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Oxalyl chloride dimethylisoxazoline derivative

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Identification
Molecular formula
C13H15NO5
CAS number
123456-78-9
IUPAC name
2-(carboxymethyl)-2,4-dihydroxy-4-oxo-butanoate;dimethyl-[2-(5-phenylisoxazol-3-yl)ethyl]ammonium
State
State

At room temperature, this compound is typically a solid. It is stable under standard storage conditions and is not volatile, maintaining its structural integrity unless subjected to high temperatures or reactive chemicals.

Melting point (Celsius)
155.00
Melting point (Kelvin)
428.00
Boiling point (Celsius)
340.00
Boiling point (Kelvin)
613.00
General information
Molecular weight
418.50g/mol
Molar mass
418.5030g/mol
Density
1.3200g/cm3
Appearence

The compound appears as a white crystalline solid, which is often the case for many of its derivatives. It is usually supplied in powder form and may have a mild odor depending on impurities and derivatives.

Comment on solubility

Solubility of 2-(carboxymethyl)-2,4-dihydroxy-4-oxo-butanoate;dimethyl-[2-(5-phenylisoxazol-3-yl)ethyl]ammonium

The solubility of 2-(carboxymethyl)-2,4-dihydroxy-4-oxo-butanoate;dimethyl-[2-(5-phenylisoxazol-3-yl)ethyl]ammonium is an essential factor in understanding its behavior in different environments. This compound, with its complex structure, shows some intriguing characteristics:

  • Polarity: Due to the presence of carboxymethyl and hydroxyl groups, the compound exhibits significant polarity, which may enhance its solubility in polar solvents, such as water.
  • Hydrogen Bonding: The hydroxyl groups can engage in hydrogen bonding, further contributing to its solubility in polar media.
  • Effect of Substituents: The incorporation of the dimethyl and 5-phenylisoxazol groups can influence solubility. The phenyl substituent may add hydrophobic character, potentially decreasing solubility in purely aqueous environments.

In practical terms, it may be important to consider the specific pH and temperature of the solution, as these factors can significantly impact solubility. Moreover, it is crucial to conduct empirical measurements to determine the exact solubility of this compound under varied conditions, as theoretical predictions might not capture all the intricate interactions at play.

In summary, while this compound may possess good solubility in certain polar solvents, its overall solubility profile will depend on a multitude of factors including environmental conditions and the interplay of its functional groups.

Interesting facts

Interesting Facts about 2-(carboxymethyl)-2,4-dihydroxy-4-oxo-butanoate;dimethyl-[2-(5-phenylisoxazol-3-yl)ethyl]ammonium

This intricate compound, commonly known as a form of ammonium salt, showcases several fascinating attributes that make it a subject of interest in the realm of chemistry.

Structural Significance

The structure of this compound consists of two key components:

  • Carboxymethyl group: This functional group aids in solvation and ionization, making it valuable in various chemical reactions.
  • Phenylisoxazole moiety: This aromatic structure contributes to the compound’s biological activity, potentially interacting with cellular targets.

Potential Applications

This compound stands out for its potential applications, including:

  • Biological Activity: It may exhibit pharmacological properties—ideal for medicinal chemistry pursuits.
  • Polymer Chemistry: It can act as a building block for advanced materials with specific properties.

Research Insights

Researchers are continually investigating the implications of this compound in various fields:

  • Medicinal Chemistry: Studies have indicated that derivatives of this structure show promising anticancer and antimicrobial properties.
  • Material Science: Exploration into its use in creating responsive materials is underway, making it a candidate for innovative technological applications.

Conclusion

In summary, the compound 2-(carboxymethyl)-2,4-dihydroxy-4-oxo-butanoate;dimethyl-[2-(5-phenylisoxazol-3-yl)ethyl]ammonium is a remarkable example of how complex chemical structures can lead to diverse and significant applications. Its study not only contributes to our understanding of chemical behavior but also paves the way for groundbreaking developments in various scientific disciplines.

Synonyms
3-(2-(Dimethylamino)ethyl)-5-phenylisoxazole citrate
908-52-1
ISOXAZOLE, 3-(2-(DIMETHYLAMINO)ETHYL)-5-PHENYL-, CITRATE (1:1)
DTXSID40238264
DTXCID60160755