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Thiamine disulfide

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Identification
Molecular formula
C12H20N4O4S2
CAS number
67-61-8
IUPAC name
methyl 6-acetylsulfanyl-8-[[2-[(4-amino-2-methyl-pyrimidin-5-yl)methyl-formyl-amino]-1-(2-hydroxyethyl)prop-1-enyl]disulfanyl]octanoate
State
State

At room temperature, thiamine disulfide is a solid.

Melting point (Celsius)
238.00
Melting point (Kelvin)
511.15
Boiling point (Celsius)
372.00
Boiling point (Kelvin)
645.15
General information
Molecular weight
530.74g/mol
Molar mass
530.7390g/mol
Density
1.2600g/cm3
Appearence

Thiamine disulfide appears as a white to almost white crystalline powder.

Comment on solubility

Solubility of Methyl 6-acetylsulfanyl-8-[[2-[(4-amino-2-methyl-pyrimidin-5-yl)methyl-formyl-amino]-1-(2-hydroxyethyl)prop-1-enyl]disulfanyl]octanoate

The solubility of methyl 6-acetylsulfanyl-8-[[2-[(4-amino-2-methyl-pyrimidin-5-yl)methyl-formyl-amino]-1-(2-hydroxyethyl)prop-1-enyl]disulfanyl]octanoate (C12H20N4O4S2) can be quite intriguing due to its complex structure. This compound exhibits varying solubility characteristics based on the solvent used.

Factors Influencing Solubility:

  • Polarity: Given its multiple polar functional groups, including amines and hydroxyls, the compound may be more soluble in polar solvents such as water or alcohols.
  • Hydrophobic Regions: The long alkyl chains present may contribute to hydrophobic interactions, potentially reducing solubility in polar environments.
  • pH Dependency: The protonation state of the amino groups could also affect solubility; increased acidity may lead to enhanced solubility.
  • Temperature: Increased temperature typically enhances solubility, which may aid in dissolving this compound in various solvents.

Overall, while predicting the solubility of complex compounds like this one may present challenges, it is often possible to ascertain that they will show significantly greater solubility in polar solvents compared to nonpolar solvents. Factors such as temperature and pH are crucial in determining the overall solubility profile.

In conclusion, exploring the solubility of such intricate compounds often reveals a rich interplay of molecular interactions that can be quite fascinating for researchers and practitioners in the field.

Interesting facts

Interesting Facts about Methyl 6-acetylsulfanyl-8-[[2-[(4-amino-2-methyl-pyrimidin-5-yl)methyl-formyl-amino]-1-(2-hydroxyethyl)prop-1-enyl]disulfanyl]octanoate

Methyl 6-acetylsulfanyl-8-[[2-[(4-amino-2-methyl-pyrimidin-5-yl)methyl-formyl-amino]-1-(2-hydroxyethyl)prop-1-enyl]disulfanyl]octanoate is an intriguing compound worth exploring. Here are several fascinating aspects of this compound:

  • Multifunctional Structure: This compound features a complex molecular architecture with multiple functional groups, including acetyl, amino, and hydroxy moieties. Such diversity in structure can influence its biological activities.
  • Potential Biological Activity: The presence of a pyrimidine ring, a common feature in numerous pharmaceuticals, hints at potential applications in drug discovery and medicinal chemistry.
  • Disulfide Link: The inclusion of disulfanyl linkages may endow the compound with unique redox properties, which could be significant in the field of biochemistry where the reduction-oxidation state plays a crucial role.
  • Applications in Organic Synthesis: Due to its intricate structure, synthetic chemists may find this compound useful as a building block for more complicated molecules in organic synthesis.
  • Research Interest: Given the growing emphasis on personalized medicine and biotechnology, compounds like this could be pivotal in the development of targeted therapies.

As a chemistry student or researcher, analyzing compounds with such rich and multifaceted characteristics can lead to the discovery of new properties and applications. Understanding the interactions and behaviors of this compound in various settings offers a promising avenue for exploration.

In the words of famous chemist Linus Pauling, “The best way to have a good idea is to have a lot of ideas.” Exploring this compound may just lead to the next breakthrough in chemical and pharmacological research!

Synonyms
TATD; Thiamine 8-(methyl 6-acetyldihydrothioctate) disulfide
DTXSID70859269
NS00126001
Methyl 6-(acetylsulfanyl)-8-{[(2E)-2-{[(4-amino-2-methylpyrimidin-5-yl)methyl](formyl)amino}-5-hydroxypent-2-en-3-yl]disulfanyl}octanoate