ChemSpider 2D Image | 3-(2-Fluoro-3-hydroxyphenyl)pentanoic acid | C11H13FO3

3-(2-Fluoro-3-hydroxyphenyl)pentanoic acid

  • Molecular FormulaC11H13FO3
  • Average mass212.217 Da
  • Monoisotopic mass212.084869 Da
  • ChemSpider ID32821467

More details:

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

3-(2-Fluor-3-hydroxyphenyl)pentansäure [German] [ACD/IUPAC Name]
3-(2-Fluoro-3-hydroxyphenyl)pentanoic acid [ACD/IUPAC Name]
Acide 3-(2-fluoro-3-hydroxyphényl)pentanoïque [French] [ACD/IUPAC Name]
Benzenepropanoic acid, β-ethyl-2-fluoro-3-hydroxy- [ACD/Index Name]
1142230-96-3 [RN]
MFCD28014570 [MDL number]

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 342.2±27.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 61.8±3.0 kJ/mol
    Flash Point: 160.8±23.7 °C
    Index of Refraction: 1.538
    Molar Refractivity: 53.1±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 2
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 2.21
    ACD/LogD (pH 5.5): 1.46
    ACD/BCF (pH 5.5): 4.63
    ACD/KOC (pH 5.5): 58.43
    ACD/LogD (pH 7.4): -0.36
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 58 Å2
    Polarizability: 21.1±0.5 10-24cm3
    Surface Tension: 47.5±3.0 dyne/cm
    Molar Volume: 169.8±3.0 cm3

    Click to predict properties on the Chemicalize site


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