ChemSpider 2D Image | iosumetic acid | C13H15I3N2O3

iosumetic acid

  • Molecular FormulaC13H15I3N2O3
  • Average mass627.983 Da
  • Monoisotopic mass627.821655 Da
  • ChemSpider ID64520

More details:

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

37863-70-0 [RN]
4-{Ethyl[2,4,6-triiod-3-(methylamino)phenyl]amino}-4-oxobutansäure [German] [ACD/IUPAC Name]
4-{Ethyl[2,4,6-triiodo-3-(methylamino)phenyl]amino}-4-oxobutanoic acid [ACD/IUPAC Name]
8738M34B4Y
Acide 4-{éthyl[2,4,6-triiodo-3-(méthylamino)phényl]amino}-4-oxobutanoïque [French] [ACD/IUPAC Name]
acide iosumétique [French] [INN]
ácido iosumético [Spanish] [INN]
acidum iosumeticum [Latin] [INN]
Butanoic acid, 4-[ethyl[2,4,6-triiodo-3-(methylamino)phenyl]amino]-4-oxo- [ACD/Index Name]
iosumetic acid [INN] [USAN]
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

3767 [DBID]

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

Density: 2.3±0.1 g/cm3
Boiling Point: 657.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 101.7±3.0 kJ/mol
Flash Point: 351.6±31.5 °C
Index of Refraction: 1.738
Molar Refractivity: 109.0±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 3.91
ACD/LogD (pH 5.5): 2.62
ACD/BCF (pH 5.5): 30.09
ACD/KOC (pH 5.5): 183.21
ACD/LogD (pH 7.4): 0.83
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.96
Polar Surface Area: 70 Å2
Polarizability: 43.2±0.5 10-24cm3
Surface Tension: 69.1±3.0 dyne/cm
Molar Volume: 270.9±3.0 cm3

Click to predict properties on the Chemicalize site


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