ChemSpider 2D Image | 4-Methyl-2-({methyl[1-(5-methyl-2-thienyl)ethyl]amino}methyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione | C12H18N4S2

4-Methyl-2-({methyl[1-(5-methyl-2-thienyl)ethyl]amino}methyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione

  • Molecular FormulaC12H18N4S2
  • Average mass282.428 Da
  • Monoisotopic mass282.097290 Da
  • ChemSpider ID26114156

More details:

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

3H-1,2,4-Triazole-3-thione, 2,4-dihydro-4-methyl-2-[[methyl[1-(5-methyl-2-thienyl)ethyl]amino]methyl]- [ACD/Index Name]
4-Methyl-2-({methyl[1-(5-methyl-2-thienyl)ethyl]amino}methyl)-2,4-dihydro-3H-1,2,4-triazol-3-thion [German] [ACD/IUPAC Name]
4-Methyl-2-({methyl[1-(5-methyl-2-thienyl)ethyl]amino}methyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione [ACD/IUPAC Name]
4-Méthyl-2-({méthyl[1-(5-méthyl-2-thiényl)éthyl]amino}méthyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione [French] [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: 346.1±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 59.0±3.0 kJ/mol
Flash Point: 163.1±30.7 °C
Index of Refraction: 1.648
Molar Refractivity: 82.1±0.5 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.25
ACD/LogD (pH 5.5): 1.35
ACD/BCF (pH 5.5): 5.61
ACD/KOC (pH 5.5): 104.24
ACD/LogD (pH 7.4): 1.56
ACD/BCF (pH 7.4): 9.02
ACD/KOC (pH 7.4): 167.68
Polar Surface Area: 82 Å2
Polarizability: 32.5±0.5 10-24cm3
Surface Tension: 43.2±7.0 dyne/cm
Molar Volume: 225.6±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement