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3-(Trichloromethylthio)-1,3-benzothiazol-2(3H)-one

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Identification
Molecular formula
C8H4Cl3NOS2
CAS number
2527-58-4
IUPAC name
3-(trichloromethylsulfanyl)-1,3-benzothiazol-2-one
State
State

At room temperature, the compound typically exists in a solid state. It is relatively stable under standard conditions but requires appropriate handling to avoid decomposition or reaction with moisture.

Melting point (Celsius)
148.00
Melting point (Kelvin)
421.00
Boiling point (Celsius)
310.00
Boiling point (Kelvin)
583.00
General information
Molecular weight
280.56g/mol
Molar mass
280.5560g/mol
Density
1.5900g/cm3
Appearence

The compound is generally a white to off-white crystalline powder, although slight variations in color might occur due to impurities.

Comment on solubility

Solubility of 3-(Trichloromethylsulfanyl)-1,3-benzothiazol-2-one

3-(Trichloromethylsulfanyl)-1,3-benzothiazol-2-one is an interesting compound with notable solubility characteristics. The solubility of a compound often depends on several factors, including its molecular structure, polarity, and the solvent being used.

When considering the solubility of this compound, it is essential to focus on its key attributes:

  • Polarity: Due to the presence of the trichloromethyl group and the benzothiazole moiety, this compound exhibits significant polar characteristics, which can influence its interactions with various solvents.
  • Solvent Compatibility: 3-(Trichloromethylsulfanyl)-1,3-benzothiazol-2-one is likely to be more soluble in polar solvents such as dimethyl sulfoxide (DMSO) or dimethylformamide (DMF), while showing lower solubility in non-polar solvents.
  • Temperature Effect: As with many chemical compounds, an increase in temperature can enhance solubility due to the increased kinetic energy that facilitates solvation processes.

In summary, the solubility of 3-(trichloromethylsulfanyl)-1,3-benzothiazol-2-one is influenced by its polar structure and the choice of solvent, making it a subject of interest for further research and applications.

Interesting facts

Interesting Facts about 3-(Trichloromethylsulfanyl)-1,3-benzothiazol-2-one

3-(Trichloromethylsulfanyl)-1,3-benzothiazol-2-one, commonly referred to in scientific circles, is a fascinating compound with unique properties and applications. Here are some engaging insights about this intriguing molecule:

  • Biological Activity: This compound displays noteworthy biological activity, often studied for its potential therapeutic applications. Its structure allows for interactions with various biological targets, making it of interest in medicinal chemistry.
  • Environmental Impact: As a compound containing trichloromethyl groups, it is important to consider its environmental influence. Understanding the breakdown products and behavior in ecological systems is crucial for assessing its safety and sustainability.
  • Industrial Use: 3-(Trichloromethylsulfanyl)-1,3-benzothiazol-2-one is employed in industries for its fungicidal properties. It can be used in agricultural applications to protect crops from fungal infections, showcasing its utility in enhancing food security.
  • Analytical Chemistry: The detection and analysis of this compound can be quite challenging due to its unique chemical properties. Techniques such as chromatography and mass spectrometry are often employed to study its presence and behavior in different environments.
  • Research Frontiers: Ongoing research explores the synthesis of new derivatives and their corresponding biological activities. This opens up a frontier for the discovery of novel applications that could potentially yield beneficial effects in pharmaceuticals.

As a molecule rich in both chemical complexity and potential applications, 3-(trichloromethylsulfanyl)-1,3-benzothiazol-2-one serves as an exciting example of how chemistry intersects with industry and biology. Its continued study may lead to groundbreaking discoveries that contribute to our understanding of chemical behavior and its impacts on health and the environment.

Synonyms
N-Trichloromethylthiobenzothiazolone
3567-79-1
Trichloromethylthio-3-benzothiazolone
11,670 RP
BENZOTHIAZOL-2-ONE, 3-TRICHLOROMETHYLTHIO-
2(3H)-Benzothiazolone, 3-((trichloromethyl)thio)-
2(3H)-Benzothiazolone, 3-((trichloromethyl)thio)-(9CI)
SCHEMBL1872613
DTXSID30957053
3-[(Trichloromethyl)sulfanyl]-1,3-benzothiazol-2(3H)-one