ChemSpider 2D Image | 2-{4-[1-(2,3-Dimethylphenyl)-4-piperidinyl]-1-(2-phenylethyl)-2-piperazinyl}ethanol | C27H39N3O

2-{4-[1-(2,3-Dimethylphenyl)-4-piperidinyl]-1-(2-phenylethyl)-2-piperazinyl}ethanol

  • Molecular FormulaC27H39N3O
  • Average mass421.618 Da
  • Monoisotopic mass421.309326 Da
  • ChemSpider ID22164329

More details:

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

2-{4-[1-(2,3-Dimethylphenyl)-4-piperidinyl]-1-(2-phenylethyl)-2-piperazinyl}ethanol [ACD/IUPAC Name]
2-{4-[1-(2,3-Dimethylphenyl)-4-piperidinyl]-1-(2-phenylethyl)-2-piperazinyl}ethanol [German] [ACD/IUPAC Name]
2-{4-[1-(2,3-Diméthylphényl)-4-pipéridinyl]-1-(2-phényléthyl)-2-pipérazinyl}éthanol [French] [ACD/IUPAC Name]
2-Piperazineethanol, 4-[1-(2,3-dimethylphenyl)-4-piperidinyl]-1-(2-phenylethyl)- [ACD/Index Name]
2-[4-[1-(2,3-dimethylphenyl)-4-piperidinyl]-1-(2-phenylethyl)-2-piperazinyl]ethanol

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

Density: 1.1±0.1 g/cm3
Boiling Point: 582.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 91.7±3.0 kJ/mol
Flash Point: 286.5±28.8 °C
Index of Refraction: 1.576
Molar Refractivity: 129.0±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 3.78
ACD/LogD (pH 5.5): 0.98
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.81
ACD/LogD (pH 7.4): 3.03
ACD/BCF (pH 7.4): 73.80
ACD/KOC (pH 7.4): 431.00
Polar Surface Area: 30 Å2
Polarizability: 51.1±0.5 10-24cm3
Surface Tension: 44.7±3.0 dyne/cm
Molar Volume: 389.8±3.0 cm3

Click to predict properties on the Chemicalize site


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