ChemSpider 2D Image | 1-(4-Iodophenyl)-3-[2-(1-pyrrolidinyl)-3-pyridinyl]urea | C16H17IN4O

1-(4-Iodophenyl)-3-[2-(1-pyrrolidinyl)-3-pyridinyl]urea

  • Molecular FormulaC16H17IN4O
  • Average mass408.237 Da
  • Monoisotopic mass408.044708 Da
  • ChemSpider ID34354801

More details:

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

1-(4-Iodophenyl)-3-[2-(1-pyrrolidinyl)-3-pyridinyl]urea [ACD/IUPAC Name]
1-(4-Iodophényl)-3-[2-(1-pyrrolidinyl)-3-pyridinyl]urée [French] [ACD/IUPAC Name]
1-(4-Iodphenyl)-3-[2-(1-pyrrolidinyl)-3-pyridinyl]harnstoff [German] [ACD/IUPAC Name]
Urea, N-(4-iodophenyl)-N'-[2-(1-pyrrolidinyl)-3-pyridinyl]- [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: 432.5±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 68.8±3.0 kJ/mol
Flash Point: 215.4±27.3 °C
Index of Refraction: 1.736
Molar Refractivity: 96.3±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 4.10
ACD/LogD (pH 5.5): 3.03
ACD/BCF (pH 5.5): 82.23
ACD/KOC (pH 5.5): 527.46
ACD/LogD (pH 7.4): 3.68
ACD/BCF (pH 7.4): 366.64
ACD/KOC (pH 7.4): 2351.91
Polar Surface Area: 57 Å2
Polarizability: 38.2±0.5 10-24cm3
Surface Tension: 74.4±3.0 dyne/cm
Molar Volume: 239.7±3.0 cm3

Click to predict properties on the Chemicalize site


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