ChemSpider 2D Image | 1-(2-Cyclohexyl-1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl)-3-(4-iodo-2-methylphenyl)urea | C22H22IN3O3

1-(2-Cyclohexyl-1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl)-3-(4-iodo-2-methylphenyl)urea

  • Molecular FormulaC22H22IN3O3
  • Average mass503.333 Da
  • Monoisotopic mass503.070587 Da
  • ChemSpider ID34594144

More details:

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

1-(2-Cyclohexyl-1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl)-3-(4-iod-2-methylphenyl)harnstoff [German] [ACD/IUPAC Name]
1-(2-Cyclohexyl-1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl)-3-(4-iodo-2-methylphenyl)urea [ACD/IUPAC Name]
1-(2-Cyclohexyl-1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl)-3-(4-iodo-2-méthylphényl)urée [French] [ACD/IUPAC Name]
Urea, N-(2-cyclohexyl-2,3-dihydro-1,3-dioxo-1H-isoindol-5-yl)-N'-(4-iodo-2-methylphenyl)- [ACD/Index Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 524.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 79.8±3.0 kJ/mol
Flash Point: 270.8±30.1 °C
Index of Refraction: 1.727
Molar Refractivity: 119.9±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 2
ACD/LogP: 6.14
ACD/LogD (pH 5.5): 4.77
ACD/BCF (pH 5.5): 2483.52
ACD/KOC (pH 5.5): 9370.99
ACD/LogD (pH 7.4): 4.77
ACD/BCF (pH 7.4): 2483.43
ACD/KOC (pH 7.4): 9370.64
Polar Surface Area: 79 Å2
Polarizability: 47.5±0.5 10-24cm3
Surface Tension: 74.0±3.0 dyne/cm
Molar Volume: 301.5±3.0 cm3

Click to predict properties on the Chemicalize site


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