ChemSpider 2D Image | Iotalamic acid | C11H9I3N2O4

Iotalamic acid

  • Molecular FormulaC11H9I3N2O4
  • Average mass613.914 Da
  • Monoisotopic mass613.769592 Da
  • ChemSpider ID3606

More details:



Featured data source



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

1371
16CHD79MIX
1VMR BI DI FI CVQ EVM1 [WLN]
218-897-4 [EINECS]
2276-90-6 [RN]
3-(Acetylamino)-2,4,6-triiodo-5-(methylcarbamoyl)benzoic acid [ACD/IUPAC Name]
3-Acetamido-2,4,6-triiod-5-(methylcarbamoyl)benzoesäure [German] [ACD/IUPAC Name]
3-Acetamido-2,4,6-triiodo-5-(methylcarbamoyl)benzoic acid [ACD/IUPAC Name]
Acide 3-acétamido-2,4,6-triiodo-5-(méthylcarbamoyl)benzoïque [French] [ACD/IUPAC Name]
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

D01258 [DBID]
MI 216 [DBID]

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

Density: 2.5±0.1 g/cm3
Boiling Point: 520.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 83.5±3.0 kJ/mol
Flash Point: 268.4±30.1 °C
Index of Refraction: 1.764
Molar Refractivity: 99.8±0.3 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: -0.37
ACD/LogD (pH 5.5): -1.38
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.39
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 96 Å2
Polarizability: 39.6±0.5 10-24cm3
Surface Tension: 75.9±3.0 dyne/cm
Molar Volume: 241.6±3.0 cm3

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