ChemSpider 2D Image | Ethyl 4-benzyl-1-(3,5-difluorobenzyl)-4-piperidinecarboxylate | C22H25F2NO2

Ethyl 4-benzyl-1-(3,5-difluorobenzyl)-4-piperidinecarboxylate

  • Molecular FormulaC22H25F2NO2
  • Average mass373.436 Da
  • Monoisotopic mass373.185333 Da
  • ChemSpider ID22208401

More details:

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

4-Benzyl-1-(3,5-difluorobenzyl)-4-pipéridinecarboxylate d'éthyle [French] [ACD/IUPAC Name]
4-Piperidinecarboxylic acid, 1-[(3,5-difluorophenyl)methyl]-4-(phenylmethyl)-, ethyl ester [ACD/Index Name]
Ethyl 4-benzyl-1-(3,5-difluorobenzyl)-4-piperidinecarboxylate [ACD/IUPAC Name]
Ethyl-4-benzyl-1-(3,5-difluorbenzyl)-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: 429.3±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 68.5±3.0 kJ/mol
Flash Point: 213.4±28.7 °C
Index of Refraction: 1.550
Molar Refractivity: 100.4±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.88
ACD/LogD (pH 5.5): 3.16
ACD/BCF (pH 5.5): 62.17
ACD/KOC (pH 5.5): 238.31
ACD/LogD (pH 7.4): 4.57
ACD/BCF (pH 7.4): 1590.54
ACD/KOC (pH 7.4): 6097.24
Polar Surface Area: 30 Å2
Polarizability: 39.8±0.5 10-24cm3
Surface Tension: 44.0±3.0 dyne/cm
Molar Volume: 315.1±3.0 cm3

Click to predict properties on the Chemicalize site


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