ChemSpider 2D Image | 4-(2-Methoxyphenyl)-5-[2-(3-methoxyphenyl)ethyl]-2,4-dihydro-3H-1,2,4-triazol-3-one | C18H19N3O3

4-(2-Methoxyphenyl)-5-[2-(3-methoxyphenyl)ethyl]-2,4-dihydro-3H-1,2,4-triazol-3-one

  • Molecular FormulaC18H19N3O3
  • Average mass325.362 Da
  • Monoisotopic mass325.142639 Da
  • ChemSpider ID24740999

More details:

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

3H-1,2,4-Triazol-3-one, 2,4-dihydro-4-(2-methoxyphenyl)-5-[2-(3-methoxyphenyl)ethyl]- [ACD/Index Name]
4-(2-Methoxyphenyl)-5-[2-(3-methoxyphenyl)ethyl]-2,4-dihydro-3H-1,2,4-triazol-3-on [German] [ACD/IUPAC Name]
4-(2-Methoxyphenyl)-5-[2-(3-methoxyphenyl)ethyl]-2,4-dihydro-3H-1,2,4-triazol-3-one [ACD/IUPAC Name]
4-(2-Méthoxyphényl)-5-[2-(3-méthoxyphényl)éthyl]-2,4-dihydro-3H-1,2,4-triazol-3-one [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 579.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 89.9±3.0 kJ/mol
Flash Point: 304.4±32.9 °C
Index of Refraction: 1.603
Molar Refractivity: 91.2±0.5 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.73
ACD/LogD (pH 5.5): 3.06
ACD/BCF (pH 5.5): 111.92
ACD/KOC (pH 5.5): 893.37
ACD/LogD (pH 7.4): 2.56
ACD/BCF (pH 7.4): 35.54
ACD/KOC (pH 7.4): 283.73
Polar Surface Area: 69 Å2
Polarizability: 36.1±0.5 10-24cm3
Surface Tension: 44.9±7.0 dyne/cm
Molar Volume: 265.5±7.0 cm3

Click to predict properties on the Chemicalize site


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