPAC Name]
52890-43-4 [RN]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 115.5±23.0 °C at 760 mmHg
Vapour Pressure: 19.0±0.2 mmHg at 25°C
Enthalpy of Vaporization: 35.4±3.0 kJ/mol
Flash Point: 23.6±22.6 °C
Index of Refraction: 1.619
Molar Refractivity: 28.3±0.4 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 0.40
ACD/LogD (pH 5.5): -0.05
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 22.47
ACD/LogD (pH 7.4): -0.05
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 22.47
Polar Surface Area: 56 Å2
Polarizability: 11.2±0.5 10-24cm3
Surface Tension: 57.2±5.0 dyne/cm
Molar Volume: 80.6±5.0 cm3

Click to predict properties on the Chemicalize site


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