ChemSpider 2D Image | 4-{[4-(Benzyloxy)-2-methylphenyl](hydroxy)methylene}-1-[3-(4-morpholinyl)propyl]-5-(3-phenoxyphenyl)-2,3-pyrrolidinedione | C38H38N2O6

4-{[4-(Benzyloxy)-2-methylphenyl](hydroxy)methylene}-1-[3-(4-morpholinyl)propyl]-5-(3-phenoxyphenyl)-2,3-pyrrolidinedione

  • Molecular FormulaC38H38N2O6
  • Average mass618.718 Da
  • Monoisotopic mass618.273010 Da
  • ChemSpider ID2736136

More details:

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

2,3-Pyrrolidinedione, 4-[hydroxy[2-methyl-4-(phenylmethoxy)phenyl]methylene]-1-[3-(4-morpholinyl)propyl]-5-(3-phenoxyphenyl)- [ACD/Index Name]
4-{[4-(Benzyloxy)-2-methylphenyl](hydroxy)methylen}-1-[3-(4-morpholinyl)propyl]-5-(3-phenoxyphenyl)-2,3-pyrrolidindion [German] [ACD/IUPAC Name]
4-{[4-(Benzyloxy)-2-methylphenyl](hydroxy)methylene}-1-[3-(4-morpholinyl)propyl]-5-(3-phenoxyphenyl)-2,3-pyrrolidinedione [ACD/IUPAC Name]
4-{[4-(Benzyloxy)-2-méthylphényl](hydroxy)méthylène}-1-[3-(4-morpholinyl)propyl]-5-(3-phénoxyphényl)-2,3-pyrrolidinedione [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: 783.9±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 119.6±3.0 kJ/mol
Flash Point: 427.9±35.7 °C
Index of Refraction: 1.626
Molar Refractivity: 175.6±0.3 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 7.09
ACD/LogD (pH 5.5): 3.60
ACD/BCF (pH 5.5): 135.40
ACD/KOC (pH 5.5): 420.98
ACD/LogD (pH 7.4): 4.91
ACD/BCF (pH 7.4): 2755.93
ACD/KOC (pH 7.4): 8568.25
Polar Surface Area: 89 Å2
Polarizability: 69.6±0.5 10-24cm3
Surface Tension: 53.5±3.0 dyne/cm
Molar Volume: 495.8±3.0 cm3

Click to predict properties on the Chemicalize site


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