ChemSpider 2D Image | N-(4-Methylbenzyl)-2-(4-methyl-1-piperazinyl)-1-phenylethanamine | C21H29N3

N-(4-Methylbenzyl)-2-(4-methyl-1-piperazinyl)-1-phenylethanamine

  • Molecular FormulaC21H29N3
  • Average mass323.475 Da
  • Monoisotopic mass323.236145 Da
  • ChemSpider ID30488585

More details:

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

1-Piperazineethanamine, 4-methyl-N-[(4-methylphenyl)methyl]-α-phenyl- [ACD/Index Name]
N-(4-Methylbenzyl)-2-(4-methyl-1-piperazinyl)-1-phenylethanamin [German] [ACD/IUPAC Name]
N-(4-Methylbenzyl)-2-(4-methyl-1-piperazinyl)-1-phenylethanamine [ACD/IUPAC Name]
N-(4-Méthylbenzyl)-2-(4-méthyl-1-pipérazinyl)-1-phényléthanamine [French] [ACD/IUPAC Name]
[(4-METHYLPHENYL)METHYL][2-(4-METHYLPIPERAZIN-1-YL)-1-PHENYLETHYL]AMINE

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

Density: 1.0±0.1 g/cm3
Boiling Point: 453.2±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 71.3±3.0 kJ/mol
Flash Point: 234.0±22.0 °C
Index of Refraction: 1.570
Molar Refractivity: 101.6±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.94
ACD/LogD (pH 5.5): -0.54
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 2.09
ACD/BCF (pH 7.4): 10.78
ACD/KOC (pH 7.4): 78.89
Polar Surface Area: 19 Å2
Polarizability: 40.3±0.5 10-24cm3
Surface Tension: 41.3±3.0 dyne/cm
Molar Volume: 309.9±3.0 cm3

Click to predict properties on the Chemicalize site


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