ChemSpider 2D Image | 1-Benzofuran-6-carboxylic acid | C9H6O3

1-Benzofuran-6-carboxylic acid

  • Molecular FormulaC9H6O3
  • Average mass162.142 Da
  • Monoisotopic mass162.031693 Da
  • ChemSpider ID11415808

More details:

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

1-Benzofuran-6-carbonsäure [German] [ACD/IUPAC Name]
1-Benzofuran-6-carboxylic acid [ACD/IUPAC Name]
6-Benzofurancarboxylic acid [ACD/Index Name]
77095-51-3 [RN]
Acide 1-benzofurane-6-carboxylique [French] [ACD/IUPAC Name]
[77095-51-3] [RN]
2,3-dihydrobenzofuran-6-carboxylic acid
6-Benzofurancarboxylicacid
AGN-PC-01MNX5
benzo[b]furan-6-carboxylic acid
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CCRIS 4693 [DBID]

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 325.6±15.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 59.9±3.0 kJ/mol
    Flash Point: 150.7±20.4 °C
    Index of Refraction: 1.649
    Molar Refractivity: 43.3±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 1
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 2.35
    ACD/LogD (pH 5.5): 0.88
    ACD/BCF (pH 5.5): 1.22
    ACD/KOC (pH 5.5): 15.24
    ACD/LogD (pH 7.4): -0.58
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 50 Å2
    Polarizability: 17.2±0.5 10-24cm3
    Surface Tension: 57.4±3.0 dyne/cm
    Molar Volume: 118.9±3.0 cm3

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