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Acetylsulfanylmethylhydroxymethylpyridinium bromide

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Identification
Molecular formula
C12H16N2O2SBr
CAS number
109970-49-0
IUPAC name
[5-(acetylsulfanylmethyl)-3-hydroxy-2-methyl-4-pyridyl]methylammonium;bromide
State
State

At room temperature, the compound is in a solid state, typically encountered in its crystalline form. It is stable under standard temperature and pressure conditions.

Melting point (Celsius)
145.00
Melting point (Kelvin)
418.15
Boiling point (Celsius)
230.00
Boiling point (Kelvin)
503.15
General information
Molecular weight
332.26g/mol
Molar mass
332.2580g/mol
Density
1.4900g/cm3
Appearence

The compound typically appears as a light tan or white crystalline powder. It may have a slight sulfuric or acetyl odor due to the acetylsulfanyl group contained within the structure.

Comment on solubility

Solubility of [5-(acetylsulfanylmethyl)-3-hydroxy-2-methyl-4-pyridyl]methylammonium bromide

The solubility of [5-(acetylsulfanylmethyl)-3-hydroxy-2-methyl-4-pyridyl]methylammonium bromide can be described with several key considerations:

  • Solvent Type: This compound often exhibits higher solubility in polar solvents such as water or methanol due to its ionic nature.
  • Temperature Dependency: Generally, solubility increases with temperature; hence, elevated temperatures can enhance the dissolution of this compound.
  • pH Influence: The solubility may vary significantly with changes in pH, as the ammonium group can interact differently in acidic versus neutral or basic environments.
  • Presence of Competing Ions: The solubility could also be affected by the presence of bromide or other halide ions in the solution, which may lead to the formation of complex ions.

In conclusion, while this compound is expected to dissolve readily in aqueous conditions, particular attention should be paid to the environmental conditions—such as temperature, pH, and ionic strength—that may influence its solubility behavior.

Interesting facts

Interesting Facts About [5-(Acetylsulfanylmethyl)-3-hydroxy-2-methyl-4-pyridyl]methylammonium Bromide

This unique compound has captured the attention of chemists due to its intriguing structure and potential applications. Here are some of the noteworthy aspects:

  • Chemical Structure: The compound features a pyridine ring, a crucial building block in many pharmaceuticals, which highlights its relevance in medicinal chemistry.
  • Functional Groups: With the presence of acetylsulfanyl and hydroxy groups, this compound showcases interesting reactivity patterns, paving the way for various chemical transformations and synthesis routes.
  • Pharmacological Potential: Substituents on the pyridine ring can impart specific biological activities. This makes compounds like these of great interest in drug discovery, potentially leading to new therapeutics.
  • Ionic Nature: As a bromide salt, it exhibits ionic characteristics, which may influence its solubility properties and interactions with biological membranes.
  • Research Applications: The unique components may lead to investigations in areas such as antimicrobial activity, anti-inflammatory properties, and other pharmacological studies.

As researchers continue to explore the potential of compounds like [5-(acetylsulfanylmethyl)-3-hydroxy-2-methyl-4-pyridyl]methylammonium bromide, it underscores the importance of analyzing the intricate details that contribute to their behavior and utility in practical applications. The complexity of such molecules often reflects the richness of insights they may provide in advancing chemical science.

Synonyms
Pyridoxamin-5-thioacetat hydrobromid [German]
Pyridoxamin-5-thioacetat hydrobromid
Pyridoxamin-5-thioacetate hydrobromide
5-(Acetylthiomethyl)-4-aminomethyl-2-methyl-3-pyridinol hydrobromide
4-Aminomethyl-5-mercaptomethyl-2-methyl-3-pyridinol thio acetate hydrobromide
Acetic acid, thio-, S-((4-aminomethyl-5-hydroxy-6-methyl-3-pyridyl)methyl) ester, hydrobromide
17433-39-5