ChemSpider 2D Image | 2-(4-Chloro-3-methylphenoxy)-N-{[1-(4-methyl-1-piperazinyl)cyclohexyl]methyl}propanamide | C22H34ClN3O2

2-(4-Chloro-3-methylphenoxy)-N-{[1-(4-methyl-1-piperazinyl)cyclohexyl]methyl}propanamide

  • Molecular FormulaC22H34ClN3O2
  • Average mass407.977 Da
  • Monoisotopic mass407.233948 Da
  • ChemSpider ID21611715

More details:

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

2-(4-Chlor-3-methylphenoxy)-N-{[1-(4-methyl-1-piperazinyl)cyclohexyl]methyl}propanamid [German] [ACD/IUPAC Name]
2-(4-Chloro-3-methylphenoxy)-N-{[1-(4-methyl-1-piperazinyl)cyclohexyl]methyl}propanamide [ACD/IUPAC Name]
2-(4-Chloro-3-méthylphénoxy)-N-{[1-(4-méthyl-1-pipérazinyl)cyclohexyl]méthyl}propanamide [French] [ACD/IUPAC Name]
2-(4-Chloro-3-methylphenoxy)-N-{[1-(4-methylpiperazin-1-yl)cyclohexyl]methyl}propanamide
Propanamide, 2-(4-chloro-3-methylphenoxy)-N-[[1-(4-methyl-1-piperazinyl)cyclohexyl]methyl]- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 573.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 85.9±3.0 kJ/mol
Flash Point: 300.6±30.1 °C
Index of Refraction: 1.545
Molar Refractivity: 114.1±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.69
ACD/LogD (pH 5.5): 0.99
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 5.29
ACD/LogD (pH 7.4): 2.72
ACD/BCF (pH 7.4): 42.29
ACD/KOC (pH 7.4): 286.11
Polar Surface Area: 45 Å2
Polarizability: 45.2±0.5 10-24cm3
Surface Tension: 42.7±3.0 dyne/cm
Molar Volume: 360.6±3.0 cm3

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