ChemSpider 2D Image | Ethyl 4-mesityl-2,4-dioxobutanoate | C15H18O4

Ethyl 4-mesityl-2,4-dioxobutanoate

  • Molecular FormulaC15H18O4
  • Average mass262.301 Da
  • Monoisotopic mass262.120514 Da
  • ChemSpider ID13295998

More details:






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

4-Mésityl-2,4-dioxobutanoate d'éthyle [French] [ACD/IUPAC Name]
Benzenebutanoic acid, 2,4,6-trimethyl-α,γ-dioxo-, ethyl ester [ACD/Index Name]
Ethyl 4-mesityl-2,4-dioxobutanoate [ACD/IUPAC Name]
Ethyl-4-mesityl-2,4-dioxobutanoat [German] [ACD/IUPAC Name]
203870-51-3 [RN]
atoms 19 bonds 19
ethyl 2,4-dioxo-4-(2,4,6-trimethylphenyl)butanoate
MFCD12621845 [MDL number]

    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

    Density: 1.1±0.1 g/cm3
    Boiling Point: 396.8±30.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.9 mmHg at 25°C
    Enthalpy of Vaporization: 64.7±3.0 kJ/mol
    Flash Point: 174.9±24.6 °C
    Index of Refraction: 1.513
    Molar Refractivity: 71.1±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 0
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 0
    ACD/LogP: 2.91
    ACD/LogD (pH 5.5): 3.11
    ACD/BCF (pH 5.5): 133.56
    ACD/KOC (pH 5.5): 1132.07
    ACD/LogD (pH 7.4): 2.29
    ACD/BCF (pH 7.4): 20.29
    ACD/KOC (pH 7.4): 171.99
    Polar Surface Area: 60 Å2
    Polarizability: 28.2±0.5 10-24cm3
    Surface Tension: 39.9±3.0 dyne/cm
    Molar Volume: 236.4±3.0 cm3

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