ChemSpider 2D Image | 3-Fluoro-4-(1-piperazinyl)benzoic acid | C11H13FN2O2

3-Fluoro-4-(1-piperazinyl)benzoic acid

  • Molecular FormulaC11H13FN2O2
  • Average mass224.232 Da
  • Monoisotopic mass224.096100 Da
  • ChemSpider ID24605563

More details:

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

1197193-04-6 [RN]
3-Fluor-4-(1-piperazinyl)benzoesäure [German] [ACD/IUPAC Name]
3-Fluoro-4-(1-piperazinyl)benzoic acid [ACD/IUPAC Name]
3-fluoro-4-(piperazin-1-yl)benzoic acid
Acide 3-fluoro-4-(1-pipérazinyl)benzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 3-fluoro-4-(1-piperazinyl)- [ACD/Index Name]
(S)-2-Hydroxy-1-(pyrrolidin-1-yl)propan-1-one [ACD/IUPAC Name]
[1197193-04-6] [RN]
3829-80-9 [RN]
3-fluoro-4-piperazin-1-ylbenzoic acid
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.3±0.1 g/cm3
    Boiling Point: 416.2±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 70.6±3.0 kJ/mol
    Flash Point: 205.5±28.7 °C
    Index of Refraction: 1.564
    Molar Refractivity: 56.7±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 2
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 1.37
    ACD/LogD (pH 5.5): -1.10
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -1.08
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 53 Å2
    Polarizability: 22.5±0.5 10-24cm3
    Surface Tension: 47.0±3.0 dyne/cm
    Molar Volume: 174.5±3.0 cm3

    Click to predict properties on the Chemicalize site


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