ChemSpider 2D Image | 4-(2-Methoxyphenyl)-5-[2-(3,4,5-trimethoxyphenyl)ethyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione | C20H23N3O4S

4-(2-Methoxyphenyl)-5-[2-(3,4,5-trimethoxyphenyl)ethyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione

  • Molecular FormulaC20H23N3O4S
  • Average mass401.479 Da
  • Monoisotopic mass401.140930 Da
  • ChemSpider ID21119606

More details:

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

3H-1,2,4-Triazole-3-thione, 2,4-dihydro-4-(2-methoxyphenyl)-5-[2-(3,4,5-trimethoxyphenyl)ethyl]- [ACD/Index Name]
4-(2-Methoxyphenyl)-5-[2-(3,4,5-trimethoxyphenyl)ethyl]-2,4-dihydro-3H-1,2,4-triazol-3-thion [German] [ACD/IUPAC Name]
4-(2-Methoxyphenyl)-5-[2-(3,4,5-trimethoxyphenyl)ethyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione [ACD/IUPAC Name]
4-(2-Méthoxyphényl)-5-[2-(3,4,5-triméthoxyphényl)éthyl]-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: 589.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 88.0±3.0 kJ/mol
Flash Point: 310.4±32.9 °C
Index of Refraction: 1.598
Molar Refractivity: 109.3±0.5 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 4.29
ACD/LogD (pH 5.5): 2.33
ACD/BCF (pH 5.5): 18.52
ACD/KOC (pH 5.5): 133.70
ACD/LogD (pH 7.4): 1.25
ACD/BCF (pH 7.4): 1.55
ACD/KOC (pH 7.4): 11.19
Polar Surface Area: 106 Å2
Polarizability: 43.3±0.5 10-24cm3
Surface Tension: 41.2±7.0 dyne/cm
Molar Volume: 320.3±7.0 cm3

Click to predict properties on the Chemicalize site


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