ChemSpider 2D Image | Methyl 1-[2-hydroxy-3-(3-{[(2-methoxyethyl)(methyl)amino]methyl}phenoxy)propyl]-4-piperidinecarboxylate | C21H34N2O5

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

  • Molecular FormulaC21H34N2O5
  • Average mass394.505 Da
  • Monoisotopic mass394.246765 Da
  • ChemSpider ID22155393

More details:

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

1-[2-Hydroxy-3-(3-{[(2-méthoxyéthyl)(méthyl)amino]méthyl}phénoxy)propyl]-4-pipéridinecarboxylate de méthyle [French] [ACD/IUPAC Name]
4-Piperidinecarboxylic acid, 1-[2-hydroxy-3-[3-[[(2-methoxyethyl)methylamino]methyl]phenoxy]propyl]-, methyl ester [ACD/Index Name]
Methyl 1-[2-hydroxy-3-(3-{[(2-methoxyethyl)(methyl)amino]methyl}phenoxy)propyl]-4-piperidinecarboxylate [ACD/IUPAC Name]
Methyl-1-[2-hydroxy-3-(3-{[(2-methoxyethyl)(methyl)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: 1.1±0.1 g/cm3
Boiling Point: 517.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 83.2±3.0 kJ/mol
Flash Point: 267.0±30.1 °C
Index of Refraction: 1.528
Molar Refractivity: 108.2±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 0
ACD/LogP: 1.31
ACD/LogD (pH 5.5): -2.25
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.57
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 14.47
Polar Surface Area: 71 Å2
Polarizability: 42.9±0.5 10-24cm3
Surface Tension: 44.0±3.0 dyne/cm
Molar Volume: 351.4±3.0 cm3

Click to predict properties on the Chemicalize site


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