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Benzalkonium chloride

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Identification
Molecular formula
C27H42ClNO2
CAS number
8001-54-5
IUPAC name
benzyl-dimethyl-[2-[2-[3-methyl-4-(1,1,3,3-tetramethylbutyl)phenoxy]ethoxy]ethyl]ammonium
State
State

At room temperature, benzalkonium chloride is commonly encountered as a liquid in solutions. In its pure form, it can be a solid.

Melting point (Celsius)
-20.00
Melting point (Kelvin)
253.15
Boiling point (Celsius)
100.00
Boiling point (Kelvin)
373.15
General information
Molecular weight
340.29g/mol
Molar mass
340.2870g/mol
Density
0.9800g/cm3
Appearence

Benzalkonium chloride tends to be a white or yellowish-white waxy solid. It can also appear as a colorless to pale yellow liquid. In aqueous solutions, it is often seen as a transparent liquid due to its solubility in water.

Comment on solubility

Solubility of Benzyl-Dimethyl-[2-[2-[3-Methyl-4-(1,1,3,3-tetramethylbutyl)phenoxy]ethoxy]ethyl]ammonium

Benzyl-dimethyl-[2-[2-[3-methyl-4-(1,1,3,3-tetramethylbutyl)phenoxy]ethoxy]ethyl]ammonium is a fascinating compound in terms of solubility, which can largely be attributed to its complex structure. Understanding its solubility involves considering several factors:

  • Polar vs Non-polar Characteristics: The presence of both polar and non-polar groups in the molecule affects its overall solubility. The long hydrocarbon chain provides hydrophobic character, while the ammonium group introduces hydrophilicity.
  • Solvent Interaction: This compound is typically soluble in polar organic solvents such as methanol or ethanol, owing to its ionic ammonium moiety.
  • Temperature Effects: Like many chemical substances, its solubility may increase with temperature, enhancing its interaction with the solvent.
  • pH Dependency: The solubility of ammonium-based compounds can be influenced by changes in pH, potentially altering the ionization state and thus altering its solubility profile.

In conclusion, the solubility of this compound is not merely a function of its chemical structure, but rather a complex interplay of multiple factors. As stated, "Understanding solubility requires not only consideration of molecular interactions but also the environmental conditions surrounding the compound." This highlights the necessity of assessing solubility on a case-by-case basis, particularly for intricate compounds like benzyl-dimethyl-[2-[2-[3-methyl-4-(1,1,3,3-tetramethylbutyl)phenoxy]ethoxy]ethyl]ammonium.

Interesting facts

Interesting Facts about Benzyl-dimethyl-[2-[2-[3-methyl-4-(1,1,3,3-tetramethylbutyl)phenoxy]ethoxy]ethyl]ammonium

Benzyl-dimethyl-[2-[2-[3-methyl-4-(1,1,3,3-tetramethylbutyl)phenoxy]ethoxy]ethyl]ammonium is a fascinating compound with a diverse range of applications primarily in the realm of chemistry and pharmacy. Here are some intriguing aspects of this compound:

  • Amphiphilic Nature: This compound exhibits amphiphilic characteristics, which means it has both hydrophilic (water-attracting) and hydrophobic (water-repelling) parts. This property plays a crucial role in its functionality, particularly in surfactant applications.
  • Potential Biological Applications: Due to its quaternary ammonium structure, this compound may have antimicrobial properties. It is often investigated for use in formulations aimed at combating bacteria and fungi.
  • Versatile Reactivity: The presence of functional groups such as benzyl and dimethyl allows for versatile reactivity, making it a potential candidate for various chemical reactions, including nucleophilic substitutions and polymerizations.
  • Role in Drug Delivery: The structural complexity of this compound may facilitate its use in drug delivery systems, enhancing the solubility and bioavailability of pharmaceutical agents.
  • Critical Micelle Concentration (CMC): As a surfactant, understanding its CMC is essential. Below this concentration, the compound exists as individual molecules, while above it, it forms micelles, a critical aspect for applications in detergency and emulsification.

In summary, benzyl-dimethyl-[2-[2-[3-methyl-4-(1,1,3,3-tetramethylbutyl)phenoxy]ethoxy]ethyl]ammonium captivates researchers and students alike with its unique properties and broad application potential across various fields of chemistry. As Richard Feynman famously stated, “What I cannot create, I do not understand,” emphasizing the importance of understanding the intricate details of such compounds.

Synonyms
UNII-512838GU34
Benzyldimethyl(2-(2-((4-(1,1,3,3-tetramethylbutyl)-m-tolyl)oxy)ethoxy)ethyl)ammonium
58431-62-2
512838GU34
BENZENEMETHANAMINIUM, N,N-DIMETHYL-N-(2-(2-(3-METHYL-4-(1,1,3,3-TETRAMETHYLBUTYL)PHENOXY)ETHOXY)ETHYL)-
CHEMBL2366022
DTXSID20110039
Q27260848
N-benzyl-N,N-dimethyl-2-{2-[3-methyl-4-(2,4,4-trimethylpentan-2-yl)phenoxy]ethoxy}ethanaminium