ChemSpider 2D Image | Methyl 1-[2-hydroxy-3-(4-{[(1-methyl-4-piperidinyl)amino]methyl}phenoxy)propyl]-4-piperidinecarboxylate | C23H37N3O4

Methyl 1-[2-hydroxy-3-(4-{[(1-methyl-4-piperidinyl)amino]methyl}phenoxy)propyl]-4-piperidinecarboxylate

  • Molecular FormulaC23H37N3O4
  • Average mass419.558 Da
  • Monoisotopic mass419.278412 Da
  • ChemSpider ID22145394

More details:

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

1-[2-Hydroxy-3-(4-{[(1-méthyl-4-pipéridinyl)amino]méthyl}phénoxy)propyl]-4-pipéridinecarboxylate de méthyle [French] [ACD/IUPAC Name]
4-Piperidinecarboxylic acid, 1-[2-hydroxy-3-[4-[[(1-methyl-4-piperidinyl)amino]methyl]phenoxy]propyl]-, methyl ester [ACD/Index Name]
Methyl 1-[2-hydroxy-3-(4-{[(1-methyl-4-piperidinyl)amino]methyl}phenoxy)propyl]-4-piperidinecarboxylate [ACD/IUPAC Name]
Methyl-1-[2-hydroxy-3-(4-{[(1-methyl-4-piperidinyl)amino]methyl}phenoxy)propyl]-4-piperidincarboxylat [German] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 565.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 89.4±3.0 kJ/mol
Flash Point: 296.0±30.1 °C
Index of Refraction: 1.572
Molar Refractivity: 117.9±0.4 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 2.26
ACD/LogD (pH 5.5): -2.38
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.50
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 74 Å2
Polarizability: 46.7±0.5 10-24cm3
Surface Tension: 51.9±5.0 dyne/cm
Molar Volume: 358.3±5.0 cm3

Click to predict properties on the Chemicalize site


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