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Chlorhexidine gluconate

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Identification
Molecular formula
C22H30Cl2N10
CAS number
18472-51-0
IUPAC name
2-[(5-chloro-2-tricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,11,13-hexaenyl)oxy]ethyl-dimethyl-ammonium;4-hydroxy-4-oxo-but-2-enoate
State
State

At room temperature, chlorhexidine gluconate is typically in a liquid state as it is often prepared in aqueous solutions for use in disinfectants and antiseptic products.

Melting point (Celsius)
-1.00
Melting point (Kelvin)
272.15
Boiling point (Celsius)
100.00
Boiling point (Kelvin)
373.15
General information
Molecular weight
897.77g/mol
Molar mass
897.7650g/mol
Density
1.0600g/cm3
Appearence

Chlorhexidine gluconate is typically characterized as a colorless or pale yellow liquid. It may appear slightly viscous, reflecting its formulation in various concentrations within aqueous solutions. The formulation can sometimes result in a faint medicinal odor.

Comment on solubility

Solubility of 2-[(5-chloro-2-tricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,11,13-hexaenyl)oxy]ethyl-dimethyl-ammonium;4-hydroxy-4-oxo-but-2-enoate

This compound presents an intriguing case when it comes to solubility. The overall solubility can be influenced by several factors, including its unique chemical structure and the presence of various functional groups. Here are some key points to consider:

  • Polarity: The presence of both an ammonium group and hydroxyl functionalities may increase the compound's polarity, potentially enhancing its solubility in polar solvents such as water.
  • Hydrophobic regions: On the contrary, the tricyclic structure contributes to hydrophobic characteristics, which can limit solubility in aqueous environments.
  • pH Dependency: Given that the compound includes an acidic functional group (4-hydroxy-4-oxo-but-2-enoate), the solubility may also be pH-dependent. In more acidic conditions, it might become more soluble than in neutral or basic conditions.
  • Complex Formation: This compound could potentially form complexes with other ions or molecules, which might further affect its solubility profile.

In summary, while the solubility of 2-[(5-chloro-2-tricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,11,13-hexaenyl)oxy]ethyl-dimethyl-ammonium;4-hydroxy-4-oxo-but-2-enoate seems to be a complex interplay of various factors, it is likely to exhibit moderate solubility in polar solvents, contingent upon the surrounding conditions such as pH and the presence of stabilizing agents.

Interesting facts

Interesting Facts about 2-[(5-chloro-2-tricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,11,13-hexaenyl)oxy]ethyl-dimethyl-ammonium; 4-hydroxy-4-oxo-but-2-enoate

This compound is a fascinating illustration of the intersection between organic chemistry and molecular biology. Here are some intriguing highlights:

  • Complex Structure: The presence of a tricyclic framework alongside a chlorinated moiety showcases the compound's intricate architecture, indicative of its potential in advanced materials or pharmaceuticals.
  • Therapeutic Potential: The compound's cationic form suggests it may interact favorably with various biological systems, potentially leading to applications in drug delivery where positively charged compounds aid in cellular uptake.
  • Environmental Impact: With a chlorinated structure, it is important to study the environmental fate of this compound, as chlorinated organic compounds often exhibit different degradation pathways compared to their non-chlorinated counterparts.
  • Reactivity: The presence of a but-2-enoate group implies the potential for undergoing various addition reactions, making it a valuable synthetic intermediary in creating larger, more complex molecules.
  • Research Frontiers: Ongoing studies may explore its functionalities, including its role in inhibiting certain biological pathways or serving as a scaffold for developing new therapeutic agents.

In summary, the diverse properties and potential applications of this compound highlight the importance of continued exploration in the realm of complex organic molecules. As quoted by renowned chemist Linus Pauling, "Chemistry is the science of substances: their composition, structures, properties, and the changes they undergo." This compound embodies the essence of that exploration through its complex nature and potential impact across various fields.