ChemSpider 2D Image | 3-(3-Ethylphenyl)-5-(3-methoxyphenyl)-1H-1,2,4-triazole | C17H17N3O

3-(3-Ethylphenyl)-5-(3-methoxyphenyl)-1H-1,2,4-triazole

  • Molecular FormulaC17H17N3O
  • Average mass279.336 Da
  • Monoisotopic mass279.137177 Da
  • ChemSpider ID57477042

More details:






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

1H-1,2,4-Triazole, 3-(3-ethylphenyl)-5-(3-methoxyphenyl)- [ACD/Index Name]
3-(3-Ethylphenyl)-5-(3-methoxyphenyl)-1H-1,2,4-triazol [German] [ACD/IUPAC Name]
3-(3-Ethylphenyl)-5-(3-methoxyphenyl)-1H-1,2,4-triazole [ACD/IUPAC Name]
3-(3-Éthylphényl)-5-(3-méthoxyphényl)-1H-1,2,4-triazole [French] [ACD/IUPAC Name]
(3-Ethylphenyl)-5-(3-methoxyphenyl)-1,2,4-triazole

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 501.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 77.1±3.0 kJ/mol
Flash Point: 178.0±23.1 °C
Index of Refraction: 1.597
Molar Refractivity: 82.3±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 5.06
ACD/LogD (pH 5.5): 4.38
ACD/BCF (pH 5.5): 1244.62
ACD/KOC (pH 5.5): 5714.04
ACD/LogD (pH 7.4): 4.37
ACD/BCF (pH 7.4): 1238.46
ACD/KOC (pH 7.4): 5685.75
Polar Surface Area: 51 Å2
Polarizability: 32.6±0.5 10-24cm3
Surface Tension: 47.8±3.0 dyne/cm
Molar Volume: 241.6±3.0 cm3

Click to predict properties on the Chemicalize site






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