N-(4-bromo-3-methyl-phenyl)-1-methylsulfanyl-methanimidothioic acid

Identification

Molecular formula

C₉H₁₀BrNS₂

CAS number

102271-47-2

IUPAC name

N-(4-bromo-3-methyl-phenyl)-1-methylsulfanyl-methanimidothioic acid

State

The compound is typically in a crystalline solid state at room temperature.

Melting point (Celsius)

132.00

Melting point (Kelvin)

405.15

Boiling point (Celsius)

326.00

Boiling point (Kelvin)

599.15

General information

Molecular weight

306.26g/mol

Molar mass

306.2570g/mol

Density

1.5400g/cm³

Appearence

The compound typically appears as a solid powder. It has a characteristic color varying from white to light yellow, depending on its purity.

Comment on solubility

Solubility of N-(4-bromo-3-methyl-phenyl)-1-methylsulfanyl-methanimidothioic acid

N-(4-bromo-3-methyl-phenyl)-1-methylsulfanyl-methanimidothioic acid exhibits intriguing solubility characteristics that influence its applications in various chemical and biological fields. The solubility of this compound can be assessed based on several factors:

Polarity: The presence of polar functional groups, such as the methanimidothioic acid moiety, contributes to a notable degree of solubility in polar solvents like water.
Hydrophobic interactions: However, the bromo and methyl substituents on the aromatic ring impart hydrophobic properties, potentially affecting solubility in non-polar solvents.
Solvent compatibility: It is likely to demonstrate varying solubility in organic solvents. For example, it may show good solubility in dimethyl sulfoxide (DMSO) and ethanol, while less soluble in non-polar solvents.

As a point of reference, it is common for thioic acids to have moderate to high solubility in acidic or alkaline aqueous solutions due to dissociation, which increases the ionic character of the compound. Understanding these characteristics can guide practical applications, such as:

Selection of appropriate solvents for recrystallization and purification.
Designing drug formulations where optimal solubility is crucial for bioavailability.
Conducting reactions in conditions that favor solubility to improve yields.

In conclusion, evaluating the solubility of N-(4-bromo-3-methyl-phenyl)-1-methylsulfanyl-methanimidothioic acid is essential to fully exploit its potential in both research and practical applications.

Interesting facts

Interesting Facts about N-(4-bromo-3-methyl-phenyl)-1-methylsulfanyl-methanimidothioic acid

N-(4-bromo-3-methyl-phenyl)-1-methylsulfanyl-methanimidothioic acid is a fascinating compound that exhibits unique features and potential applications in various fields. Here are some intriguing facts:

Functional Groups: This compound boasts multiple functional groups, including a thioic acid and a sulfo group, which contribute to its reactivity and potential biological activity.
Pharmaceutical Potential: Compounds with similar structures have been investigated for their potential as pharmaceutical agents, particularly due to their intriguing interactions with biological targets.
Research Insights: Studies have shown that the incorporation of bromo and methyl groups can significantly alter both the physical and chemical properties of compounds, influencing their efficacy and stability.
Synthesis and Chemistry: The synthesis of this compound involves complex pathways that highlight the importance of organic chemistry techniques, making it a subject of interest for chemists.
Applications in Agriculture: Compounds with thioic acid functionalities are explored for use in agriculture, where they may serve as effective pesticides or herbicides due to their biological activity.

As a synthetic chemist or a student of organic chemistry, delving into the structure and behavior of N-(4-bromo-3-methyl-phenyl)-1-methylsulfanyl-methanimidothioic acid opens up intriguing avenues for research and development in both industrial and medicinal chemistry.