ChemSpider 2D Image | (5S)-1-Benzyl-3-(4-methoxyphenyl)-5-phenyl-1,5-dihydro-2H-pyrrol-2-one | C24H21NO2

(5S)-1-Benzyl-3-(4-methoxyphenyl)-5-phenyl-1,5-dihydro-2H-pyrrol-2-one

  • Molecular FormulaC24H21NO2
  • Average mass355.429 Da
  • Monoisotopic mass355.157227 Da
  • ChemSpider ID30659293
  • defined stereocentres - 1 of 1 defined stereocentres


More details:






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

(5S)-1-Benzyl-3-(4-methoxyphenyl)-5-phenyl-1,5-dihydro-2H-pyrrol-2-on [German] [ACD/IUPAC Name]
(5S)-1-Benzyl-3-(4-methoxyphenyl)-5-phenyl-1,5-dihydro-2H-pyrrol-2-one [ACD/IUPAC Name]
(5S)-1-Benzyl-3-(4-méthoxyphényl)-5-phényl-1,5-dihydro-2H-pyrrol-2-one [French] [ACD/IUPAC Name]
2H-Pyrrol-2-one, 1,5-dihydro-3-(4-methoxyphenyl)-5-phenyl-1-(phenylmethyl)-, (5S)- [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: 587.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.7±3.0 kJ/mol
Flash Point: 309.0±30.1 °C
Index of Refraction: 1.633
Molar Refractivity: 106.5±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.91
ACD/LogD (pH 5.5): 4.79
ACD/BCF (pH 5.5): 2584.60
ACD/KOC (pH 5.5): 9642.44
ACD/LogD (pH 7.4): 4.79
ACD/BCF (pH 7.4): 2584.60
ACD/KOC (pH 7.4): 9642.44
Polar Surface Area: 30 Å2
Polarizability: 42.2±0.5 10-24cm3
Surface Tension: 50.3±3.0 dyne/cm
Molar Volume: 298.2±3.0 cm3

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