ChemSpider 2D Image | tert-Butyl 3-(2-ethoxy-2-oxoethylidene)azetidine-1-carboxylate | C12H19NO4

tert-Butyl 3-(2-ethoxy-2-oxoethylidene)azetidine-1-carboxylate

  • Molecular FormulaC12H19NO4
  • Average mass241.284 Da
  • Monoisotopic mass241.131409 Da
  • ChemSpider ID26233881

More details:

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

1002355-96-5 [RN]
1-Azetidinecarboxylic acid, 3-(2-ethoxy-2-oxoethylidene)-, 1,1-dimethylethyl ester [ACD/Index Name]
2-Methyl-2-propanyl 3-(2-ethoxy-2-oxoethylidene)-1-azetidinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-3-(2-ethoxy-2-oxoethyliden)-1-azetidincarboxylat [German] [ACD/IUPAC Name]
3-(2-Éthoxy-2-oxoéthylidène)-1-azétidinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
MFCD16140210 [MDL number]
tert-Butyl 3-(2-ethoxy-2-oxoethylidene)azetidine-1-carboxylate
[1002355-96-5] [RN]
1-Boc-3-ethoxycarbonylmethylene-azetidine
GF-0212
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.2±0.1 g/cm3
    Boiling Point: 319.5±35.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 56.1±3.0 kJ/mol
    Flash Point: 147.0±25.9 °C
    Index of Refraction: 1.545
    Molar Refractivity: 64.1±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 0
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 1.94
    ACD/LogD (pH 5.5): 2.09
    ACD/BCF (pH 5.5): 22.63
    ACD/KOC (pH 5.5): 324.51
    ACD/LogD (pH 7.4): 2.09
    ACD/BCF (pH 7.4): 22.63
    ACD/KOC (pH 7.4): 324.51
    Polar Surface Area: 56 Å2
    Polarizability: 25.4±0.5 10-24cm3
    Surface Tension: 49.6±3.0 dyne/cm
    Molar Volume: 202.9±3.0 cm3

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