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Nicotine methiodide

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Identification
Molecular formula
C12H16INOS
CAS number
55-57-2
IUPAC name
S-[[5-hydroxy-4-(hydroxymethyl)-6-methyl-3-pyridyl]methyl] ethanethioate
State
State

At room temperature, nicotine methiodide is a solid. It is stable under standard conditions and can be handled as a typical laboratory solid.

Melting point (Celsius)
130.00
Melting point (Kelvin)
403.15
Boiling point (Celsius)
260.00
Boiling point (Kelvin)
533.15
General information
Molecular weight
238.23g/mol
Molar mass
238.2340g/mol
Density
1.1900g/cm3
Appearence

Nicotine methiodide is typically an off-white to pale yellow solid. It may appear as a powder or crystalline solid depending on the form and is often noted for its lack of significant odor.

Comment on solubility

Solubility of S-[[5-hydroxy-4-(hydroxymethyl)-6-methyl-3-pyridyl]methyl] ethanethioate

The solubility of the compound S-[[5-hydroxy-4-(hydroxymethyl)-6-methyl-3-pyridyl]methyl] ethanethioate can be characterized by several factors:

  • Polarity: The presence of hydroxyl groups in the structure suggests that this compound has polar characteristics, which can enhance its solubility in polar solvents such as water.
  • Hydrophilic and Hydrophobic Balance: The balance between hydrophilic (water-attracting) and hydrophobic (water-repelling) parts of the molecule plays a crucial role. The pyridyl ring introduces hydrophobicity, which may limit its solubility in highly polar solvents.
  • pH Influences: The solubility may be influenced by pH levels. In acidic conditions, the protonation of nitrogen on the pyridyl ring can increase solubility.
  • Temperature Effects: Generally, for organic compounds, an increase in temperature can lead to increased solubility. Therefore, solubility might vary significantly under different temperature conditions.

In summary, while the compound is expected to exhibit some level of solubility in polar solvents, aspects like temperature, pH, and the specific characteristics of the solvent will significantly influence its overall solubility profile. As such, experimenting with different conditions is essential to obtain accurate solubility data.

Interesting facts

Interesting Facts About S-[[5-Hydroxy-4-(hydroxymethyl)-6-methyl-3-pyridyl]methyl] ethanethioate

S-[[5-hydroxy-4-(hydroxymethyl)-6-methyl-3-pyridyl]methyl] ethanethioate is a fascinating compound with a range of intriguing properties and potential applications. Here are some notable highlights:

  • Source: This compound is derived from the combination of a pyridine ring and a thioester moiety, showcasing the diversity of structural classes in organic chemistry.
  • Biological Significance: It has been researched for its potential roles in pharmacology, particularly for its ability to interact with biological systems and influence metabolic pathways.
  • Synthetic Pathways: The synthesis of this compound can involve various chemical reactions, including nucleophilic substitution and condensation reactions, exemplifying the versatility of organic synthesis techniques.
  • Active Ingredients: It may serve as a precursor for components in medicinal chemistry, hinting at its potential uses in drug development.
  • Functional Groups: The presence of hydroxyl and thioate functional groups elevates its reactivity and opens avenues for further chemical modifications.

Moreover, S-[[5-hydroxy-4-(hydroxymethyl)-6-methyl-3-pyridyl]methyl] ethanethioate is a prime example of how complex organic compounds can integrate multiple elements into one molecule, leading to unique chemical behaviors and possible applications in synthesizing new materials and pharmaceuticals. As researchers continue to explore its interactions and properties, we can expect to uncover even more about its potential in science and industry.

Synonyms
Pyridoxine 5-thioacetate
21907-94-8
BRN 1535075
5-Mercapto-pyridoxin-thioacetat [German]
5-Mercapto-pyridoxin-thioacetat
DTXSID30176323
4-Pyridinemethanol, 5-acetylthiomethyl-3-hydroxy-2-methyl-
4-Pyridinemethanol, 3-hydroxy-5-(mercaptomethyl)-2-methyl-, S-acetate
2-Methyl-3-hydroxy-4-hydroxymethyl-5-acetylmercaptomethyl-pyridin [German]
Acetic acid, thio-, S-((3-hydroxy-4-(hydroxymethyl)-2-methyl-5-pyridyl)methyl) ester
Ethanethioic acid, S-((3-hydroxy-4-(hydroxymethyl)-2-methyl-5-pyridinyl)methyl) ester
5-21-05-00502 (Beilstein Handbook Reference)
2-Methyl-3-hydroxy-4-hydroxymethyl-5-acetylmercaptomethyl-pyridin
Ethanethioic acid, S-((5-hydroxy-4-(hydroxymethyl)-6-methyl-3-pyridinyl)methyl) ester
RefChem:377435
DTXCID3098814
4-Pyridinemethanol, 3-hydroxy-5-(mercaptomethyl)-2-methyl-, S-acetate (6CI)
Ethanethioic acid, S-((3-hydroxy-4-(hydroxymethyl)-2-methyl-5-pyridinyl)methyl) ester (9CI)
Ethanethioic acid, S-((5-hydroxy-4-(hydroxymethyl)-6-methyl-3-pyridinyl)methyl) ester (9CI)