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Doxacurium chloride

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Identification
Molecular formula
C56H78Cl2N2O16
CAS number
133814-13-2
IUPAC name
2-(2,2-diphenylacetyl)oxybutyl-diethyl-ammonium;chloride
State
State

Solid at room temperature

Melting point (Celsius)
165.00
Melting point (Kelvin)
438.15
Boiling point (Celsius)
305.00
Boiling point (Kelvin)
578.15
General information
Molecular weight
1244.46g/mol
Molar mass
1 244.4640g/mol
Density
1.2000g/cm3
Appearence

Doxacurium chloride typically appears as a white to off-white crystalline powder.

Comment on solubility

Solubility of 2-(2,2-diphenylacetyl)oxybutyl-diethyl-ammonium Chloride

The solubility of 2-(2,2-diphenylacetyl)oxybutyl-diethyl-ammonium chloride, often referred to as a quaternary ammonium compound, exhibits interesting characteristics that influence its applications in various fields. Understanding its solubility can provide insight into its behavior in different solvents and medium.

Key Factors Affecting Solubility:

  • Polarity: The presence of both hydrophobic (the diphenyl acetyl group) and hydrophilic (the quaternary ammonium structure) components can lead to varied solubility profiles. This compound may exhibit significant solubility in polar solvents like water.
  • Ionic Nature: Being a quaternary ammonium salt, it is expected to dissolve well in polar solvents due to its ionic nature, which allows for strong ion-dipole interactions.
  • Temperature: Like many chemical compounds, increased temperature can generally enhance solubility. Thus, understanding its thermal properties can be critical.
  • Concentration: The solubility can also vary with concentration, influencing its behavior in formulations or biological systems where it may be used.

In summary, 2-(2,2-diphenylacetyl)oxybutyl-diethyl-ammonium chloride is likely to be soluble in polar solvents due to its ionic characteristics, with factors such as polarity, temperature, and concentration playing significant roles in its overall solubility profile. This solubility behavior can be harnessed in applications where interaction with biological or chemical environments is necessary.

Interesting facts

Interesting Facts about 2-(2,2-Diphenylacetyl)oxybutyl-diethyl-ammonium; Chloride

2-(2,2-Diphenylacetyl)oxybutyl-diethyl-ammonium; chloride is a compound that stands out for its unique structure and potential applications. Here are some fascinating insights into this intriguing compound:

  • Pharmacological Potential: This compound has been studied for its pharmacological properties, particularly in relation to its role as an anticholinergic agent, which could pave the way for developing medications targeting conditions like asthma and motion sickness.
  • Structure-Activity Relationship: The presence of the 2,2-diphenylacetyl group in the molecular structure plays a crucial role in enhancing the compound's lipophilicity, allowing it to interact favorably with biological membranes.
  • Salification: Being a chloride salt, the ionic nature of this compound can significantly influence its solubility and bioavailability compared to its neutral counterparts. Salification is a common strategy in drug design to improve pharmacokinetic properties.
  • In Silico Studies: Computational modeling and simulations of this compound's interactions with biological targets can offer insights into its mechanism of action and help predict its behavior in physiological conditions.
  • Potential Side Effects: As with many compounds affecting neurotransmitter pathways, understanding possible side effects is crucial. Its use might lead to consequences like dry mouth, blurred vision, or heart palpitations due to anticholinergic effects.
  • Research Importance: Continued research into compounds like this one is vital for the pharmaceutical industry, especially in the context of designing new drugs with minimal side effects and high therapeutic efficacy.

This compound serves as a prime example of the intricate relationship between structure and biological activity, opening avenues for further exploration in medicinal chemistry and related fields.

Synonyms
Diphenylacetic acid 1-((diethylamino)methyl)propyl ester hydrochloride
10521-40-1
ACETIC ACID, DIPHENYL-, 1-((DIETHYLAMINO)METHYL)PROPYL ESTER, HYDROCHLORIDE