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ioxaglic acid

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Identification
Molecular formula
C19H16I3N2O6
CAS number
59017-62-2
IUPAC name
2-[[3-(butanoylamino)-2,4,6-triiodo-phenyl]methyl]hexanedioic acid
State
State

At room temperature, ioxaglic acid is typically utilized in its dissolved form, making it a liquid when administered in clinical settings, although the pure compound itself is a solid.

Melting point (Celsius)
138.00
Melting point (Kelvin)
411.15
Boiling point (Celsius)
250.00
Boiling point (Kelvin)
523.15
General information
Molecular weight
1261.94g/mol
Molar mass
1 261.9420g/mol
Density
2.9000g/cm3
Appearence

Ioxaglic acid appears as a white to off-white microcrystalline powder. It is typically provided as a solution for injection, which appears as a clear, sterile liquid.

Comment on solubility

Solubility of 2-[[3-(butanoylamino)-2,4,6-triiodo-phenyl]methyl]hexanedioic acid

The solubility of the compound 2-[[3-(butanoylamino)-2,4,6-triiodo-phenyl]methyl]hexanedioic acid (C19H16I3N2O6) can be characterized by a few significant points:

  • Polarity: Given the presence of various functional groups, including the butanoylamino and carboxylic acid moieties, the compound exhibits increased polarity, which could enhance its solubility in polar solvents such as water.
  • Iodine Atoms: The three iodine atoms contribute to hydrophobic characteristics, potentially leading to limited solubility in non-polar solvents.
  • Hydrogen Bonding: The carboxylic acid group may allow for hydrogen bonding with water molecules, facilitating solubility.
  • pH Dependence: The solubility may be affected by pH levels, as the ionization state of the carboxylic acid group can vary under different conditions.

In summary, the solubility of this compound is likely to be more favorable in polar solvents, although the presence of iodine could hinder solubility in certain environments. As one expert noted, "Compounds with a high degree of molecular complexity often display varied solubility characteristics that are critical for their application in both laboratory and industrial settings."

Interesting facts

Interesting Facts About 2-[[3-(butanoylamino)-2,4,6-triiodo-phenyl]methyl]hexanedioic acid

2-[[3-(butanoylamino)-2,4,6-triiodo-phenyl]methyl]hexanedioic acid, often referred to in academia for its unique chemical structure, presents a fascinating study within the realms of organic and medicinal chemistry. Here are some noteworthy points about this compound:

  • Complex Structure: This compound consists of a hexanedioic acid backbone that is substituted with a triiodinated phenyl group, making it an interesting subject for synthesis and modification. The presence of iodine adds to its intrigue, as halogens often influence the reactivity and biological activity of organic compounds.
  • Biological Applications: The incorporation of an amino group with butanoyl substitution suggests potential uses in pharmaceuticals, particularly in drug design. Such functionalities are often modeled for developing selective inhibitors or therapeutics.
  • Stability and Reactivity: The stability of compounds with multiple halogens, like this one, can provide insights into their reactivity. The tri-iodo substitution can result in unique electrochemical properties that could be harnessed for innovative applications.
  • Research Interest: Due to its distinctive structure, this compound may be the subject of research in areas such as molecular imaging or targeting specific biological pathways within the body.

Chemical compounds like 2-[[3-(butanoylamino)-2,4,6-triiodo-phenyl]methyl]hexanedioic acid exemplify the intricate relationships between structure and function in chemistry. As one scholar once stated, "The beauty of chemistry lies in its ability to unveil the complexities hidden within simple compounds."

In summary, this compound represents a convergence of organic structure and potential utility, making it a remarkable subject for further studies and applications in various scientific fields.

Synonyms
BRN 3040745
2-(3-Butyramido-2,4,6-triiodobenzyl)adipic acid
Hexanedioic acid, 2-(3-butyramido-2,4,6-triiodobenzyl)-
10590-23-5
ADIPIC ACID, 2-(3-BUTYRAMIDO-2,4,6-TRIIODOBENZYL)-
Acido 2-(3-butirroilamino-2,4,6-triiodobenzil)adipico [Italian]
Acido 2-(3-butirroilamino-2,4,6-triiodobenzil)adipico
DTXSID70909819
2-({3-[(1-Hydroxybutylidene)amino]-2,4,6-triiodophenyl}methyl)hexanedioic acid