ChemSpider 2D Image | MFCD11971997 | C17H12FNO2S

MFCD11971997

  • Molecular FormulaC17H12FNO2S
  • Average mass313.346 Da
  • Monoisotopic mass313.057281 Da
  • ChemSpider ID24652782

More details:

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

[4-(4-Fluorophenyl)-2-phenyl-1,3-thiazol-5-yl]acetic acid [ACD/IUPAC Name]
[4-(4-Fluorphenyl)-2-phenyl-1,3-thiazol-5-yl]essigsäure [German] [ACD/IUPAC Name]
5-Thiazoleacetic acid, 4-(4-fluorophenyl)-2-phenyl- [ACD/Index Name]
Acide [4-(4-fluorophényl)-2-phényl-1,3-thiazol-5-yl]acétique [French] [ACD/IUPAC Name]
MFCD11971997
[4-(4-Fluoro-phenyl)-2-phenyl-thiazol-5-yl]-acetic acid
2-(4-(4-fluorophenyl)-2-phenylthiazol-5-yl)acetic acid
2-[4-(4-fluorophenyl)-2-phenyl-1,3-thiazol-5-yl]acetic acid
53514-93-5 [RN]
AGN-PC-0NTI0D
More...

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 532.4±60.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.5 mmHg at 25°C
    Enthalpy of Vaporization: 85.1±3.0 kJ/mol
    Flash Point: 275.8±32.9 °C
    Index of Refraction: 1.627
    Molar Refractivity: 83.0±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 1
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 4.22
    ACD/LogD (pH 5.5): 2.45
    ACD/BCF (pH 5.5): 18.00
    ACD/KOC (pH 5.5): 98.33
    ACD/LogD (pH 7.4): 0.74
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.92
    Polar Surface Area: 78 Å2
    Polarizability: 32.9±0.5 10-24cm3
    Surface Tension: 54.5±3.0 dyne/cm
    Molar Volume: 234.4±3.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement