ChemSpider 2D Image | [4-(2-Aminoethoxy)-3,5-diiodophenyl](2-butyl-1-benzofuran-3-yl)methanone | C21H21I2NO3

[4-(2-Aminoethoxy)-3,5-diiodophenyl](2-butyl-1-benzofuran-3-yl)methanone

  • Molecular FormulaC21H21I2NO3
  • Average mass589.205 Da
  • Monoisotopic mass588.961060 Da
  • ChemSpider ID111385

More details:

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

[4-(2-Aminoethoxy)-3,5-diiodophenyl](2-butyl-1-benzofuran-3-yl)methanone [ACD/IUPAC Name]
[4-(2-Aminoéthoxy)-3,5-diiodophényl](2-butyl-1-benzofuran-3-yl)méthanone [French] [ACD/IUPAC Name]
[4-(2-Aminoethoxy)-3,5-diiodphenyl](2-butyl-1-benzofuran-3-yl)methanon [German] [ACD/IUPAC Name]
Methanone, (4-(2-aminoethoxy)-3,5-diiodophenyl)(2-butyl-3-benzofuranyl)-
Methanone, [4-(2-aminoethoxy)-3,5-diiodophenyl](2-butyl-3-benzofuranyl)- [ACD/Index Name]
(4-(2-aminoethoxy)-3,5-diiodophenyl)(2-butylbenzofuran-3-yl)methanone
94317-95-0 [RN]
DDEA
Desdiethylamiodarone
DI-N-DESETHYL AMIODARONE
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.7±0.1 g/cm3
Boiling Point: 629.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 93.1±3.0 kJ/mol
Flash Point: 334.2±31.5 °C
Index of Refraction: 1.664
Molar Refractivity: 125.7±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 6.73
ACD/LogD (pH 5.5): 3.36
ACD/BCF (pH 5.5): 56.52
ACD/KOC (pH 5.5): 132.12
ACD/LogD (pH 7.4): 5.07
ACD/BCF (pH 7.4): 2882.62
ACD/KOC (pH 7.4): 6738.45
Polar Surface Area: 65 Å2
Polarizability: 49.8±0.5 10-24cm3
Surface Tension: 53.9±3.0 dyne/cm
Molar Volume: 338.6±3.0 cm3

Click to predict properties on the Chemicalize site


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