ChemSpider 2D Image | Ethyl (2S)-4-methyl-2-piperidinecarboxylate | C9H17NO2

Ethyl (2S)-4-methyl-2-piperidinecarboxylate

  • Molecular FormulaC9H17NO2
  • Average mass171.237 Da
  • Monoisotopic mass171.125931 Da
  • ChemSpider ID113060419

  • defined stereocentres - 1 of 2 defined stereocentres

More details:

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

(2S)-4-Méthyl-2-pipéridinecarboxylate d'éthyle [French] [ACD/IUPAC Name]
2-Piperidinecarboxylic acid, 4-methyl-, ethyl ester, (2S)- [ACD/Index Name]
Ethyl (2S)-4-methyl-2-piperidinecarboxylate [ACD/IUPAC Name]
Ethyl-(2S)-4-methyl-2-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: 226.1±33.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.4 mmHg at 25°C
Enthalpy of Vaporization: 46.3±3.0 kJ/mol
Flash Point: 90.5±25.4 °C
Index of Refraction: 1.442
Molar Refractivity: 46.7±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.48
ACD/LogD (pH 5.5): 0.23
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 9.27
ACD/LogD (pH 7.4): 1.34
ACD/BCF (pH 7.4): 5.93
ACD/KOC (pH 7.4): 118.81
Polar Surface Area: 38 Å2
Polarizability: 18.5±0.5 10-24cm3
Surface Tension: 29.2±3.0 dyne/cm
Molar Volume: 176.6±3.0 cm3

Click to predict properties on the Chemicalize site


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