ChemSpider 2D Image | Ethyl (3R)-1-(2-ethylhexanoyl)-3-piperidinecarboxylate | C16H29NO3

Ethyl (3R)-1-(2-ethylhexanoyl)-3-piperidinecarboxylate

  • Molecular FormulaC16H29NO3
  • Average mass283.406 Da
  • Monoisotopic mass283.214752 Da
  • ChemSpider ID41053166

  • defined stereocentres - 1 of 2 defined stereocentres

More details:

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

(3R)-1-(2-Éthylhexanoyl)-3-pipéridinecarboxylate d'éthyle [French] [ACD/IUPAC Name]
3-Piperidinecarboxylic acid, 1-(2-ethyl-1-oxohexyl)-, ethyl ester, (3R)- [ACD/Index Name]
Ethyl (3R)-1-(2-ethylhexanoyl)-3-piperidinecarboxylate [ACD/IUPAC Name]
Ethyl-(3R)-1-(2-ethylhexanoyl)-3-piperidincarboxylat [German] [ACD/IUPAC Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 395.6±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 64.6±3.0 kJ/mol
Flash Point: 193.1±25.9 °C
Index of Refraction: 1.473
Molar Refractivity: 79.2±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 3.76
ACD/LogD (pH 5.5): 3.83
ACD/BCF (pH 5.5): 481.06
ACD/KOC (pH 5.5): 2894.14
ACD/LogD (pH 7.4): 3.83
ACD/BCF (pH 7.4): 481.06
ACD/KOC (pH 7.4): 2894.14
Polar Surface Area: 47 Å2
Polarizability: 31.4±0.5 10-24cm3
Surface Tension: 36.6±3.0 dyne/cm
Molar Volume: 282.3±3.0 cm3

Click to predict properties on the Chemicalize site


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