ChemSpider 2D Image | 1-{4-[1-(2-Chlorophenyl)-3-ethyl-1H-1,2,4-triazol-5-yl]-2-butanyl}-4-methylpiperazine | C19H28ClN5

1-{4-[1-(2-Chlorophenyl)-3-ethyl-1H-1,2,4-triazol-5-yl]-2-butanyl}-4-methylpiperazine

  • Molecular FormulaC19H28ClN5
  • Average mass361.912 Da
  • Monoisotopic mass361.203339 Da
  • ChemSpider ID62739829

More details:

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

1-{4-[1-(2-Chlorophenyl)-3-ethyl-1H-1,2,4-triazol-5-yl]-2-butanyl}-4-methylpiperazine [ACD/IUPAC Name]
1-{4-[1-(2-Chlorophényl)-3-éthyl-1H-1,2,4-triazol-5-yl]-2-butanyl}-4-méthylpipérazine [French] [ACD/IUPAC Name]
1-{4-[1-(2-Chlorphenyl)-3-ethyl-1H-1,2,4-triazol-5-yl]-2-butanyl}-4-methylpiperazin [German] [ACD/IUPAC Name]
Piperazine, 1-[3-[1-(2-chlorophenyl)-3-ethyl-1H-1,2,4-triazol-5-yl]-1-methylpropyl]-4-methyl- [ACD/Index Name]
1-{3-[1-(2-chlorophenyl)-3-ethyl-1H-1,2,4-triazol-5-yl]-1-methylpropyl}-4-methylpiperazine

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

Density: 1.2±0.1 g/cm3
Boiling Point: 523.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 79.7±3.0 kJ/mol
Flash Point: 270.5±32.9 °C
Index of Refraction: 1.610
Molar Refractivity: 104.5±0.5 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.01
ACD/LogD (pH 5.5): 0.81
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 5.55
ACD/LogD (pH 7.4): 2.53
ACD/BCF (pH 7.4): 34.48
ACD/KOC (pH 7.4): 288.30
Polar Surface Area: 37 Å2
Polarizability: 41.4±0.5 10-24cm3
Surface Tension: 43.0±7.0 dyne/cm
Molar Volume: 301.4±7.0 cm3

Click to predict properties on the Chemicalize site


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