Found 3 results

Search term: UDRCONFHWYGWFI (Found by InChIKey (skeleton match))
ChemSpider 2D Image | Ethyl 3-oxo(5,5,5-~2~H_3_)pentanoate | C7H9D3O3

Ethyl 3-oxo(5,5,5-2H3)pentanoate

  • Molecular FormulaC7H9D3O3
  • Average mass147.187 Da
  • Monoisotopic mass147.097473 Da
  • ChemSpider ID48061870

  • Non-standard isotope - Non-standard isotope

More details:

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

3-Oxo(5,5,5-2H3)pentanoate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 3-oxo(5,5,5-2H3)pentanoate [ACD/IUPAC Name]
Ethyl-3-oxo(5,5,5-2H3)pentanoat [German] [ACD/IUPAC Name]
Pentanoic-5,5,5-d3 acid, 3-oxo-, ethyl ester [ACD/Index Name]
1346598-17-1 [RN]
ethyl 5,5,5-trideuterio-3-oxopentanoate
Ethyl Propionylacetate-d3

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

    Density: 1.0±0.1 g/cm3
    Boiling Point: 193.0±8.0 °C at 760 mmHg
    Vapour Pressure: 0.5±0.4 mmHg at 25°C
    Enthalpy of Vaporization: 42.9±3.0 kJ/mol
    Flash Point: 77.8±0.0 °C
    Index of Refraction: 1.416
    Molar Refractivity: 36.3±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 0
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 1.25
    ACD/LogD (pH 5.5): 0.77
    ACD/BCF (pH 5.5): 2.28
    ACD/KOC (pH 5.5): 62.72
    ACD/LogD (pH 7.4): 0.77
    ACD/BCF (pH 7.4): 2.28
    ACD/KOC (pH 7.4): 62.68
    Polar Surface Area: 43 Å2
    Polarizability: 14.4±0.5 10-24cm3
    Surface Tension: 30.7±3.0 dyne/cm
    Molar Volume: 144.7±3.0 cm3

    Click to predict properties on the Chemicalize site


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