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Etofesine hydrochloride

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Identification
Molecular formula
C28H34ClNO5
CAS number
122890-87-3
IUPAC name
ethyl 1-[2-(2-hydroxy-2,2-diphenyl-acetyl)oxyethyl]-4-phenyl-piperidin-1-ium-4-carboxylate;chloride
State
State

At room temperature, Etofesine hydrochloride is in a solid state. It is generally stable under normal conditions but should be stored in a cool, dry place.

Melting point (Celsius)
228.00
Melting point (Kelvin)
501.15
Boiling point (Celsius)
0.00
Boiling point (Kelvin)
0.00
General information
Molecular weight
494.00g/mol
Molar mass
494.0040g/mol
Density
1.1590g/cm3
Appearence

Etofesine hydrochloride typically appears as a crystalline solid powder. It may be off-white in color and should be handled carefully to maintain its chemical integrity.

Comment on solubility

Solubility of Ethyl 1-[2-(2-hydroxy-2,2-diphenyl-acetyl)oxyethyl]-4-phenyl-piperidin-1-ium-4-carboxylate; Chloride

The solubility of ethyl 1-[2-(2-hydroxy-2,2-diphenyl-acetyl)oxyethyl]-4-phenyl-piperidin-1-ium-4-carboxylate; chloride can be influenced by various factors due to its complex structure. Here are some key points to consider:

  • Polarity: Given the presence of multiple functional groups, including the piperidinium and carboxylate moieties, the compound is expected to exhibit a significant degree of polarity, which often enhances solubility in polar solvents such as water.
  • Solvent Interaction: Solubility can be affected by the choice of solvent. For instance, alcohols and dimethyl sulfoxide (DMSO) may dissolve the compound more readily compared to nonpolar solvents like hexane.
  • Temperature Impact: Like many compounds, its solubility may increase with temperature, so higher temperatures may provide better dissolution rates.
  • Hydrogen Bonding: The hydroxyl group can participate in hydrogen bonding, potentially leading to favorable interactions with polar solvents, which could enhance overall solubility.

In summary, while specific solubility data for this particular compound may not be extensively documented, the presence of various functional groups suggests that it likely demonstrates solubility in polar solvents, with the exact nature being temperature and solvent-dependent. Further experimental evaluation would be valuable to ascertain its solubility profile accurately.

Interesting facts

Interesting Facts about Ethyl 1-[2-(2-Hydroxy-2,2-diphenyl-acetyl)oxyethyl]-4-phenyl-piperidin-1-ium-4-carboxylate; Chloride

This compound is a fascinating example of a piperidine derivative that demonstrates unique chemical behavior and versatility in various applications. Below are some key highlights:

  • Pharmacological Potential: The structure of this compound suggests it could possess significant pharmacological properties, particularly in the fields of neuroscience and medicinal chemistry where piperidine derivatives are frequently explored for their potential as analgesics or sedatives.
  • Complex Structure: Featuring a piperidin-1-ium core, this compound includes an array of functional groups such as a hydroxy group and acyl functionalities that could lead to interesting interactions at the molecular level.
  • Research Relevance: Researchers focus on compounds like this for their potential use in drug design. The incorporation of diphenyl groups can enhance the physicochemical properties of the drug candidates, improving binding specificity to biological targets.
  • In Silico Studies: Scientists often employ computational modeling to predict the behavior of such complex molecules. These methods can be instrumental in understanding how the compound interacts with various biological systems.
  • Chloride Role: The presence of chloride in the formulation assists in the stabilization of the overall molecular architecture and may play a role in the compound’s solubility and distribution properties in biological systems.

In summary, ethyl 1-[2-(2-hydroxy-2,2-diphenyl-acetyl)oxyethyl]-4-phenyl-piperidin-1-ium-4-carboxylate; chloride stands out in the linguistic complexity and potential applications. As we continue to explore the functionalities of such molecules, the prospects for exciting discoveries in pharmacology are immense. Researchers may very well unlock new pathways for treatment solutions based on the unique attributes of this compound.

Synonyms
1-(2-Hydroxyethyl)-4-phenylisonipecotic acid ethyl ester benzilate (ester) hydrochloride
4-Piperidinecarboxylic acid, 1-(2-hydroxyethyl)-4-phenyl-, ethyl ester, benzilate HCl
Isonipecotic acid, 1-(2-hydroxyethyl)-4-phenyl-, ethyl ester, benzilate (ester), hydrochloride
14170-92-4