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UMEBRA

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Identification
Molecular formula
C42H58Br2N2O6
CAS number
229305-45-1
IUPAC name
(2-acetoxycyclohexyl)methyl-[2-[4-[4-[2-[(2-acetoxycyclohexyl)methyl-dimethyl-ammonio]-2-oxo-ethyl]phenyl]phenyl]acetyl]-dimethyl-ammonium;dibromide
State
State

In its physical state at room temperature, (2-acetoxycyclohexyl)methyl-[2-[4-[4-[2-[(2-acetoxycyclohexyl)methyl-dimethyl-ammonio]-2-oxo-ethyl]phenyl]phenyl]acetyl]-dimethyl-ammonium;dibromide is generally a solid. This stability at ambient conditions makes it convenient for storage and handling, provided it is safeguarded from excessive moisture and temperature fluctuations.

Melting point (Celsius)
120.00
Melting point (Kelvin)
393.15
Boiling point (Celsius)
312.00
Boiling point (Kelvin)
585.15
General information
Molecular weight
749.60g/mol
Molar mass
749.5960g/mol
Density
1.2400g/cm3
Appearence

The compound is typically in the form of a crystalline solid. It has no distinct color, appearing white or off-white based on the purity of the substance. Handling often requires care to maintain the integrity of its structure due to its hygroscopic nature, meaning it readily absorbs moisture from the environment.

Comment on solubility

Solubility of (2-acetoxycyclohexyl)methyl-[2-[4-[4-[2-[(2-acetoxycyclohexyl)methyl-dimethyl-ammonio]-2-oxo-ethyl]phenyl]phenyl]acetyl]-dimethyl-ammonium;dibromide

The solubility of a compound can significantly influence its applications and behavior in various environments. In the case of (2-acetoxycyclohexyl)methyl-[2-[4-[4-[2-[(2-acetoxycyclohexyl)methyl-dimethyl-ammonio]-2-oxo-ethyl]phenyl]phenyl]acetyl]-dimethyl-ammonium; dibromide, the following considerations are crucial:

  • Polarity: This compound exhibits properties of both polarity and non-polarity due to its structural components, affecting its solubility in different solvents.
  • Solvent Compatibility: It is likely to have higher solubility in polar solvents such as water, while its non-polar sections may limit solubility in organic solvents.
  • Ionic Nature: Being a quaternary ammonium compound, the presence of the dibromide moiety suggests that it may dissociate in polar solvents, potentially enhancing solubility.

However, the actual solubility can be further influenced by factors such as:

  • Temperature: Generally, solubility increases with temperature for most substances, but the specific behavior can vary.
  • pH of the Solution: Since the compound contains amino and bromide groups, changes in pH may affect its ionization and hence its solubility.
  • Presence of Other Ions: The presence of competing ions in a solution can also impact the solubility behavior of this compound.

In summary, while one can hypothesize about the solubility of this complex compound based on its ionic nature and structural features, experimental validation is essential to determine its precise solubility characteristics in various solvents and conditions.

Interesting facts

Interesting Facts about (2-acetoxycyclohexyl)methyl-[2-[4-[4-[2-[(2-acetoxycyclohexyl)methyl-dimethyl-ammonio]-2-oxo-ethyl]phenyl]phenyl]acetyl]-dimethyl-ammonium;dibromide

This compound, though complex in structure, opens a window into the fascinating world of organic chemistry and pharmaceutical applications. Let's explore some captivating aspects:

  • Unique Composition: The presence of both acetoxy and dimethylammonium groups in the structure contributes to its intriguing biological activity, potentially enhancing the compound’s solubility and biological availability.
  • Pharmaceutical Relevance: Compounds with similar structures are often investigated for their potential use as drug delivery systems, particularly in targeting specific cells or biological pathways.
  • Mechanism of Action: Research indicates that the incorporation of ammonium ions may influence the interaction of this compound with cellular membranes, making it an interesting candidate for studying cellular transport mechanisms.
  • Structural Complexity: The intricate arrangement of phenyl and cyclohexyl groups not only adds complexity to the molecular structure but also allows for various stereochemical configurations, which could impact its biological function.
  • Potential Applications: This compound may find applications in areas such as drug design, particularly in the development of agents that can modulate biological systems or serve as novel therapeutic agents.

As we advance in the field of chemistry, understanding compounds like this offers insight into the intricacies of molecular interactions, paving the way for innovative solutions in medicine and technology. Emphasizing the structural features of such compounds allows chemists to hypothesize mechanisms of action and predict potential uses in real-world applications.

Synonyms
28003-35-2
Ammonium, (4,4'-biphenylylenebis(2-oxoethylene))bis(((2-hydroxycyclohexyl)methyl)dimethyl-, dibromide, diacetate
RefChem:318896
DTXSID90950686
2,2'-([1,1'-Biphenyl]-4,4'-diyl)bis(N-{[2-(acetyloxy)cyclohexyl]methyl}-N,N-dimethylethanamidium) dibromide