ChemSpider 2D Image | tert-Butyl 2-(azetidin-1-yl)acetate | C9H17NO2

tert-Butyl 2-(azetidin-1-yl)acetate

  • Molecular FormulaC9H17NO2
  • Average mass171.237 Da
  • Monoisotopic mass171.125931 Da
  • ChemSpider ID57325173

More details:

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

1055268-73-9 [RN]
1-Azetidineacetic acid, 1,1-dimethylethyl ester [ACD/Index Name]
1-Azétidinylacétate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
2-Methyl-2-propanyl 1-azetidinylacetate [ACD/IUPAC Name]
2-Methyl-2-propanyl-1-azetidinylacetat [German] [ACD/IUPAC Name]
tert-Butyl 2-(azetidin-1-yl)acetate
MFCD28359544

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

    Density: 1.0±0.1 g/cm3
    Boiling Point: 209.8±23.0 °C at 760 mmHg
    Vapour Pressure: 0.2±0.4 mmHg at 25°C
    Enthalpy of Vaporization: 44.6±3.0 kJ/mol
    Flash Point: 81.4±11.9 °C
    Index of Refraction: 1.468
    Molar Refractivity: 47.0±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 0
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 1.52
    ACD/LogD (pH 5.5): 0.41
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 11.45
    ACD/LogD (pH 7.4): 1.52
    ACD/BCF (pH 7.4): 8.07
    ACD/KOC (pH 7.4): 147.93
    Polar Surface Area: 30 Å2
    Polarizability: 18.6±0.5 10-24cm3
    Surface Tension: 34.2±3.0 dyne/cm
    Molar Volume: 169.2±3.0 cm3

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