ChemSpider 2D Image | 5-(4-Fluorophenyl)-2-(1H-pyrrol-1-yl)-1,3-thiazole-4-carboxylic acid | C14H9FN2O2S

5-(4-Fluorophenyl)-2-(1H-pyrrol-1-yl)-1,3-thiazole-4-carboxylic acid

  • Molecular FormulaC14H9FN2O2S
  • Average mass288.297 Da
  • Monoisotopic mass288.036865 Da
  • ChemSpider ID34079826

More details:

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

1623079-32-2 [RN]
4-Thiazolecarboxylic acid, 5-(4-fluorophenyl)-2-(1H-pyrrol-1-yl)- [ACD/Index Name]
5-(4-Fluorophenyl)-2-(1H-pyrrol-1-yl)-1,3-thiazole-4-carboxylic acid [ACD/IUPAC Name]
5-(4-Fluorphenyl)-2-(1H-pyrrol-1-yl)-1,3-thiazol-4-carbonsäure [German] [ACD/IUPAC Name]
Acide 5-(4-fluorophényl)-2-(1H-pyrrol-1-yl)-1,3-thiazole-4-carboxylique [French] [ACD/IUPAC Name]
5-(4-Fluorophenyl)-2-(1H-pyrrol-1-yl)thiazole-4-carboxylic acid
5-(4-fluorophenyl)-2-pyrrol-1-yl-1,3-thiazole-4-carboxylic acid
5-(4-Fluoro-phenyl)-2-pyrrol-1-yl-thiazole-4-carboxylic acid
AKOS021982964
MFCD28248873
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.4±0.1 g/cm3
    Boiling Point: 488.7±53.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.3 mmHg at 25°C
    Enthalpy of Vaporization: 79.5±3.0 kJ/mol
    Flash Point: 249.3±30.9 °C
    Index of Refraction: 1.683
    Molar Refractivity: 75.8±0.5 cm3
    #H bond acceptors: 4
    #H bond donors: 1
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 3.19
    ACD/LogD (pH 5.5): 0.68
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 3.59
    ACD/LogD (pH 7.4): 0.17
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.09
    Polar Surface Area: 83 Å2
    Polarizability: 30.1±0.5 10-24cm3
    Surface Tension: 55.4±7.0 dyne/cm
    Molar Volume: 200.0±7.0 cm3

    Click to predict properties on the Chemicalize site


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