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Search term: TVEAXARFLUXLEB-UHFFFAOYSA-N (Found by InChIKey (full match))

ChemSpider 2D Image | 5-(3-{3-[4-(4-Fluoro-3-methylphenoxy)-2-propylphenoxy]propoxy}phenyl)-1,3-thiazolidine-2,4-dione | C28H28FNO5S

5-(3-{3-[4-(4-Fluoro-3-methylphenoxy)-2-propylphenoxy]propoxy}phenyl)-1,3-thiazolidine-2,4-dione

  • Molecular FormulaC28H28FNO5S
  • Average mass509.589 Da
  • Monoisotopic mass509.167206 Da
  • ChemSpider ID23183102

More details:






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

2,4-Thiazolidinedione, 5-[3-[3-[4-(4-fluoro-3-methylphenoxy)-2-propylphenoxy]propoxy]phenyl]- [ACD/Index Name]
5-(3-{3-[4-(4-Fluor-3-methylphenoxy)-2-propylphenoxy]propoxy}phenyl)-1,3-thiazolidin-2,4-dion [German] [ACD/IUPAC Name]
5-(3-{3-[4-(4-Fluoro-3-methylphenoxy)-2-propylphenoxy]propoxy}phenyl)-1,3-thiazolidine-2,4-dione [ACD/IUPAC Name]
5-(3-{3-[4-(4-Fluoro-3-méthylphénoxy)-2-propylphénoxy]propoxy}phényl)-1,3-thiazolidine-2,4-dione [French] [ACD/IUPAC Name]
5-(3-{3-[4-(4-Fluoro-3-methyl-phenoxy)-2-propyl-phenoxy]-propoxy}-phenyl)-thiazolidine-2,4-dione

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

Density: 1.3±0.1 g/cm3
Boiling Point: 655.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 96.5±3.0 kJ/mol
Flash Point: 350.1±31.5 °C
Index of Refraction: 1.591
Molar Refractivity: 137.7±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 7.05
ACD/LogD (pH 5.5): 5.70
ACD/BCF (pH 5.5): 11734.15
ACD/KOC (pH 5.5): 26239.80
ACD/LogD (pH 7.4): 4.48
ACD/BCF (pH 7.4): 712.53
ACD/KOC (pH 7.4): 1593.34
Polar Surface Area: 99 Å2
Polarizability: 54.6±0.5 10-24cm3
Surface Tension: 48.2±3.0 dyne/cm
Molar Volume: 407.2±3.0 cm3

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