ChemSpider 2D Image | (E)-tert-Butyl 2-(3-ethoxy-3-oxoprop-1-en-1-yl)-8-azaspiro[4.5]decane-8-carboxylate | C19H31NO4

(E)-tert-Butyl 2-(3-ethoxy-3-oxoprop-1-en-1-yl)-8-azaspiro[4.5]decane-8-carboxylate

  • Molecular FormulaC19H31NO4
  • Average mass337.454 Da
  • Monoisotopic mass337.225311 Da
  • ChemSpider ID44209840

  • Double-bond stereo - Double-bond stereo

More details:

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

(E)-tert-Butyl 2-(3-ethoxy-3-oxoprop-1-en-1-yl)-8-azaspiro[4.5]decane-8-carboxylate
1599479-34-1 [RN]
2-[(1E)-3-Éthoxy-3-oxo-1-propén-1-yl]-8-azaspiro[4.5]décane-8-carboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
2-Methyl-2-propanyl 2-[(1E)-3-ethoxy-3-oxo-1-propen-1-yl]-8-azaspiro[4.5]decane-8-carboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-2-[(1E)-3-ethoxy-3-oxo-1-propen-1-yl]-8-azaspiro[4.5]decan-8-carboxylat [German] [ACD/IUPAC Name]
8-Azaspiro[4.5]decane-8-carboxylic acid, 2-[(1E)-3-ethoxy-3-oxo-1-propen-1-yl]-, 1,1-dimethylethyl ester [ACD/Index Name]
MFCD29041950
tert-butyl (E)-2-(3-ethoxy-3-oxoprop-1-en-1-yl)-8-azaspiro[4.5]decane-8-carboxylate
tert-butyl 2-(3-ethoxy-3-oxoprop-1-en-1-yl)-8-azaspiro[4.5]decane-8-carboxylate

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

    Density: 1.1±0.1 g/cm3
    Boiling Point: 428.6±38.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 68.4±3.0 kJ/mol
    Flash Point: 213.0±26.8 °C
    Index of Refraction: 1.513
    Molar Refractivity: 93.4±0.4 cm3
    #H bond acceptors: 5
    #H bond donors: 0
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 0
    ACD/LogP: 4.09
    ACD/LogD (pH 5.5): 4.39
    ACD/BCF (pH 5.5): 1278.55
    ACD/KOC (pH 5.5): 5826.23
    ACD/LogD (pH 7.4): 4.39
    ACD/BCF (pH 7.4): 1278.55
    ACD/KOC (pH 7.4): 5826.23
    Polar Surface Area: 56 Å2
    Polarizability: 37.0±0.5 10-24cm3
    Surface Tension: 41.2±5.0 dyne/cm
    Molar Volume: 311.0±5.0 cm3

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