ChemSpider 2D Image | 2-Methyl-2-propanyl 3-oxo-2-(2,3,5-triiodophenyl)-1-pyrrolidinecarboxylate | C15H16I3NO3

2-Methyl-2-propanyl 3-oxo-2-(2,3,5-triiodophenyl)-1-pyrrolidinecarboxylate

  • Molecular FormulaC15H16I3NO3
  • Average mass639.006 Da
  • Monoisotopic mass638.826416 Da
  • ChemSpider ID98102569

More details:

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

1-Pyrrolidinecarboxylic acid, 3-oxo-2-(2,3,5-triiodophenyl)-, 1,1-dimethylethyl ester [ACD/Index Name]
2-Methyl-2-propanyl 3-oxo-2-(2,3,5-triiodophenyl)-1-pyrrolidinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-3-oxo-2-(2,3,5-triiodphenyl)-1-pyrrolidincarboxylat [German] [ACD/IUPAC Name]
3-Oxo-2-(2,3,5-triiodophényl)-1-pyrrolidinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]

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

Density: 2.2±0.1 g/cm3
Boiling Point: 533.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.0±3.0 kJ/mol
Flash Point: 276.5±30.1 °C
Index of Refraction: 1.673
Molar Refractivity: 110.1±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 4.23
ACD/LogD (pH 5.5): 4.38
ACD/BCF (pH 5.5): 1253.75
ACD/KOC (pH 5.5): 5745.12
ACD/LogD (pH 7.4): 4.38
ACD/BCF (pH 7.4): 1253.75
ACD/KOC (pH 7.4): 5745.12
Polar Surface Area: 47 Å2
Polarizability: 43.7±0.5 10-24cm3
Surface Tension: 57.1±3.0 dyne/cm
Molar Volume: 293.9±3.0 cm3

Click to predict properties on the Chemicalize site


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