ChemSpider 2D Image | MFCD27987024 | C16H27NO4

MFCD27987024

  • Molecular FormulaC16H27NO4
  • Average mass297.390 Da
  • Monoisotopic mass297.194000 Da
  • ChemSpider ID32743241

  • Double-bond stereo - Double-bond stereo

More details:

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

(4E)-4-(2-Éthoxy-2-oxoéthylidène)-3,3-diméthyl-1-pipéridinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
1-Piperidinecarboxylic acid, 4-(2-ethoxy-2-oxoethylidene)-3,3-dimethyl-, 1,1-dimethylethyl ester, (4E)- [ACD/Index Name]
2-Methyl-2-propanyl (4E)-4-(2-ethoxy-2-oxoethylidene)-3,3-dimethyl-1-piperidinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-(4E)-4-(2-ethoxy-2-oxoethyliden)-3,3-dimethyl-1-piperidincarboxylat [German] [ACD/IUPAC Name]
958026-98-7 [RN]
MFCD27987024
tert-butyl (4E)-4-(2-ethoxy-2-oxoethylidene)-3,3-dimethylpiperidine-1-carboxylate
tert-butyl (E)-4-(2-ethoxy-2-oxoethylidene)-3,3-dimethylpiperidine-1-carboxylate
(E)-tert-Butyl 4-(2-ethoxy-2-oxoethylidene)-3,3-dimethylpiperidine-1-carboxylate
1-Boc-4-(2-ethoxy-2-oxoethylidene)-3,3-dimethylpiperidine
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.1±0.1 g/cm3
    Boiling Point: 368.2±35.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 61.5±3.0 kJ/mol
    Flash Point: 176.5±25.9 °C
    Index of Refraction: 1.509
    Molar Refractivity: 82.7±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 0
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 3.75
    ACD/LogD (pH 5.5): 3.54
    ACD/BCF (pH 5.5): 289.21
    ACD/KOC (pH 5.5): 2010.68
    ACD/LogD (pH 7.4): 3.54
    ACD/BCF (pH 7.4): 289.21
    ACD/KOC (pH 7.4): 2010.68
    Polar Surface Area: 56 Å2
    Polarizability: 32.8±0.5 10-24cm3
    Surface Tension: 39.8±3.0 dyne/cm
    Molar Volume: 276.8±3.0 cm3

    Click to predict properties on the Chemicalize site


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