ChemSpider 2D Image | 6-Fluoro-2-(5-isopropyl-2-methyl-4-phenoxyphenyl)-4-quinolinecarboxylic acid | C26H22FNO3

6-Fluoro-2-(5-isopropyl-2-methyl-4-phenoxyphenyl)-4-quinolinecarboxylic acid

  • Molecular FormulaC26H22FNO3
  • Average mass415.456 Da
  • Monoisotopic mass415.158386 Da
  • ChemSpider ID30827865

More details:

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

4-Quinolinecarboxylic acid, 6-fluoro-2-[2-methyl-5-(1-methylethyl)-4-phenoxyphenyl]- [ACD/Index Name]
6-Fluor-2-(5-isopropyl-2-methyl-4-phenoxyphenyl)-4-chinolincarbonsäure [German] [ACD/IUPAC Name]
6-Fluoro-2-(5-isopropyl-2-methyl-4-phenoxyphenyl)-4-quinolinecarboxylic acid [ACD/IUPAC Name]
6-Fluoro-2-[2-Methyl-4-Phenoxy-5-(Propan-2-Yl)phenyl]quinoline-4-Carboxylic Acid
Acide 6-fluoro-2-(5-isopropyl-2-méthyl-4-phénoxyphényl)-4-quinoléinecarboxylique [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 543.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 86.5±3.0 kJ/mol
Flash Point: 282.4±30.1 °C
Index of Refraction: 1.628
Molar Refractivity: 119.2±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 7.56
ACD/LogD (pH 5.5): 3.79
ACD/BCF (pH 5.5): 102.97
ACD/KOC (pH 5.5): 168.47
ACD/LogD (pH 7.4): 3.31
ACD/BCF (pH 7.4): 34.26
ACD/KOC (pH 7.4): 56.05
Polar Surface Area: 59 Å2
Polarizability: 47.2±0.5 10-24cm3
Surface Tension: 49.8±3.0 dyne/cm
Molar Volume: 335.7±3.0 cm3

Click to predict properties on the Chemicalize site


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