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Benztropine mesylate

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Identification
Molecular formula
C21H25NO2·CH3SO3H
CAS number
132-17-2
IUPAC name
1-(benzothiophen-3-yl)-2-piperidin-1-ium-1-yl-ethanone;chloride
State
State

At room temperature, this compound is typically in a solid state.

Melting point (Celsius)
120.00
Melting point (Kelvin)
393.00
Boiling point (Celsius)
275.00
Boiling point (Kelvin)
548.00
General information
Molecular weight
305.83g/mol
Molar mass
305.8330g/mol
Density
0.9800g/cm3
Appearence

This compound typically appears as a white to off-white crystalline powder.

Comment on solubility

Solubility of 1-(benzothiophen-3-yl)-2-piperidin-1-ium-1-yl-ethanone;chloride

The solubility of 1-(benzothiophen-3-yl)-2-piperidin-1-ium-1-yl-ethanone;chloride can be analyzed through various parameters that influence the interaction between the compound and solvents. Here are some important aspects to consider:

  • Polarity: This compound contains multiple functional groups, contributing to its overall polarity, which tends to enhance solubility in polar solvents, such as water or alcohols.
  • Hydrogen Bonding: The presence of nitrogen in the piperidine ring can facilitate hydrogen bonding with water, thereby increasing solubility.
  • Solvent Effects: Solubility may vary significantly across different solvents. For instance, it is likely to be more soluble in polar aprotic solvents compared to non-polar solvents due to compatible molecular interactions.

As a general rule, the solubility of salts in water can often be quite favorable; however, the overall structure of the compound is key. Compounds featuring quaternary ammonium groups are typically more soluble in aqueous solutions, while aromatic compounds like benzothiophene may exhibit different solubility behaviors depending on conditions such as:

  • Temperature
  • pH of the solution
  • Concentration of other ionic species

In conclusion, while the solubility of 1-(benzothiophen-3-yl)-2-piperidin-1-ium-1-yl-ethanone;chloride may be generally favorable in polar solvents, it is influenced by the interplay of structural features, solvent characteristics, and external conditions, making it essential to conduct empirical solubility tests for precise data.

Interesting facts

Interesting Facts about 1-(Benzothiophen-3-yl)-2-piperidin-1-ium-1-yl-ethanone; Chloride

This compound, featuring a unique combination of a benzothiophene and a piperidine moiety, is fascinating from both pharmacological and synthetic chemistry perspectives. Its structure lends itself to a variety of potential applications, particularly in the fields of medicinal chemistry and material science.

Key Highlights:

  • Pharmacological Potential: Compounds containing piperidine rings are often explored for their biological activity. This particular compound may exhibit properties that could be beneficial in drug development, particularly for targeting neurological disorders.
  • Synthetic Versatility: The synthesis of this compound involves techniques that can be adapted for creating other derivatives, showcasing the importance of modifying structural elements in drug discovery.
  • Bioisosterism: The presence of the thiophene group can enhance the lipophilicity of the compound, which is a crucial factor affecting the drug's ability to penetrate cell membranes.
  • Research Insights: Studies have suggested that benzothiophene derivatives can display a wide range of pharmacological activities, including anti-inflammatory and anticancer properties.

Furthermore, the chloride salt form of this compound may help in improving its stability and solubility, making it an interesting candidate for further research. As scientists continue to explore this compound, we can anticipate discoveries that could contribute to the development of new therapies and materials.

In summary, 1-(Benzothiophen-3-yl)-2-piperidin-1-ium-1-yl-ethanone; chloride exemplifies how intricate chemical structures can carry significant implications for biological research and industrial applications. This compound serves as a reminder of the vast potential that lies within the realm of organic chemistry and its impact on science and society.

Synonyms
Benzo(b)thien-3-yl piperidinomethyl ketone hydrochloride
7349-48-6
3-(Piperidinoacetyl)benzo(b)thiophene hydrochloride
Benzo(b)thiophene, 3-(piperidinoacetyl)-, hydrochloride
KETONE, BENZO(b)THIEN-3-YL PIPERIDINOMETHYL, HYDROCHLORIDE