ChemSpider 2D Image | 5-Methyl-4-(3-methylcyclohexyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione | C10H17N3S

5-Methyl-4-(3-methylcyclohexyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione

  • Molecular FormulaC10H17N3S
  • Average mass211.327 Da
  • Monoisotopic mass211.114319 Da
  • ChemSpider ID30994491

More details:

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

3H-1,2,4-Triazole-3-thione, 2,4-dihydro-5-methyl-4-(3-methylcyclohexyl)- [ACD/Index Name]
5-Methyl-4-(3-methylcyclohexyl)-2,4-dihydro-3H-1,2,4-triazol-3-thion [German] [ACD/IUPAC Name]
5-Methyl-4-(3-methylcyclohexyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione [ACD/IUPAC Name]
5-Méthyl-4-(3-méthylcyclohexyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione [French] [ACD/IUPAC Name]
1096306-89-6 [RN]
MFCD12166493

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

Density: 1.3±0.1 g/cm3
Boiling Point: 356.9±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 60.2±3.0 kJ/mol
Flash Point: 169.6±23.2 °C
Index of Refraction: 1.662
Molar Refractivity: 60.5±0.5 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 3.10
ACD/LogD (pH 5.5): 1.29
ACD/BCF (pH 5.5): 2.64
ACD/KOC (pH 5.5): 28.65
ACD/LogD (pH 7.4): 0.68
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 7.11
Polar Surface Area: 70 Å2
Polarizability: 24.0±0.5 10-24cm3
Surface Tension: 42.6±7.0 dyne/cm
Molar Volume: 163.7±7.0 cm3

Click to predict properties on the Chemicalize site


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