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Etodolac

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Identification
Molecular formula
C17H21ClN2O3
CAS number
41340-25-4
IUPAC name
ethyl 5-chloro-9-methyl-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13),9-pentaene-2-carboxylate
State
State

At room temperature, etodolac is a solid.

Melting point (Celsius)
145.00
Melting point (Kelvin)
418.15
Boiling point (Celsius)
312.00
Boiling point (Kelvin)
585.15
General information
Molecular weight
287.74g/mol
Molar mass
287.7380g/mol
Density
1.4700g/cm3
Appearence

Etodolac appears as a white to off-white crystalline powder. It is practically insoluble in water, freely soluble in acetone, and soluble in ethanol.

Comment on solubility

Solubility of Ethyl 5-Chloro-9-Methyl-3,10-Diazatricyclo[6.4.1.04,13]Trideca-1,4,6,8(13),9-Pentaene-2-Carboxylate

The solubility of ethyl 5-chloro-9-methyl-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13),9-pentaene-2-carboxylate is influenced by several factors:

  • Polarity: The presence of polar functional groups, such as the -COOEt (carboxylate) group, can enhance solubility in polar solvents like water.
  • Hydrophobic Regions: The compound's tricyclic structure may contain hydrophobic regions that could hinder solubility in aqueous environments.
  • Interactions: Hydrogen bonding potential with solvent molecules may significantly impact its solubility behavior.
  • Temperature: Increased temperature generally improves the solubility of organic compounds, leading to a greater dissolution rate in suitable solvents.
  • Solvent Choice: Solvents such as ethanol or dimethyl sulfoxide (DMSO) might provide better solubility due to their ability to interact favorably with both polar and non-polar regions of the compound.

In conclusion, it is crucial to consider these varying factors to predict the solubility characteristics of this complex molecule effectively. As with many organic compounds, understanding the solubility behavior is vital for its application in different chemical environments.

Interesting facts

Interesting Facts about Ethyl 5-Chloro-9-Methyl-3,10-Diazatricyclo[6.4.1.04,13]Trideca-1,4,6,8(13),9-Pentaene-2-Carboxylate

This fascinating compound, ethyl 5-chloro-9-methyl-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13),9-pentaene-2-carboxylate, is part of a unique class of compounds known for their complex bicyclic structures. Here are some noteworthy insights:

  • Structural Intricacy: The compound features a tricyclic framework that intricately combines diazine and carboxylate functionalities, making it a prime candidate for research in organic synthesis and chemical reactivity.
  • Biological Potential: Due to the presence of multiple functional groups, such as the −COOethyl group, this compound may exhibit interesting biological activities, potentially aiding in the design of new pharmaceuticals.
  • Chirality and Isomerism: Compounds with such complex structures often possess chirality, which can create different isomers. This aspect is particularly crucial in drug development, where the specific isomer can have vastly different effects in biological systems.
  • Reactivity: The presence of chloro and methyl groups in the compound can make it highly reactive under certain conditions. This reactivity opens pathways for further chemical transformations, which are vital in synthetic organic chemistry.
  • Applications: Compounds like this one are often explored for applications ranging from agrochemicals to materials science, showcasing their versatility.

In summary, the study of ethyl 5-chloro-9-methyl-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13),9-pentaene-2-carboxylate not only enhances our understanding of complex chemical architectures but also encourages new avenues in medicinal chemistry and materials innovation.