ChemSpider 2D Image | Ethyl 3-cyano-3-(4-hydroxy-1-piperidinyl)-1-pyrrolidinecarboxylate | C13H21N3O3

Ethyl 3-cyano-3-(4-hydroxy-1-piperidinyl)-1-pyrrolidinecarboxylate

  • Molecular FormulaC13H21N3O3
  • Average mass267.324 Da
  • Monoisotopic mass267.158295 Da
  • ChemSpider ID29280992

More details:

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

1131451-62-1 [RN]
1-Pyrrolidinecarboxylic acid, 3-cyano-3-(4-hydroxy-1-piperidinyl)-, ethyl ester [ACD/Index Name]
3-Cyano-3-(4-hydroxy-1-pipéridinyl)-1-pyrrolidinecarboxylate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 3-cyano-3-(4-hydroxy-1-piperidinyl)-1-pyrrolidinecarboxylate [ACD/IUPAC Name]
ethyl 3-cyano-3-(4-hydroxypiperidin-1-yl)pyrrolidine-1-carboxylate
Ethyl-3-cyan-3-(4-hydroxy-1-piperidinyl)-1-pyrrolidincarboxylat [German] [ACD/IUPAC Name]
ethyl-3-cyano-3-(4-hydroxypiperidin-1-yl)pyrrolidine-1-carboxylate
MFCD13659308

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 454.9±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.5 mmHg at 25°C
    Enthalpy of Vaporization: 82.4±6.0 kJ/mol
    Flash Point: 228.9±28.7 °C
    Index of Refraction: 1.560
    Molar Refractivity: 69.2±0.4 cm3
    #H bond acceptors: 6
    #H bond donors: 1
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: -0.85
    ACD/LogD (pH 5.5): -0.26
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 17.01
    ACD/LogD (pH 7.4): -0.25
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 17.39
    Polar Surface Area: 77 Å2
    Polarizability: 27.4±0.5 10-24cm3
    Surface Tension: 57.7±5.0 dyne/cm
    Molar Volume: 214.2±5.0 cm3

    Click to predict properties on the Chemicalize site


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