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Benzalkonium chloride

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Identification
Molecular formula
C27H42ClNO2
CAS number
8001-54-5
IUPAC name
dibutyl-[3-[2-[hydroxy(phenyl)methyl]phenoxy]propyl]-methyl-ammonium
State
State

At room temperature, benzalkonium chloride is typically encountered as a liquid solution. It is highly soluble in water, which contributes to its widespread use in aqueous formulations such as disinfectants, antiseptics, and preservatives.

Melting point (Celsius)
153.00
Melting point (Kelvin)
426.00
Boiling point (Celsius)
100.00
Boiling point (Kelvin)
373.00
General information
Molecular weight
340.00g/mol
Molar mass
340.0000g/mol
Density
0.9803g/cm3
Appearence

Benzalkonium chloride appears as a white solid or a colorless to pale yellow liquid, depending on its concentration. It is often encountered as an aqueous solution. Its appearance can also be opalescent, meaning it has a milky hue that reflects light.

Comment on solubility

Solubility of Dibutyl-[3-[2-[hydroxy(phenyl)methyl]phenoxy]propyl]-methyl-ammonium

The solubility of dibutyl-[3-[2-[hydroxy(phenyl)methyl]phenoxy]propyl]-methyl-ammonium (C27H42ClNO2) can be influenced by various factors, including temperature, pH, and the presence of solvents. This compound possesses both hydrophobic and hydrophilic characteristics, which affects its behavior in different environments.

  • Hydrophobic Regions: The dibutyl and phenyl groups tend to make the compound less soluble in water, thus favoring solubility in organic solvents.
  • Hydrophilic Functionalities: The hydroxy(-OH) group can interact favorably with water, thereby enhancing solubility to some degree.
  • Solvent Effects: Solvents such as ethanol or DMSO may improve its solubility compared to water alone.

In summary, while dibutyl-[3-[2-[hydroxy(phenyl)methyl]phenoxy]propyl]-methyl-ammonium displays limited solubility in water, its dual nature allows for significant solubility in organic solvents. As one practical insight, to achieve optimal solubility, it may be beneficial to consider solvent mixtures that can balance its amphiphilic characteristics.

Interesting facts

Interesting Facts About Dibutyl-[3-[2-[hydroxy(phenyl)methyl]phenoxy]propyl]-methyl-ammonium

Dibutyl-[3-[2-[hydroxy(phenyl)methyl]phenoxy]propyl]-methyl-ammonium is a fascinating compound in the realm of chemistry, showcasing an intriguing combination of functional groups and structural properties. Here are some key points to consider:

  • Biological Relevance: This compound is noteworthy for its potential applications in biological systems, particularly as a surfactant or in drug delivery mechanisms due to its amphiphilic nature.
  • Structural Complexity: With a complex molecular architecture, this compound features a quaternary ammonium structure which enhances its solubility in organic solvents while maintaining hydrophilic properties due to the presence of hydroxyl and phenyl groups.
  • Versatile Applications: Compounds like this are often used in various fields including:
    • Pharmaceuticals
    • Cosmetics
    • Material science
  • Interaction with Membranes: The cationic nature of the ammonium group in this compound enables it to interact favorably with biological membranes, making it a candidate for studies involving cell membrane dynamics.
  • Research Prospects: Ongoing research into its functionalities could lead to innovative applications such as:
    • Drug formulations
    • Nanotechnology applications
    • Environmental remediation techniques

In summary, dibutyl-[3-[2-[hydroxy(phenyl)methyl]phenoxy]propyl]-methyl-ammonium is not just a chemical formula but a gateway to understanding complex chemical behaviors and interactions in both laboratory and real-world applications.