ChemSpider 2D Image | Ethyl bromo(cyclobutyl)acetate | C8H13BrO2

Ethyl bromo(cyclobutyl)acetate

  • Molecular FormulaC8H13BrO2
  • Average mass221.092 Da
  • Monoisotopic mass220.009888 Da
  • ChemSpider ID58837082

More details:

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

21816-22-8 [RN]
Bromo(cyclobutyl)acétate d'éthyle [French] [ACD/IUPAC Name]
Cyclobutaneacetic acid, α-bromo-, ethyl ester [ACD/Index Name]
ETHYL 2-BROMO-2-CYCLOBUTYLACETATE
Ethyl bromo(cyclobutyl)acetate [ACD/IUPAC Name]
Ethyl-brom(cyclobutyl)acetat [German] [ACD/IUPAC Name]
CCOC(=O)C(Br)C1CCC1
ethyl2-bromo-2-cyclobutylacetate
MFCD28501834

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 231.1±13.0 °C at 760 mmHg
    Vapour Pressure: 0.1±0.5 mmHg at 25°C
    Enthalpy of Vaporization: 46.8±3.0 kJ/mol
    Flash Point: 114.7±10.2 °C
    Index of Refraction: 1.506
    Molar Refractivity: 46.5±0.3 cm3
    #H bond acceptors: 2
    #H bond donors: 0
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 2.65
    ACD/LogD (pH 5.5): 2.40
    ACD/BCF (pH 5.5): 39.37
    ACD/KOC (pH 5.5): 482.43
    ACD/LogD (pH 7.4): 2.40
    ACD/BCF (pH 7.4): 39.37
    ACD/KOC (pH 7.4): 482.43
    Polar Surface Area: 26 Å2
    Polarizability: 18.4±0.5 10-24cm3
    Surface Tension: 40.9±3.0 dyne/cm
    Molar Volume: 156.3±3.0 cm3

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