ChemSpider 2D Image | 5-Chloro-3-propoxy-1-benzofuran-2-carboxylic acid | C12H11ClO4

5-Chloro-3-propoxy-1-benzofuran-2-carboxylic acid

  • Molecular FormulaC12H11ClO4
  • Average mass254.666 Da
  • Monoisotopic mass254.034592 Da
  • ChemSpider ID35492199

More details:

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

1707581-33-6 [RN]
2-Benzofurancarboxylic acid, 5-chloro-3-propoxy- [ACD/Index Name]
5-Chlor-3-propoxy-1-benzofuran-2-carbonsäure [German] [ACD/IUPAC Name]
5-Chloro-3-propoxy-1-benzofuran-2-carboxylic acid [ACD/IUPAC Name]
Acide 5-chloro-3-propoxy-1-benzofurane-2-carboxylique [French] [ACD/IUPAC Name]
5-Chloro-3-propoxybenzofuran-2-carboxylic acid
5-Chloro-3-propoxy-benzofuran-2-carboxylic acid
MFCD26129400

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 391.5±37.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.9 mmHg at 25°C
    Enthalpy of Vaporization: 67.6±3.0 kJ/mol
    Flash Point: 190.6±26.5 °C
    Index of Refraction: 1.599
    Molar Refractivity: 64.2±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 1
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 3.66
    ACD/LogD (pH 5.5): 0.89
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 5.57
    ACD/LogD (pH 7.4): 0.21
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.15
    Polar Surface Area: 60 Å2
    Polarizability: 25.4±0.5 10-24cm3
    Surface Tension: 49.9±3.0 dyne/cm
    Molar Volume: 187.8±3.0 cm3

    Click to predict properties on the Chemicalize site


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