ChemSpider 2D Image | 2-[(1S)-2-(4-Fluorophenyl)-2-oxo-1-phenylethyl]-4-methyl-3-oxo-N-phenylpentanamide | C26H24FNO3

2-[(1S)-2-(4-Fluorophenyl)-2-oxo-1-phenylethyl]-4-methyl-3-oxo-N-phenylpentanamide

  • Molecular FormulaC26H24FNO3
  • Average mass417.472 Da
  • Monoisotopic mass417.174011 Da
  • ChemSpider ID75564197

  • defined stereocentres - 1 of 2 defined stereocentres

More details:

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

2-[(1S)-2-(4-Fluorophenyl)-2-oxo-1-phenylethyl]-4-methyl-3-oxo-N-phenylpentanamide [ACD/IUPAC Name]
2-[(1S)-2-(4-Fluorophényl)-2-oxo-1-phényléthyl]-4-méthyl-3-oxo-N-phénylpentanamide [French] [ACD/IUPAC Name]
2-[(1S)-2-(4-Fluorphenyl)-2-oxo-1-phenylethyl]-4-methyl-3-oxo-N-phenylpentanamid [German] [ACD/IUPAC Name]
Benzenebutanamide, 4-fluoro-α-(2-methyl-1-oxopropyl)-γ-oxo-N,β-diphenyl-, (βS)- [ACD/Index 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: 631.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 93.4±3.0 kJ/mol
Flash Point: 335.6±31.5 °C
Index of Refraction: 1.599
Molar Refractivity: 117.7±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 5.55
ACD/LogD (pH 5.5): 4.61
ACD/BCF (pH 5.5): 1882.86
ACD/KOC (pH 5.5): 7685.98
ACD/LogD (pH 7.4): 4.61
ACD/BCF (pH 7.4): 1867.32
ACD/KOC (pH 7.4): 7622.55
Polar Surface Area: 63 Å2
Polarizability: 46.7±0.5 10-24cm3
Surface Tension: 48.3±3.0 dyne/cm
Molar Volume: 344.5±3.0 cm3

Click to predict properties on the Chemicalize site


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