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Haloperidol decanoate

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Identification
Molecular formula
C31H41ClFNO4
CAS number
74050-97-6
IUPAC name
ethyl 1-[1-(4-ethoxycarbonyl-4-phenyl-piperidin-1-ium-1-yl)-2-phenyl-ethyl]-4-phenyl-piperidine-4-carboxylate;4-hydroxy-4-oxo-but-2-enoate
State
State

At room temperature, Haloperidol decanoate is in a liquid state, typically utilized in medical applications as an injectable solution.

Melting point (Celsius)
-32.00
Melting point (Kelvin)
241.15
Boiling point (Celsius)
301.80
Boiling point (Kelvin)
574.95
General information
Molecular weight
530.66g/mol
Molar mass
530.6590g/mol
Density
1.1596g/cm3
Appearence

Haloperidol decanoate is typically seen as a clear, colorless to pale yellow liquid. It is usually supplied as a solution for intramuscular injection.

Comment on solubility

Solubility of Ethyl 1-[1-(4-ethoxycarbonyl-4-phenyl-piperidin-1-ium-1-yl)-2-phenyl-ethyl]-4-phenyl-piperidine-4-carboxylate; 4-hydroxy-4-oxo-but-2-enoate

The solubility of a compound is a critical aspect that influences its application and effectiveness in various fields. In the case of ethyl 1-[1-(4-ethoxycarbonyl-4-phenyl-piperidin-1-ium-1-yl)-2-phenyl-ethyl]-4-phenyl-piperidine-4-carboxylate; 4-hydroxy-4-oxo-but-2-enoate, we can observe several important factors:

  • Polarity: The presence of both hydrophobic (phenyl groups) and hydrophilic moieties (carboxylate and hydroxyl groups) in the structure suggests a potential for complex solubility behavior.
  • Solvent Interaction: The solubility will vary significantly depending on the solvent used. Typically, organic solvents such as ethanol or methanol may facilitate better solubility due to the ethyl side chain.
  • pH Dependence: Given that one of the components is a carboxylate, the pH of the solution could greatly influence its solubility. A higher pH may enhance solubility due to deprotonation of the carboxylic acid group, making the compound more ionic and thus more soluble in water.
  • Temperature Effects: Like many organic compounds, increased temperature generally enhances solubility, as it allows for more energetic molecular interactions with the solvent.

In summary, while the solubility profile of this compound is expected to be complex, it's influenced by a multitude of factors including solvent type, pH, temperature, and the inherent structure that balances hydrophobic and hydrophilic characteristics. Understanding these interactions is essential for optimizing its use in practical applications.

Interesting facts

Interesting Facts About Ethyl 1-[1-(4-ethoxycarbonyl-4-phenyl-piperidin-1-ium-1-yl)-2-phenyl-ethyl]-4-phenyl-piperidine-4-carboxylate; 4-hydroxy-4-oxo-but-2-enoate

This compound is a fascinating example of the intricate world of organic chemistry, showcasing the intricate balance between structure and function. Here are a few key points that highlight its significance:

  • Molecular Complexity: The structure of this compound features multiple rings and functional groups, presenting a rich landscape for chemical interactions. The presence of both piperidine and phenyl groups suggests potential application in medicinal chemistry, particularly in drug development.
  • Pharmaceutical Potential: Compounds with piperidine moieties are often investigated for their effects on neurotransmitter receptors. This suggests that this compound may have interesting pharmacological properties, providing a platform for the development of new therapeutic agents.
  • Synthetic Pathways: The synthesis of such complex organic molecules often involves multiple steps and reaction conditions, employing techniques such as alkylation and acylation. Understanding these pathways can provide insight into not just this compound, but also similar analogs in chemical libraries.
  • Functional Groups: The carboxylate and ketone features in this compound imply potential reactivity and versatility, which may be pivotal in further chemical modifications, enhancing its utility in different chemical contexts.
  • Research Implications: Due to its complexity, this compound could serve as a valuable research tool in the study of structure-activity relationships (SAR). Scientists can modify different parts of the compound to explore their impact on biological activity.

In summary, Ethyl 1-[1-(4-ethoxycarbonyl-4-phenyl-piperidin-1-ium-1-yl)-2-phenyl-ethyl]-4-phenyl-piperidine-4-carboxylate; 4-hydroxy-4-oxo-but-2-enoate epitomizes the exciting interplay between structure and function in organic compounds, and continues to be a subject of interest for scientists probing the nuances of chemical synthesis and biological activity.