ChemSpider 2D Image | Ethyl 2,4-dioxo-4-(3,4,5-trimethoxyphenyl)butanoate | C15H18O7

Ethyl 2,4-dioxo-4-(3,4,5-trimethoxyphenyl)butanoate

  • Molecular FormulaC15H18O7
  • Average mass310.299 Da
  • Monoisotopic mass310.105255 Da
  • ChemSpider ID24531839

More details:

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

2,4-Dioxo-4-(3,4,5-triméthoxyphényl)butanoate d'éthyle [French] [ACD/IUPAC Name]
Benzenebutanoic acid, 3,4,5-trimethoxy-α,γ-dioxo-, ethyl ester [ACD/Index Name]
Ethyl 2,4-dioxo-4-(3,4,5-trimethoxyphenyl)butanoate [ACD/IUPAC Name]
Ethyl-2,4-dioxo-4-(3,4,5-trimethoxyphenyl)butanoat [German] [ACD/IUPAC Name]
70909-47-6 [RN]
atoms 22 bonds 22
MFCD14707580

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 443.2±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.1 mmHg at 25°C
    Enthalpy of Vaporization: 70.1±3.0 kJ/mol
    Flash Point: 195.9±28.8 °C
    Index of Refraction: 1.502
    Molar Refractivity: 76.7±0.3 cm3
    #H bond acceptors: 7
    #H bond donors: 0
    #Freely Rotating Bonds: 9
    #Rule of 5 Violations: 0
    ACD/LogP: 1.64
    ACD/LogD (pH 5.5): 1.53
    ACD/BCF (pH 5.5): 8.60
    ACD/KOC (pH 5.5): 161.73
    ACD/LogD (pH 7.4): 1.23
    ACD/BCF (pH 7.4): 4.23
    ACD/KOC (pH 7.4): 79.49
    Polar Surface Area: 88 Å2
    Polarizability: 30.4±0.5 10-24cm3
    Surface Tension: 39.6±3.0 dyne/cm
    Molar Volume: 259.6±3.0 cm3

    Click to predict properties on the Chemicalize site


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