ChemSpider 2D Image | 4-Fluoro-2-hydroxy-N-[(2S)-1-hydroxy-3-methyl-2-butanyl]benzamide | C12H16FNO3

4-Fluoro-2-hydroxy-N-[(2S)-1-hydroxy-3-methyl-2-butanyl]benzamide

  • Molecular FormulaC12H16FNO3
  • Average mass241.259 Da
  • Monoisotopic mass241.111420 Da
  • ChemSpider ID35168517

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

4-Fluor-2-hydroxy-N-[(2S)-1-hydroxy-3-methyl-2-butanyl]benzamid [German] [ACD/IUPAC Name]
4-Fluoro-2-hydroxy-N-[(2S)-1-hydroxy-3-methyl-2-butanyl]benzamide [ACD/IUPAC Name]
4-Fluoro-2-hydroxy-N-[(2S)-1-hydroxy-3-méthyl-2-butanyl]benzamide [French] [ACD/IUPAC Name]
Benzamide, 4-fluoro-2-hydroxy-N-[(1S)-1-(hydroxymethyl)-2-methylpropyl]- [ACD/Index Name]
4-FLUORO-2-HYDROXY-N-[(2S)-1-HYDROXY-3-METHYLBUTAN-2-YL]BENZAMIDE

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

Density: 1.2±0.1 g/cm3
Boiling Point: 407.2±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 69.5±3.0 kJ/mol
Flash Point: 200.1±28.7 °C
Index of Refraction: 1.540
Molar Refractivity: 61.7±0.3 cm3
#H bond acceptors: 4
#H bond donors: 3
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.06
ACD/LogD (pH 5.5): 2.44
ACD/BCF (pH 5.5): 41.87
ACD/KOC (pH 5.5): 501.13
ACD/LogD (pH 7.4): 2.02
ACD/BCF (pH 7.4): 15.90
ACD/KOC (pH 7.4): 190.27
Polar Surface Area: 70 Å2
Polarizability: 24.5±0.5 10-24cm3
Surface Tension: 46.3±3.0 dyne/cm
Molar Volume: 196.7±3.0 cm3

Click to predict properties on the Chemicalize site


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