ChemSpider 2D Image | 3-(Benzyloxy)-5-chloro-1-benzofuran-2-carboxylic acid | C16H11ClO4

3-(Benzyloxy)-5-chloro-1-benzofuran-2-carboxylic acid

  • Molecular FormulaC16H11ClO4
  • Average mass302.709 Da
  • Monoisotopic mass302.034576 Da
  • ChemSpider ID35492208

More details:

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

1707568-69-1 [RN]
2-Benzofurancarboxylic acid, 5-chloro-3-(phenylmethoxy)- [ACD/Index Name]
3-(Benzyloxy)-5-chlor-1-benzofuran-2-carbonsäure [German] [ACD/IUPAC Name]
3-(Benzyloxy)-5-chloro-1-benzofuran-2-carboxylic acid [ACD/IUPAC Name]
Acide 3-(benzyloxy)-5-chloro-1-benzofurane-2-carboxylique [French] [ACD/IUPAC Name]
3-(Benzyloxy)-5-chlorobenzofuran-2-carboxylic acid
3-Benzyloxy-5-chloro-benzofuran-2-carboxylic acid
5-chloro-3-phenylmethoxy-1-benzofuran-2-carboxylic acid
MFCD26129409

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 473.6±40.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.2 mmHg at 25°C
    Enthalpy of Vaporization: 77.6±3.0 kJ/mol
    Flash Point: 240.2±27.3 °C
    Index of Refraction: 1.658
    Molar Refractivity: 79.4±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 1
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 4.26
    ACD/LogD (pH 5.5): 2.67
    ACD/BCF (pH 5.5): 16.34
    ACD/KOC (pH 5.5): 51.50
    ACD/LogD (pH 7.4): 2.00
    ACD/BCF (pH 7.4): 3.48
    ACD/KOC (pH 7.4): 10.96
    Polar Surface Area: 60 Å2
    Polarizability: 31.5±0.5 10-24cm3
    Surface Tension: 56.9±3.0 dyne/cm
    Molar Volume: 215.5±3.0 cm3

    Click to predict properties on the Chemicalize site


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