ChemSpider 2D Image | 3-Ethyl 3-methyl 1-(2-methyl-2-propanyl) 1,3,3-piperidinetricarboxylate | C15H25NO6

3-Ethyl 3-methyl 1-(2-methyl-2-propanyl) 1,3,3-piperidinetricarboxylate

  • Molecular FormulaC15H25NO6
  • Average mass315.362 Da
  • Monoisotopic mass315.168182 Da
  • ChemSpider ID58804831

More details:

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

1,3,3-Pipéridinetricarboxylate de 3-éthyle et de 3-méthyle et de 1-(2-méthyl-2-propanyle) [French] [ACD/IUPAC Name]
1,3,3-Piperidinetricarboxylic acid, 1-(1,1-dimethylethyl) 3-ethyl 3-methyl ester [ACD/Index Name]
3-Ethyl 3-methyl 1-(2-methyl-2-propanyl) 1,3,3-piperidinetricarboxylate [ACD/IUPAC Name]
3-Ethyl-3-methyl-1-(2-methyl-2-propanyl)-1,3,3-piperidintricarboxylat [German] [ACD/IUPAC Name]
1624302-00-6 [RN]
3-Ethyl 3-Methyl 1-Boc-piperidine-3,3-dicarboxylate
MFCD24474719

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

    Density: 1.1±0.1 g/cm3
    Boiling Point: 362.7±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 60.9±3.0 kJ/mol
    Flash Point: 173.2±27.9 °C
    Index of Refraction: 1.479
    Molar Refractivity: 77.9±0.3 cm3
    #H bond acceptors: 7
    #H bond donors: 0
    #Freely Rotating Bonds: 7
    #Rule of 5 Violations: 0
    ACD/LogP: 2.31
    ACD/LogD (pH 5.5): 2.49
    ACD/BCF (pH 5.5): 45.90
    ACD/KOC (pH 5.5): 538.46
    ACD/LogD (pH 7.4): 2.49
    ACD/BCF (pH 7.4): 45.90
    ACD/KOC (pH 7.4): 538.46
    Polar Surface Area: 82 Å2
    Polarizability: 30.9±0.5 10-24cm3
    Surface Tension: 41.3±3.0 dyne/cm
    Molar Volume: 274.9±3.0 cm3

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