ChemSpider 2D Image | 5-[4-(Dimethylamino)phenyl]-1-(4-ethoxybenzyl)-4-[4-ethoxy-3-(2-methyl-2-propanyl)benzoyl]-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one | C34H40N2O5

5-[4-(Dimethylamino)phenyl]-1-(4-ethoxybenzyl)-4-[4-ethoxy-3-(2-methyl-2-propanyl)benzoyl]-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one

  • Molecular FormulaC34H40N2O5
  • Average mass556.692 Da
  • Monoisotopic mass556.293701 Da
  • ChemSpider ID34814108

More details:

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

2H-Pyrrol-2-one, 5-[4-(dimethylamino)phenyl]-4-[3-(1,1-dimethylethyl)-4-ethoxybenzoyl]-1-[(4-ethoxyphenyl)methyl]-1,5-dihydro-3-hydroxy- [ACD/Index Name]
5-[4-(Dimethylamino)phenyl]-1-(4-ethoxybenzyl)-4-[4-ethoxy-3-(2-methyl-2-propanyl)benzoyl]-3-hydroxy-1,5-dihydro-2H-pyrrol-2-on [German] [ACD/IUPAC Name]
5-[4-(Dimethylamino)phenyl]-1-(4-ethoxybenzyl)-4-[4-ethoxy-3-(2-methyl-2-propanyl)benzoyl]-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one [ACD/IUPAC Name]
5-[4-(Diméthylamino)phényl]-1-(4-éthoxybenzyl)-4-[4-éthoxy-3-(2-méthyl-2-propanyl)benzoyl]-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one [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: 744.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 113.9±3.0 kJ/mol
Flash Point: 403.9±32.9 °C
Index of Refraction: 1.609
Molar Refractivity: 161.9±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 7.53
ACD/LogD (pH 5.5): 4.78
ACD/BCF (pH 5.5): 1381.99
ACD/KOC (pH 5.5): 2993.75
ACD/LogD (pH 7.4): 3.08
ACD/BCF (pH 7.4): 27.59
ACD/KOC (pH 7.4): 59.76
Polar Surface Area: 79 Å2
Polarizability: 64.2±0.5 10-24cm3
Surface Tension: 51.1±3.0 dyne/cm
Molar Volume: 467.7±3.0 cm3

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