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Diallate

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Identification
Molecular formula
C10H17Cl2NOS
CAS number
2303-16-4
IUPAC name
S-(2,3-dichloroallyl) N,N-diisopropylcarbamothioate
State
State

At room temperature, diallate is a liquid. It is stable under standard conditions but should be stored in a cool, dry place, away from sources of ignition and incompatible substances.

Melting point (Celsius)
-20.00
Melting point (Kelvin)
253.15
Boiling point (Celsius)
140.00
Boiling point (Kelvin)
413.15
General information
Molecular weight
249.21g/mol
Molar mass
249.2070g/mol
Density
1.1630g/cm3
Appearence

Diallate appears as a colorless to slightly yellow liquid. It may have a faint garlic-like odor due to its chemical structure.

Comment on solubility

Solubility of S-(2,3-dichloroallyl) N,N-diisopropylcarbamothioate

The solubility of S-(2,3-dichloroallyl) N,N-diisopropylcarbamothioate can be intriguing given its unique structure. Generally, the solubility of a compound depends on several factors, including:

  • Polarity: The presence of polar functional groups often increases solubility in polar solvents, while non-polar structures are better solubilized in non-polar solvents.
  • Hydrogen Bonding: Compounds capable of forming hydrogen bonds tend to have higher solubility in water.
  • Molecular Size: Smaller molecules usually exhibit higher solubility compared to larger, bulkier ones.

In the case of S-(2,3-dichloroallyl) N,N-diisopropylcarbamothioate, its unique thioate structure and dichloro substituents suggest that:

  • It may show limited solubility in water due to the bulky isopropyl groups and the overall hydrophobic character.
  • It could be more soluble in organic solvents such as acetone or ethanol, where non-polar interactions can prevail.

Research indicates that compounds with similar functionalities often exhibit variable solubility, thus experimental determination is key. As always, "the solution to the solubility puzzle often lies within the molecular architecture of the compound itself."

Interesting facts

Interesting Facts about S-(2,3-Dichloroallyl) N,N-Diisopropylcarbamothioate

S-(2,3-Dichloroallyl) N,N-diisopropylcarbamothioate is a fascinating chemical compound that belongs to the class of carbamothioates, which are recognized for their diverse applications.

Key Features

  • A versatile molecular structure: This compound is notable for its unique combination of functional groups, including the thiolate and chloro groups, which significantly influence its reactivity.
  • Herbicidal Activity: It is known primarily for its use in agriculture as a herbicide. Its ability to inhibit the growth of unwanted plants makes it a valuable tool in crop management.
  • Synthesis and Applications: The synthesis of this compound involves the reaction of thiolates, which can be done under controlled conditions to achieve desired yields and purity.
  • Environmental Impact: Understanding the degradation pathway of this compound is critical, as residues may affect soil health and local ecosystems.

Moreover, chemical compounds like S-(2,3-Dichloroallyl) N,N-diisopropylcarbamothioate illustrate the intricate balance between utility and safety. As Dr. Jane Goodall once said, "What you do makes a difference, and you have to decide what kind of difference you want to make." This compound, like many others, poses questions about its impact on both pest control and environmental sustainability.

Conclusion

As a student or researcher, exploring compounds such as S-(2,3-Dichloroallyl) N,N-diisopropylcarbamothioate offers a perfect blend of chemistry and environmental stewardship, allowing for a deeper understanding of how molecular properties can influence practical applications in the real world.

Synonyms
S-(2,3-dichloroprop-2-enyl) N,N-di(propan-2-yl)carbamothioate
Diallate 10 microg/mL in Cyclohexane
SCHEMBL1873360
CHEMBL3185536
DB-046059
NS00003628
NS00073909
S-2,3-dichloroallyl N,N-diisopropylthiocarbamate
Q63088175