ChemSpider 2D Image | 1-(4-Iodobenzyl)-3-methyl-3-phenylpiperazine | C18H21IN2

1-(4-Iodobenzyl)-3-methyl-3-phenylpiperazine

  • Molecular FormulaC18H21IN2
  • Average mass392.277 Da
  • Monoisotopic mass392.074921 Da
  • ChemSpider ID48820125

More details:

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

1-(4-Iodbenzyl)-3-methyl-3-phenylpiperazin [German] [ACD/IUPAC Name]
1-(4-Iodobenzyl)-3-methyl-3-phenylpiperazine [ACD/IUPAC Name]
1-(4-Iodobenzyl)-3-méthyl-3-phénylpipérazine [French] [ACD/IUPAC Name]
Piperazine, 1-[(4-iodophenyl)methyl]-3-methyl-3-phenyl- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 437.7±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 69.4±3.0 kJ/mol
Flash Point: 218.5±27.3 °C
Index of Refraction: 1.615
Molar Refractivity: 96.5±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 4.49
ACD/LogD (pH 5.5): 1.54
ACD/BCF (pH 5.5): 1.99
ACD/KOC (pH 5.5): 9.87
ACD/LogD (pH 7.4): 3.20
ACD/BCF (pH 7.4): 90.08
ACD/KOC (pH 7.4): 447.91
Polar Surface Area: 15 Å2
Polarizability: 38.3±0.5 10-24cm3
Surface Tension: 44.2±3.0 dyne/cm
Molar Volume: 276.5±3.0 cm3

Click to predict properties on the Chemicalize site


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