ChemSpider 2D Image | 5-(3,5-Dimethoxyphenyl)-4-(2-methoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione | C17H17N3O3S

5-(3,5-Dimethoxyphenyl)-4-(2-methoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione

  • Molecular FormulaC17H17N3O3S
  • Average mass343.400 Da
  • Monoisotopic mass343.099060 Da
  • ChemSpider ID21123988

More details:

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

3H-1,2,4-Triazole-3-thione, 5-(3,5-dimethoxyphenyl)-2,4-dihydro-4-(2-methoxyphenyl)- [ACD/Index Name]
5-(3,5-Dimethoxyphenyl)-4-(2-methoxyphenyl)-2,4-dihydro-3H-1,2,4-triazol-3-thion [German] [ACD/IUPAC Name]
5-(3,5-Dimethoxyphenyl)-4-(2-methoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione [ACD/IUPAC Name]
5-(3,5-Diméthoxyphényl)-4-(2-méthoxyphényl)-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: 564.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.8±3.0 kJ/mol
Flash Point: 295.1±32.9 °C
Index of Refraction: 1.625
Molar Refractivity: 94.2±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 5.06
ACD/LogD (pH 5.5): 2.84
ACD/BCF (pH 5.5): 51.42
ACD/KOC (pH 5.5): 320.06
ACD/LogD (pH 7.4): 1.23
ACD/BCF (pH 7.4): 1.25
ACD/KOC (pH 7.4): 7.79
Polar Surface Area: 97 Å2
Polarizability: 37.4±0.5 10-24cm3
Surface Tension: 43.3±7.0 dyne/cm
Molar Volume: 266.5±7.0 cm3

Click to predict properties on the Chemicalize site


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