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Diclobutrazole

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Identification
Molecular formula
C13H16Cl2NO2
CAS number
75736-33-3
IUPAC name
[3-[(2,4-dichlorophenoxy)methyl]oxetan-3-yl]methyl-trimethyl-ammonium;bromide
State
State

At room temperature, Diclobutrazole is typically in a solid state. It exists as a crystalline solid under standard conditions.

Melting point (Celsius)
84.00
Melting point (Kelvin)
357.15
Boiling point (Celsius)
335.00
Boiling point (Kelvin)
608.15
General information
Molecular weight
300.59g/mol
Molar mass
300.5910g/mol
Density
1.1000g/cm3
Appearence

Diclobutrazole appears as a white to off-white crystalline solid. This compound is typically available in its solid crystalline form and is characterized by its fine particulate structure.

Comment on solubility

Solubility of the Compound

The compound [3-[(2,4-dichlorophenoxy)methyl]oxetan-3-yl]methyl-trimethyl-ammonium; bromide exhibits interesting solubility characteristics that can be attributed to its unique structure. Understanding its solubility is vital for various applications, including its effectiveness in biological and chemical processes.

Key Points on Solubility:

  • Polar Nature: The presence of a quaternary ammonium group suggests that the compound is likely to be polar, enhancing its solubility in polar solvents such as water.
  • Halogen Influence: With the inclusion of the dichlorophenyl group, the solubility might be further affected. Halogen groups can alter the molecular interactions, affecting how well the compound dissolves.
  • Ionization: As a bromide salt, the overall solubility can also be influenced by the dissociation of the bromide ion in solution, contributing to its ionic character.
  • Functional Groups: The oxetane ring introduces strain, which may interact with solvent molecules differently than non-cyclic structures, potentially aiding in solubility.

Overall, the solubility of this compound is likely to be dependent on the solvent and the **temperature**, with polar solvents enhancing its solubility due to its ionic nature and polar groups. Understanding these aspects is crucial for effective utilization in chemical applications.

Interesting facts

Interesting Facts About 3-[(2,4-Dichlorophenoxy)methyl]oxetan-3-yl]methyl-trimethyl-ammonium Bromide

The compound 3-[(2,4-dichlorophenoxy)methyl]oxetan-3-yl]methyl-trimethyl-ammonium bromide is an intriguing chemical entity with important applications in various fields. Here are some fascinating insights:

1. Functionality

  • Surfactant Properties: This compound is known for its amphiphilic nature, which allows it to function as an effective surfactant. This property is vital in enhancing solubility and stability in formulations.
  • Antibacterial Activity: It exhibits significant antibacterial properties, making it valuable in disinfectants and antiseptic applications.

2. Chemical Structure

Its structure features a unique oxetane ring, which is a cyclic ether. This five-membered ring contributes to its reactivity and the complex nature of its interactions with different substances.

3. Applications

  • Pharmaceuticals: The compound holds potential in drug delivery systems due to its quaternary ammonium structure, which can enhance pharmacological properties.
  • Agriculture: Given the presence of the 2,4-dichlorophenoxy group, this compound may also play a role in agricultural chemistry, particularly in herbicide formulations.

4. Environmental Impact

As with many chemical compounds, the environmental implications of using 3-[(2,4-dichlorophenoxy)methyl]oxetan-3-yl]methyl-trimethyl-ammonium bromide are under consideration, especially its persistence and ecological effects. Research continues to evaluate its biodegradability and potential toxicology.

5. Safety Considerations

As a quaternary ammonium compound, it is essential to handle this substance with care. It is recommended to adhere to safety protocols to mitigate any risks associated with exposure.

In summary, 3-[(2,4-dichlorophenoxy)methyl]oxetan-3-yl]methyl-trimethyl-ammonium bromide is a multifaceted compound with diverse applications ranging from industry to healthcare. Its unique structural attributes and functional properties continue to inspire research and development within the scientific community.

Synonyms
HC 6017
4034-08-6
((3-((2,4-Dichlorophenoxy)methyl)-3-oxetanyl)methyl)trimethylammonium bromide
3-Oxetanemethanaminium, 3-((2,4-dichlorophenoxy)methyl)-N,N,N-trimethyl-, bromide
Ammonium, ((3-((2,4-dichlorophenoxy)methyl)-3-oxetanyl)methyl)trimethyl-, bromide
DTXSID90960765
{3-[(2,4-Dichlorophenoxy)methyl]oxetan-3-yl}-N,N,N-trimethylmethanaminium bromide