ChemSpider 2D Image | Ethyl [(4S)-1-benzyl-2-oxo-4-piperidinyl]acetate | C16H21NO3

Ethyl [(4S)-1-benzyl-2-oxo-4-piperidinyl]acetate

  • Molecular FormulaC16H21NO3
  • Average mass275.343 Da
  • Monoisotopic mass275.152130 Da
  • ChemSpider ID113056516

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

[(4S)-1-Benzyl-2-oxo-4-pipéridinyl]acétate d'éthyle [French] [ACD/IUPAC Name]
4-Piperidineacetic acid, 2-oxo-1-(phenylmethyl)-, ethyl ester, (4S)- [ACD/Index Name]
Ethyl [(4S)-1-benzyl-2-oxo-4-piperidinyl]acetate [ACD/IUPAC Name]
Ethyl-[(4S)-1-benzyl-2-oxo-4-piperidinyl]acetat [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: 431.8±28.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 68.7±3.0 kJ/mol
Flash Point: 215.0±24.0 °C
Index of Refraction: 1.532
Molar Refractivity: 76.3±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.19
ACD/LogD (pH 5.5): 2.43
ACD/BCF (pH 5.5): 41.35
ACD/KOC (pH 5.5): 499.63
ACD/LogD (pH 7.4): 2.43
ACD/BCF (pH 7.4): 41.35
ACD/KOC (pH 7.4): 499.63
Polar Surface Area: 47 Å2
Polarizability: 30.2±0.5 10-24cm3
Surface Tension: 42.7±3.0 dyne/cm
Molar Volume: 246.4±3.0 cm3

Click to predict properties on the Chemicalize site


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