ChemSpider 2D Image | 2-{4-[({2-Methyl-3-[4-(2-methyl-2-propanyl)phenyl]propyl}amino)methyl]-1-piperidinyl}ethanol | C22H38N2O

2-{4-[({2-Methyl-3-[4-(2-methyl-2-propanyl)phenyl]propyl}amino)methyl]-1-piperidinyl}ethanol

  • Molecular FormulaC22H38N2O
  • Average mass346.550 Da
  • Monoisotopic mass346.298401 Da
  • ChemSpider ID30393450

More details:






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

1-Piperidineethanol, 4-[[[3-[4-(1,1-dimethylethyl)phenyl]-2-methylpropyl]amino]methyl]- [ACD/Index Name]
2-{4-[({2-Methyl-3-[4-(2-methyl-2-propanyl)phenyl]propyl}amino)methyl]-1-piperidinyl}ethanol [German] [ACD/IUPAC Name]
2-{4-[({2-Methyl-3-[4-(2-methyl-2-propanyl)phenyl]propyl}amino)methyl]-1-piperidinyl}ethanol [ACD/IUPAC Name]
2-{4-[({2-Méthyl-3-[4-(2-méthyl-2-propanyl)phényl]propyl}amino)méthyl]-1-pipéridinyl}éthanol [French] [ACD/IUPAC Name]
2-[4-({[3-(4-TERT-BUTYLPHENYL)-2-METHYLPROPYL]AMINO}METHYL)PIPERIDIN-1-YL]ETHAN-1-OL
2-[4-({[3-(4-TERT-BUTYLPHENYL)-2-METHYLPROPYL]AMINO}METHYL)PIPERIDIN-1-YL]ETHANOL

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.0±0.1 g/cm3
Boiling Point: 473.2±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 77.6±3.0 kJ/mol
Flash Point: 240.0±24.6 °C
Index of Refraction: 1.513
Molar Refractivity: 107.1±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 4.27
ACD/LogD (pH 5.5): 0.24
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.82
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.68
Polar Surface Area: 36 Å2
Polarizability: 42.5±0.5 10-24cm3
Surface Tension: 36.8±3.0 dyne/cm
Molar Volume: 356.3±3.0 cm3

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