ChemSpider 2D Image | iotroxic acid | C22H18I6N2O9

iotroxic acid

  • Molecular FormulaC22H18I6N2O9
  • Average mass1215.813 Da
  • Monoisotopic mass1215.527954 Da
  • ChemSpider ID3609

More details:

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

256-917-3 [EINECS]
3,3'-{Oxybis[2,1-ethandiyloxy(1-oxo-2,1-ethandiyl)imino]}bis(2,4,6-triiodbenzoesäure) [German] [ACD/IUPAC Name]
3,3'-{Oxybis[2,1-ethanediyloxy(1-oxo-2,1-ethanediyl)imino]}bis(2,4,6-triiodobenzoic acid) [ACD/IUPAC Name]
3,3'-{Oxybis[ethane-2,1-diyloxy(1-oxoethane-2,1-diyl)imino]}bis(2,4,6-triiodobenzoic acid)
51022-74-3 [RN]
Acide 3,3'-{oxybis[2,1-éthanediyloxy(1-oxo-2,1-éthanediyl)imino]}bis(2,4,6-triiodobenzoïque) [French] [ACD/IUPAC Name]
acide iotroxique [French] [INN]
ácido iotróxico [Spanish] [INN]
acidum iotroxicum [Latin] [INN]
iotroxic acid [BAN] [INN] [JAN] [JP15] [USAN]

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

3652 [DBID]
BRN 2800081 [DBID]
D01388 [DBID]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 2.6±0.1 g/cm3
Boiling Point: 938.8±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 143.1±3.0 kJ/mol
Flash Point: 521.6±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: 2
ACD/LogP: 1.74
ACD/LogD (pH 5.5): -0.29
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.29
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
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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