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1-Allylsulfanyl-N-(2-phenylethyl)methanimidothioic acid

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Identification
Molecular formula
C12H15NS2
CAS number
.Not assigned yet.
IUPAC name
1-allylsulfanyl-N-(2-phenylethyl)methanimidothioic acid
State
State

This compound is typically in a liquid state at room temperature.

Melting point (Celsius)
-36.00
Melting point (Kelvin)
237.15
Boiling point (Celsius)
305.00
Boiling point (Kelvin)
578.15
General information
Molecular weight
253.39g/mol
Molar mass
253.3880g/mol
Density
1.3500g/cm3
Appearence

This compound typically appears as a pale yellow liquid. It can have a pungent odor due to the presence of thio and allyl groups. It is generally unstable and can degrade under normal conditions, giving off a noxious smell.

Comment on solubility

Solubility of 1-allylsulfanyl-N-(2-phenylethyl)methanimidothioic acid

Understanding the solubility of 1-allylsulfanyl-N-(2-phenylethyl)methanimidothioic acid is crucial for its application in various fields, particularly in pharmaceuticals and chemical synthesis. The solubility of this compound can be influenced by several factors:

  • Polarity: The presence of polar functional groups may enhance solubility in polar solvents, while nonpolar portions can lead to better solubility in organic solvents.
  • Temperature: Solubility typically increases with temperature; thus, the temperature at which solubility is measured can significantly affect results.
  • pH Levels: The protonation state of the compound can change with pH, thereby altering solubility. For acidic compounds, lower pH levels can lead to higher solubility.
  • Interactions with Solvents: Solubility can be markedly enhanced by hydrogen bonding or other interactions between the solute and solvent molecules.

Studies show that compounds like 1-allylsulfanyl-N-(2-phenylethyl)methanimidothioic acid may exhibit varying solubility in different solvents. For example, it might be sparingly soluble in water while exhibiting higher solubility in organic solvents such as ethanol or acetone.
It is essential to note that solubility data can vary based on experimental conditions, and thus empirical testing is often necessary for accurate characterization.

In conclusion, the solubility profile of 1-allylsulfanyl-N-(2-phenylethyl)methanimidothioic acid is influenced by its structural characteristics and environmental factors, which necessitate careful assessment for effective utilization in various applications.

Interesting facts

Interesting Facts about 1-Allylsulfanyl-N-(2-phenylethyl)methanimidothioic Acid

This compound, known as 1-Allylsulfanyl-N-(2-phenylethyl)methanimidothioic acid, is a fascinating member of the thioamide family, with unique structural and chemical attributes that draw interest from chemists and researchers alike.

Chemical Structure and Properties

The structure of this compound features a thioamide functional group, which often plays a critical role in various biological activities and chemical reactivity. Thioamides are known for their ability to act as:

  • Nucleophiles in reactions with electrophiles,
  • Key components in organic synthesis processes,
  • Potential candidates in drug development due to their biological properties.

Biological Relevance

Research has shown that compounds containing thioamide groups can exhibit antimicrobial and antitumor activities, making them of high interest in medicinal chemistry. The unique substituents in 1-Allylsulfanyl-N-(2-phenylethyl)methanimidothioic acid suggest possible applications in:

  • Pharmaceuticals aimed at treating infections,
  • Agents designed for cancer therapy,
  • Biochemicals for studying enzyme mechanisms.

Synthesis and Reactions

The synthetic pathway of this compound can be intricate, often involving:

  • Formation of the thioamide linkage,
  • Selective alkylation reactions,
  • Utilization of strong nucleophiles to introduce the allyl and phenylethyl groups.

The diversity in synthetic routes emphasizes the compound's versatility and potential for further functionalization, enabling chemists to tailor properties according to specific needs.

In conclusion, 1-Allylsulfanyl-N-(2-phenylethyl)methanimidothioic acid represents a captivating area of study, bridging the gap between organic synthesis and potential therapeutic applications. As scientists explore its properties and reactions, the compound may well contribute to advancements in both academic and pharmaceutical realms.