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ethyl 4-benzoyl-5-methylisoxazole-3-carboxylate

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Identification
Molecular formula
C14H13NO4
CAS number
144689-93-0
IUPAC name
ethyl 4-benzoyl-5-methyl-isoxazole-3-carboxylate
State
State

It is typically found as a solid at room temperature.

Melting point (Celsius)
110.00
Melting point (Kelvin)
383.15
Boiling point (Celsius)
430.15
Boiling point (Kelvin)
703.30
General information
Molecular weight
259.26g/mol
Molar mass
259.2620g/mol
Density
1.1812g/cm3
Appearence

It appears as a crystalline solid that can range from off-white to pale yellow in color.

Comment on solubility

Solubility of Ethyl 4-benzoyl-5-methyl-isoxazole-3-carboxylate

Ethyl 4-benzoyl-5-methyl-isoxazole-3-carboxylate, a compound with intriguing structural features, exhibits a range of solubility characteristics that are essential for its applications in various fields, particularly in organic synthesis and pharmaceuticals. Understanding the solubility profile is crucial as it often impacts the compound's efficacy, stability, and formulation.

Key Solubility Considerations:

  • Polar vs. Non-Polar Solvents: This compound is expected to show greater solubility in organic solvents such as ethanol or acetone due to its hydrophobic aromatic rings.
  • Impact of Functional Groups: The presence of the carboxylate group can enhance interactions with polar solvents, making the compound more soluble in mixed solvent systems.
  • Temperature Dependence: As with many organic compounds, solubility may increase with temperature, often allowing for a more versatile application in synthesis and formulation.

In summary, the solubility of ethyl 4-benzoyl-5-methyl-isoxazole-3-carboxylate in various solvents is influenced by its unique molecular structure, which balances polar and non-polar characteristics. As noted, "The right solvent can significantly enhance the reactivity and utility of the compound." Thus, understanding these solubility dynamics is paramount for effective usage in practical scenarios.

Interesting facts

Interesting Facts about Ethyl 4-benzoyl-5-methyl-isoxazole-3-carboxylate

Ethyl 4-benzoyl-5-methyl-isoxazole-3-carboxylate, commonly referred to in the chemical community as a derivative of isoxazole, presents intriguing characteristics that highlight its potential applications and significance in various fields.

Key Highlights:

  • Pharmaceutical Potential: This compound plays a vital role in medicinal chemistry, where derivatives of isoxazole are often explored for their biological activities, including anti-inflammatory and analgesic effects.
  • Synthetic Versatility: The presence of both the benzoyl and the ethyl carboxylate groups offers ample opportunities for synthetic modifications, allowing chemists to create a diverse range of related compounds.
  • Research Applications: Ethyl 4-benzoyl-5-methyl-isoxazole-3-carboxylate is of interest in studies involving diketones and their rearrangement, providing valuable insights into reaction mechanisms and compound behavior.
  • Potential in Materials Science: The features of isoxazole derivatives make them promising candidates for designing new materials, including polymers and ligands in coordination chemistry.

In the words of a renowned chemist, “Every compound carries a story within its bonds and structures.” Ethyl 4-benzoyl-5-methyl-isoxazole-3-carboxylate is no exception, boasting a wealth of possibilities that beckon further exploration and utilization.

The scientific inquiry into this compound reflects the broader quest to understand the intricate relationships among molecular structures, properties, and functions. As research unfolds, it is likely that new and exciting applications will arise, solidifying its place in the annals of chemical exploration.

Synonyms
17335-06-7
3-ISOXAZOLECARBOXYLIC ACID, 4-BENZOYL-5-METHYL-, ETHYL ESTER
4-Benzoyl-5-methyl-3-isoxazolecarboxylic acid ethyl ester
BRN 0996797
DTXSID40169605
DTXCID9092096
ethyl 4-benzoyl-5-methyl-1,2-oxazole-3-carboxylate
Ethyl 4-benzoyl-5-methylisoxazole-3-carboxylate
SCHEMBL994810