ChemSpider 2D Image | 5-Ethynyl-2-furoic acid | C7H4O3

5-Ethynyl-2-furoic acid

  • Molecular FormulaC7H4O3
  • Average mass136.105 Da
  • Monoisotopic mass136.016037 Da
  • ChemSpider ID35484945

More details:

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

1356458-63-3 [RN]
2-Furancarboxylic acid, 5-ethynyl- [ACD/Index Name]
5-Ethinyl-2-furoesäure [German] [ACD/IUPAC Name]
5-Ethynyl-2-furoic acid [ACD/IUPAC Name]
5-ethynylfuran-2-carboxylic acid
Acide 5-éthynyl-2-furoïque [French] [ACD/IUPAC Name]
5-Ethynyl-furan-2-carboxylic acid
MFCD22371544
SCHEMBL14634145

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 285.4±25.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.6 mmHg at 25°C
    Enthalpy of Vaporization: 55.4±3.0 kJ/mol
    Flash Point: 126.4±23.2 °C
    Index of Refraction: 1.561
    Molar Refractivity: 32.6±0.4 cm3
    #H bond acceptors: 3
    #H bond donors: 1
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 0.82
    ACD/LogD (pH 5.5): -1.49
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -2.06
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 50 Å2
    Polarizability: 12.9±0.5 10-24cm3
    Surface Tension: 58.9±5.0 dyne/cm
    Molar Volume: 100.6±5.0 cm3

    Click to predict properties on the Chemicalize site


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