ChemSpider 2D Image | 2,2'-{Oxybis[2,1-ethanediyloxy(1-oxo-2,1-ethanediyl)imino]}bis(3,4,6-triiodobenzoic acid) | C22H18I6N2O9

2,2'-{Oxybis[2,1-ethanediyloxy(1-oxo-2,1-ethanediyl)imino]}bis(3,4,6-triiodobenzoic acid)

  • Molecular FormulaC22H18I6N2O9
  • Average mass1215.813 Da
  • Monoisotopic mass1215.527954 Da
  • ChemSpider ID2317146

More details:

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

2,2'-{Oxybis[2,1-ethandiyloxy(1-oxo-2,1-ethandiyl)imino]}bis(3,4,6-triiodbenzoesäure) [German] [ACD/IUPAC Name]
2,2'-{Oxybis[2,1-ethanediyloxy(1-oxo-2,1-ethanediyl)imino]}bis(3,4,6-triiodobenzoic acid) [ACD/IUPAC Name]
Acide 2,2'-{oxybis[2,1-éthanediyloxy(1-oxo-2,1-éthanediyl)imino]}bis(3,4,6-triiodobenzoïque) [French] [ACD/IUPAC Name]
Benzoic acid, 2,2'-[oxybis[2,1-ethanediyloxy(1-oxo-2,1-ethanediyl)imino]]bis[3,4,6-triiodo- [ACD/Index Name]

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

Density: 2.6±0.1 g/cm3
Boiling Point: 924.3±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 140.8±3.0 kJ/mol
Flash Point: 512.8±34.3 °C
Index of Refraction: 1.788
Molar Refractivity: 194.1±0.3 cm3
#H bond acceptors: 11
#H bond donors: 4
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 3
ACD/LogP: 8.15
ACD/LogD (pH 5.5): 3.61
ACD/BCF (pH 5.5): 32.78
ACD/KOC (pH 5.5): 28.00
ACD/LogD (pH 7.4): 3.61
ACD/BCF (pH 7.4): 32.72
ACD/KOC (pH 7.4): 27.95
Polar Surface Area: 160 Å2
Polarizability: 76.9±0.5 10-24cm3
Surface Tension: 83.0±3.0 dyne/cm
Molar Volume: 459.1±3.0 cm3

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