ChemSpider 2D Image | Ethyl 1-{3-[2-hydroxy-3-(4-methyl-1-piperazinyl)propoxy]-4-methoxybenzyl}-4-piperidinecarboxylate | C24H39N3O5

Ethyl 1-{3-[2-hydroxy-3-(4-methyl-1-piperazinyl)propoxy]-4-methoxybenzyl}-4-piperidinecarboxylate

  • Molecular FormulaC24H39N3O5
  • Average mass449.584 Da
  • Monoisotopic mass449.288971 Da
  • ChemSpider ID22123901

More details:

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

1-{3-[2-Hydroxy-3-(4-méthyl-1-pipérazinyl)propoxy]-4-méthoxybenzyl}-4-pipéridinecarboxylate d'éthyle [French] [ACD/IUPAC Name]
4-Piperidinecarboxylic acid, 1-[[3-[2-hydroxy-3-(4-methyl-1-piperazinyl)propoxy]-4-methoxyphenyl]methyl]-, ethyl ester [ACD/Index Name]
Ethyl 1-{3-[2-hydroxy-3-(4-methyl-1-piperazinyl)propoxy]-4-methoxybenzyl}-4-piperidinecarboxylate [ACD/IUPAC Name]
Ethyl-1-{3-[2-hydroxy-3-(4-methyl-1-piperazinyl)propoxy]-4-methoxybenzyl}-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: 579.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 91.2±3.0 kJ/mol
Flash Point: 304.3±30.1 °C
Index of Refraction: 1.542
Molar Refractivity: 123.8±0.3 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 0
ACD/LogP: 1.32
ACD/LogD (pH 5.5): -2.57
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.33
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 12.45
Polar Surface Area: 75 Å2
Polarizability: 49.1±0.5 10-24cm3
Surface Tension: 45.3±3.0 dyne/cm
Molar Volume: 393.4±3.0 cm3

Click to predict properties on the Chemicalize site


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