ChemSpider 2D Image | 5-[4-(Benzyloxy)-3-ethoxyphenyl]-4-[(4-fluorophenyl)(hydroxy)methylene]-1-[3-(4-morpholinyl)propyl]-2,3-pyrrolidinedione | C33H35FN2O6

5-[4-(Benzyloxy)-3-ethoxyphenyl]-4-[(4-fluorophenyl)(hydroxy)methylene]-1-[3-(4-morpholinyl)propyl]-2,3-pyrrolidinedione

  • Molecular FormulaC33H35FN2O6
  • Average mass574.639 Da
  • Monoisotopic mass574.247925 Da
  • ChemSpider ID3826278

More details:

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

2,3-Pyrrolidinedione, 5-[3-ethoxy-4-(phenylmethoxy)phenyl]-4-[(4-fluorophenyl)hydroxymethylene]-1-[3-(4-morpholinyl)propyl]- [ACD/Index Name]
5-[4-(Benzyloxy)-3-ethoxyphenyl]-4-[(4-fluorophenyl)(hydroxy)methylene]-1-[3-(4-morpholinyl)propyl]-2,3-pyrrolidinedione [ACD/IUPAC Name]
5-[4-(Benzyloxy)-3-éthoxyphényl]-4-[(4-fluorophényl)(hydroxy)méthylène]-1-[3-(4-morpholinyl)propyl]-2,3-pyrrolidinedione [French] [ACD/IUPAC Name]
5-[4-(Benzyloxy)-3-ethoxyphenyl]-4-[(4-fluorphenyl)(hydroxy)methylen]-1-[3-(4-morpholinyl)propyl]-2,3-pyrrolidindion [German] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.3±0.1 g/cm3
Boiling Point: 720.7±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 110.5±3.0 kJ/mol
Flash Point: 389.7±35.7 °C
Index of Refraction: 1.602
Molar Refractivity: 155.6±0.3 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: 4.97
ACD/LogD (pH 5.5): 2.05
ACD/BCF (pH 5.5): 9.05
ACD/KOC (pH 5.5): 60.75
ACD/LogD (pH 7.4): 3.34
ACD/BCF (pH 7.4): 173.66
ACD/KOC (pH 7.4): 1165.90
Polar Surface Area: 89 Å2
Polarizability: 61.7±0.5 10-24cm3
Surface Tension: 51.7±3.0 dyne/cm
Molar Volume: 453.7±3.0 cm3

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