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Search term: AXRZCYGMDFWOCC (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 5-(1-Benzofuran-2-yl)isoxazole-3-carboxylic acid | C12H7NO4

5-(1-Benzofuran-2-yl)isoxazole-3-carboxylic acid

  • Molecular FormulaC12H7NO4
  • Average mass229.188 Da
  • Monoisotopic mass229.037506 Da
  • ChemSpider ID21786515

More details:

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

3-Isoxazolecarboxylic acid, 5-(2-benzofuranyl)- [ACD/Index Name]
5-(1-Benzofuran-2-yl)-1,2-oxazol-3-carbonsäure [German] [ACD/IUPAC Name]
5-(1-Benzofuran-2-yl)-1,2-oxazole-3-carboxylic acid [ACD/IUPAC Name]
5-(1-Benzofuran-2-yl)isoxazole-3-carboxylic acid
5776-98-7 [RN]
Acide 5-(1-benzofuran-2-yl)-1,2-oxazole-3-carboxylique [French] [ACD/IUPAC Name]
5-benzofuran-2-yl-isoxazole-3-carboxylic acid
AKOS015956282
F2135-0507
L-4074
More...

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 495.3±35.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.3 mmHg at 25°C
    Enthalpy of Vaporization: 80.3±3.0 kJ/mol
    Flash Point: 253.4±25.9 °C
    Index of Refraction: 1.648
    Molar Refractivity: 58.3±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 1
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 3.36
    ACD/LogD (pH 5.5): 0.64
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 5.44
    ACD/LogD (pH 7.4): -0.30
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 76 Å2
    Polarizability: 23.1±0.5 10-24cm3
    Surface Tension: 61.6±3.0 dyne/cm
    Molar Volume: 160.2±3.0 cm3

    Click to predict properties on the Chemicalize site


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