ChemSpider 2D Image | 1-[2-(Dimethylamino)ethyl]-4-[(2,5-dimethylphenyl)(hydroxy)methylene]-5-(4-iodophenyl)-2,3-pyrrolidinedione | C23H25IN2O3

1-[2-(Dimethylamino)ethyl]-4-[(2,5-dimethylphenyl)(hydroxy)methylene]-5-(4-iodophenyl)-2,3-pyrrolidinedione

  • Molecular FormulaC23H25IN2O3
  • Average mass504.361 Da
  • Monoisotopic mass504.090973 Da
  • ChemSpider ID3678715

More details:

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

1-[2-(Dimethylamino)ethyl]-4-[(2,5-dimethylphenyl)(hydroxy)methylen]-5-(4-iodphenyl)-2,3-pyrrolidindion [German] [ACD/IUPAC Name]
1-[2-(Dimethylamino)ethyl]-4-[(2,5-dimethylphenyl)(hydroxy)methylene]-5-(4-iodophenyl)-2,3-pyrrolidinedione [ACD/IUPAC Name]
1-[2-(Diméthylamino)éthyl]-4-[(2,5-diméthylphényl)(hydroxy)méthylène]-5-(4-iodophényl)-2,3-pyrrolidinedione [French] [ACD/IUPAC Name]
2,3-Pyrrolidinedione, 1-[2-(dimethylamino)ethyl]-4-[(2,5-dimethylphenyl)hydroxymethylene]-5-(4-iodophenyl)- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 583.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 91.7±3.0 kJ/mol
Flash Point: 306.7±32.9 °C
Index of Refraction: 1.644
Molar Refractivity: 122.4±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 2
ACD/LogP: 5.26
ACD/LogD (pH 5.5): 1.26
ACD/BCF (pH 5.5): 1.20
ACD/KOC (pH 5.5): 6.71
ACD/LogD (pH 7.4): 2.76
ACD/BCF (pH 7.4): 37.85
ACD/KOC (pH 7.4): 211.99
Polar Surface Area: 61 Å2
Polarizability: 48.5±0.5 10-24cm3
Surface Tension: 54.2±3.0 dyne/cm
Molar Volume: 338.1±3.0 cm3

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