ChemSpider 2D Image | 4-[4-Ethoxy-3-(2-methyl-2-propanyl)benzoyl]-3-hydroxy-5-[4-(2-methyl-2-propanyl)phenyl]-1-(1-naphthyl)-1,5-dihydro-2H-pyrrol-2-one | C37H39NO4

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

  • Molecular FormulaC37H39NO4
  • Average mass561.710 Da
  • Monoisotopic mass561.287903 Da
  • ChemSpider ID34827509

More details:

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

2H-Pyrrol-2-one, 4-[3-(1,1-dimethylethyl)-4-ethoxybenzoyl]-5-[4-(1,1-dimethylethyl)phenyl]-1,5-dihydro-3-hydroxy-1-(1-naphthalenyl)- [ACD/Index Name]
4-[4-Ethoxy-3-(2-methyl-2-propanyl)benzoyl]-3-hydroxy-5-[4-(2-methyl-2-propanyl)phenyl]-1-(1-naphthyl)-1,5-dihydro-2H-pyrrol-2-on [German] [ACD/IUPAC Name]
4-[4-Ethoxy-3-(2-methyl-2-propanyl)benzoyl]-3-hydroxy-5-[4-(2-methyl-2-propanyl)phenyl]-1-(1-naphthyl)-1,5-dihydro-2H-pyrrol-2-one [ACD/IUPAC Name]
4-[4-Éthoxy-3-(2-méthyl-2-propanyl)benzoyl]-3-hydroxy-5-[4-(2-méthyl-2-propanyl)phényl]-1-(1-naphtyl)-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: 699.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 107.5±3.0 kJ/mol
Flash Point: 376.9±31.5 °C
Index of Refraction: 1.623
Molar Refractivity: 167.8±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 9.62
ACD/LogD (pH 5.5): 7.22
ACD/BCF (pH 5.5): 101222.74
ACD/KOC (pH 5.5): 67417.41
ACD/LogD (pH 7.4): 5.45
ACD/BCF (pH 7.4): 1746.13
ACD/KOC (pH 7.4): 1162.97
Polar Surface Area: 67 Å2
Polarizability: 66.5±0.5 10-24cm3
Surface Tension: 50.2±3.0 dyne/cm
Molar Volume: 475.9±3.0 cm3

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