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Methyl 2,3,5,6-tetrachloro-4-(methylsulfanylcarbonyl)benzoate

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Identification
Molecular formula
C11H6Cl4O3S
CAS number
71463-61-3
IUPAC name
methyl 2,3,5,6-tetrachloro-4-methylsulfanylcarbonyl-benzoate
State
State

At room temperature, this compound is a solid.

Melting point (Celsius)
158.00
Melting point (Kelvin)
431.15
Boiling point (Celsius)
375.00
Boiling point (Kelvin)
648.15
General information
Molecular weight
385.99g/mol
Molar mass
385.9900g/mol
Density
1.6800g/cm3
Appearence

The compound is typically a white to off-white crystalline solid. It might appear in powder or granule form and has a distinct chemical odor.

Comment on solubility

Solubility of Methyl 2,3,5,6-Tetrachloro-4-methylsulfanylcarbonyl-benzoate

Methyl 2,3,5,6-tetrachloro-4-methylsulfanylcarbonyl-benzoate is a complex organic compound, and its solubility can be influenced by various factors. Understanding its solubility profile requires consideration of the following aspects:

  • Polarity: The presence of multiple chlorinated and sulfur-containing groups suggests a polar nature, which may enhance solubility in polar solvents.
  • Solvent Compatibility: This compound is likely to be soluble in solvents such as:
    • Dimethyl sulfoxide (DMSO)
    • Acetone
  • Limitations in Water Solubility: Due to the extensive chlorination and the bulky structure, methyl 2,3,5,6-tetrachloro-4-methylsulfanylcarbonyl-benzoate is expected to have limited solubility in water.

Overall, understanding the intermolecular interactions that dictate solubility, such as hydrogen bonding and Van der Waals forces, is essential in predicting the behavior of this compound in various solvents. The quote "Like dissolves like" is particularly relevant here, as it underscores the importance of matching the polarity of the solvent with that of the solute.

In summary, while the solubility of methyl 2,3,5,6-tetrachloro-4-methylsulfanylcarbonyl-benzoate is favorable in certain organic solvents, it is largely insoluble in water, necessitating careful selection of solvents for any intended applications or reactions.

Interesting facts

Interesting Facts about Methyl 2,3,5,6-Tetrachloro-4-Methylsulfanylcarbonyl-Benzoate

Methyl 2,3,5,6-tetrachloro-4-methylsulfanylcarbonyl-benzoate is a fascinating compound that draws attention due to its unique structure and potential applications. Here are some interesting facts:

  • Pesticidal Properties: This compound is known for its efficacy as a pesticide. Its chlorinated structure allows it to target a variety of pests effectively, making it valuable in agricultural practices.
  • Synthesis and Chemistry: The synthesis of this compound involves intricate chemical reactions, showcasing the complexity of organic chemistry. Students often find the multi-step synthetic pathways to be an engaging challenge.
  • Environmental Impact: Due to its chlorinated nature, there are discussions surrounding the environmental ramifications of using tetrachlorinated compounds. As a chemistry student, it is crucial to study both the benefits and potential risks associated with such substances.
  • Structure-Activity Relationship: The various substituents attached to the benzene ring can impact the compound's biological activity. Understanding the structure-activity relationship (SAR) can provide insights into improving the compound's effectiveness and safety.
  • Regulatory Considerations: As a pesticide, this compound falls under strict regulatory scrutiny. Learning about the regulations and testing requirements for chemical safety can provide a deeper understanding of chemistry's role in society.

In conclusion, methyl 2,3,5,6-tetrachloro-4-methylsulfanylcarbonyl-benzoate is not only an interesting compound from a chemical synthesis standpoint but also raises important questions about safety, regulation, and environmental impact. As we delve deeper into its properties, we unravel the intricate balance between chemical benefits and ecological responsibilities.

Synonyms
GLENBAR
O,S-Dimethyltetrachlorothioterephthalate
OCS 21944
OCS-21,944
HSDB 1419
UNII-5GVL0P8GXB
BRN 2059752
O,S-Dimethylester kyseliny tetrachlorthiotereftalove
O,S-Dimethylester kyseliny tetrachlorthiotereftalove [Czech]
DTXSID70191075
O,S-DIMETHYLTETRACHLOROTHIOTEREPHTHALATE [HSDB]
Methyl 2,3,5,6-tetrachloro-4-[(methylsulfanyl)carbonyl]benzoate
Methyl 2,3,5,6-tetrachloro-4-((methylsulfanyl)carbonyl)benzoate
DTXCID80113566
OCS21,944
O,SDimethyltetrachlorothioterephthalate
O,SDimethyl tetrachlorothioterephthalate
O,SDimethylester kyseliny tetrachlorthiotereftalove
Tetrachlorothioterephthalic acid O,Sdimethyl ester
Terephthalic acid, tetrachlorothio, O,Sdimethyl ester
Thioterephthalic acid, tetrachloro, O,Sdimethyl ester
Benzoic acid, 2,3,5,6tetrachloro4((methylthio)carbonyl), methyl ester
kndxzfmnqksihu-uhfffaoysa-n
DTMT
3765-57-9
O,S-Dimethyl tetrachlorothioterephthalate
Terephthalic acid, tetrachlorothio-, O,S-dimethyl ester
Thioterephthalic acid, tetrachloro-, O,S-dimethyl ester
5GVL0P8GXB
Tetrachlorothioterephthalic acid O,S-dimethyl ester
Benzoic acid, 2,3,5,6-tetrachloro-4-((methylthio)carbonyl)-, methyl ester
Benzoic acid, 2,3,5,6-tetrachloro-4-[(methylthio)carbonyl]-, methyl ester
SCHEMBL11445140
Q27262146
2,3,5,6-Tetrachloro-4-(methylthio)carbonylbenzenecarboxylic acid methyl ester