ChemSpider 2D Image | 4-(~2~H_3_)Methyl-5-(2-pyrazinyl)-3H-1,2-dithiole-3-thione | C8H3D3N2S3

4-(2H3)Methyl-5-(2-pyrazinyl)-3H-1,2-dithiole-3-thione

  • Molecular FormulaC8H3D3N2S3
  • Average mass229.360 Da
  • Monoisotopic mass228.988144 Da
  • ChemSpider ID58780194

  • Non-standard isotope - Non-standard isotope

More details:

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

3H-1,2-Dithiole-3-thione, 4-(methyl-d3)-5-(2-pyrazinyl)- [ACD/Index Name]
4-(2H3)Methyl-5-(2-pyrazinyl)-3H-1,2-dithiol-3-thion [German] [ACD/IUPAC Name]
4-(2H3)Methyl-5-(2-pyrazinyl)-3H-1,2-dithiole-3-thione [ACD/IUPAC Name]
4-(2H3)Méthyl-5-(2-pyrazinyl)-3H-1,2-dithiole-3-thione [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 408.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 63.4±3.0 kJ/mol
Flash Point: 200.6±31.5 °C
Index of Refraction: 1.760
Molar Refractivity: 61.4±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 1.92
ACD/LogD (pH 5.5): 2.41
ACD/BCF (pH 5.5): 39.65
ACD/KOC (pH 5.5): 484.88
ACD/LogD (pH 7.4): 2.41
ACD/BCF (pH 7.4): 39.65
ACD/KOC (pH 7.4): 484.88
Polar Surface Area: 108 Å2
Polarizability: 24.4±0.5 10-24cm3
Surface Tension: 88.0±5.0 dyne/cm
Molar Volume: 149.3±5.0 cm3

Click to predict properties on the Chemicalize site


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