ChemSpider 2D Image | 1-[3-(3-Isopropyl-5-methylphenoxy)-3-phenylpropyl]-4-phenylpiperazine | C29H36N2O

1-[3-(3-Isopropyl-5-methylphenoxy)-3-phenylpropyl]-4-phenylpiperazine

  • Molecular FormulaC29H36N2O
  • Average mass428.609 Da
  • Monoisotopic mass428.282776 Da
  • ChemSpider ID22722790

More details:

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

1-[3-(3-Isopropyl-5-methylphenoxy)-3-phenylpropyl]-4-phenylpiperazin [German] [ACD/IUPAC Name]
1-[3-(3-Isopropyl-5-methylphenoxy)-3-phenylpropyl]-4-phenylpiperazine [ACD/IUPAC Name]
1-[3-(3-Isopropyl-5-méthylphénoxy)-3-phénylpropyl]-4-phénylpipérazine [French] [ACD/IUPAC Name]
Piperazine, 1-[3-[3-methyl-5-(1-methylethyl)phenoxy]-3-phenylpropyl]-4-phenyl- [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: 572.9±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: 152.2±27.3 °C
Index of Refraction: 1.578
Molar Refractivity: 133.7±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 7.37
ACD/LogD (pH 5.5): 4.95
ACD/BCF (pH 5.5): 1481.39
ACD/KOC (pH 5.5): 2389.78
ACD/LogD (pH 7.4): 6.33
ACD/BCF (pH 7.4): 34745.14
ACD/KOC (pH 7.4): 56050.75
Polar Surface Area: 16 Å2
Polarizability: 53.0±0.5 10-24cm3
Surface Tension: 42.3±3.0 dyne/cm
Molar Volume: 403.0±3.0 cm3

Click to predict properties on the Chemicalize site


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