ChemSpider 2D Image | Ethyl 5-(4-hydroxy-7-methoxy-2-oxo-2H-chromen-3-yl)-2-furoate | C17H14O7

Ethyl 5-(4-hydroxy-7-methoxy-2-oxo-2H-chromen-3-yl)-2-furoate

  • Molecular FormulaC17H14O7
  • Average mass330.289 Da
  • Monoisotopic mass330.073944 Da
  • ChemSpider ID21531702

More details:

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

2-Furancarboxylic acid, 5-(4-hydroxy-7-methoxy-2-oxo-2H-1-benzopyran-3-yl)-, ethyl ester [ACD/Index Name]
5-(4-Hydroxy-7-méthoxy-2-oxo-2H-chromén-3-yl)-2-furoate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 5-(4-hydroxy-7-methoxy-2-oxo-2H-chromen-3-yl)-2-furoate [ACD/IUPAC Name]
Ethyl-5-(4-hydroxy-7-methoxy-2-oxo-2H-chromen-3-yl)-2-furoat [German] [ACD/IUPAC Name]
3-[5-[ethoxy(hydroxy)methylidene]furan-2-ylidene]-7-methoxychromene-2,4-dione
55367-40-3 [RN]
AC1OA43Y
AGN-PC-0AAOVT
ethyl 5-(4-hydroxy-7-methoxy-2-oxo-2H-chromen-3-yl)furan-2-carboxylate
ethyl 5-(4-hydroxy-7-methoxy-2-oxochromen-3-yl)furan-2-carboxylate
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.4±0.1 g/cm3
    Boiling Point: 554.5±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.6 mmHg at 25°C
    Enthalpy of Vaporization: 87.9±3.0 kJ/mol
    Flash Point: 289.1±30.1 °C
    Index of Refraction: 1.606
    Molar Refractivity: 81.2±0.3 cm3
    #H bond acceptors: 7
    #H bond donors: 1
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 3.11
    ACD/LogD (pH 5.5): 1.86
    ACD/BCF (pH 5.5): 8.63
    ACD/KOC (pH 5.5): 82.39
    ACD/LogD (pH 7.4): 0.10
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.42
    Polar Surface Area: 95 Å2
    Polarizability: 32.2±0.5 10-24cm3
    Surface Tension: 57.0±3.0 dyne/cm
    Molar Volume: 235.4±3.0 cm3

    Click to predict properties on the Chemicalize site


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