ChemSpider 2D Image | Ethyl 4-[4-(4-chlorophenoxy)phenyl]-2,4-dioxobutanoate | C18H15ClO5

Ethyl 4-[4-(4-chlorophenoxy)phenyl]-2,4-dioxobutanoate

  • Molecular FormulaC18H15ClO5
  • Average mass346.762 Da
  • Monoisotopic mass346.060791 Da
  • ChemSpider ID21494311

More details:

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

4-[4-(4-Chlorophénoxy)phényl]-2,4-dioxobutanoate d'éthyle [French] [ACD/IUPAC Name]
Benzenebutanoic acid, 4-(4-chlorophenoxy)-α,γ-dioxo-, ethyl ester [ACD/Index Name]
Ethyl 4-[4-(4-chlorophenoxy)phenyl]-2,4-dioxobutanoate [ACD/IUPAC Name]
Ethyl-4-[4-(4-chlorphenoxy)phenyl]-2,4-dioxobutanoat [German] [ACD/IUPAC Name]
[74649-80-2] [RN]
4-[4-(4-chloro-phenoxy)-phenyl]-2,4-dioxo-butyric acid ethyl ester
74649-80-2 [RN]
74649-80-2?
Ethyl 4-(4-(4-chlorophenoxy)phenyl)-2,4-dioxobutanoate
MFCD08277644 [MDL number]

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 491.3±35.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.2 mmHg at 25°C
    Enthalpy of Vaporization: 75.8±3.0 kJ/mol
    Flash Point: 187.2±24.9 °C
    Index of Refraction: 1.565
    Molar Refractivity: 88.0±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 0
    #Freely Rotating Bonds: 8
    #Rule of 5 Violations: 0
    ACD/LogP: 4.37
    ACD/LogD (pH 5.5): 4.11
    ACD/BCF (pH 5.5): 742.32
    ACD/KOC (pH 5.5): 3742.00
    ACD/LogD (pH 7.4): 2.97
    ACD/BCF (pH 7.4): 53.77
    ACD/KOC (pH 7.4): 271.08
    Polar Surface Area: 70 Å2
    Polarizability: 34.9±0.5 10-24cm3
    Surface Tension: 47.3±3.0 dyne/cm
    Molar Volume: 270.1±3.0 cm3

    Click to predict properties on the Chemicalize site


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