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Troxerutin

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Identification
Molecular formula
C33H42NO10Cl
CAS number
7085-55-4
IUPAC name
dimethyl-[3-(3-methyl-4-oxo-2-phenyl-chromene-8-carbonyl)oxypropyl]ammonium;chloride
State
State

At room temperature, troxerutin is a solid. It is typically handled and stored as a dry powder.

Melting point (Celsius)
269.00
Melting point (Kelvin)
542.15
Boiling point (Celsius)
380.00
Boiling point (Kelvin)
653.15
General information
Molecular weight
611.68g/mol
Molar mass
611.6800g/mol
Density
0.2814g/cm3
Appearence

Troxerutin appears as a yellow to greenish-yellow crystalline powder. It is often noted for its lack of significant odor and is known to be largely insoluble in water, but soluble in methanol and ethanol.

Comment on solubility

Solubility Insights on Dimethyl-[3-(3-methyl-4-oxo-2-phenyl-chromene-8-carbonyl)oxypropyl]ammonium;chloride

The solubility of the compound dimethyl-[3-(3-methyl-4-oxo-2-phenyl-chromene-8-carbonyl)oxypropyl]ammonium;chloride can be influenced by several key factors due to its complex structure. Understanding these can shed light on how this compound behaves in various solvents.

Factors Affecting Solubility

  • Polarity: The presence of both hydrophobic chromene-based moieties and hydrophilic ammonium and chloride portions plays a critical role. The balance between these regions determines solubility in polar versus non-polar solvents.
  • Temperature: Generally, as temperature increases, solubility in many solvents also increases. Thus, heating the solution may enhance the solubility of this compound.
  • pH Levels: The solubility may vary with changes in pH, particularly due to the ammonium group, which could become protonated or deprotonated based on the surrounding environment.

General Observations

In general, quaternary ammonium compounds like this one tend to exhibit good solubility in polar solvents such as water and alcohols due to their ionic nature. However, the large organic portion may impede solubility to some extent, leading to mixed results. Keep in mind the following:

  • The solubility may be higher in *aqueous solutions* due to the chloride ion's solvation.
  • In non-polar solvents, solubility could be quite *limited* owing to the increased hydrophobic character of the chromene structure.

In summary, while we can anticipate some favorable solubility characteristics due to its ionic components, the complex structure also introduces limitations, making the understanding of this compound's solubility both fascinating and intricate.

Interesting facts

Interesting Facts About Dimethyl-[3-(3-methyl-4-oxo-2-phenyl-chromene-8-carbonyl)oxypropyl]ammonium; Chloride

This fascinating compound, a quaternary ammonium derivative, stands out due to its unique structure and potential applications. Here are some interesting insights about it:

  • Structural Complexity: The compound features a complex chromene skeleton, which is known for its diverse biological activity. This contributes to its potential usefulness in pharmaceuticals and agricultural chemistry.
  • Biological Significance: Compounds containing chromene moieties often demonstrate interesting pharmacological properties, including anti-inflammatory, antioxidant, and antitumor activities. Researchers are exploring these properties for therapeutic applications.
  • Quaternary Ammonium Role: As a quaternary ammonium compound, this substance is typically used as a surfactant or antimicrobial agent. Quaternary ammonium compounds are renowned for their efficacy in various industries including healthcare for disinfection purposes.
  • Compatibility with Biological Systems: The dimethylammonium group can enhance the solubility and penetration of this compound through biological membranes, making it an interesting candidate for drug delivery systems.
  • Potential in Organic Synthesis: The presence of multiple reactive sites in its structure opens pathways for synthesizing new compounds, potentially leading to novel drugs or materials with improved properties.

In summary, Dimethyl-[3-(3-methyl-4-oxo-2-phenyl-chromene-8-carbonyl)oxypropyl]ammonium; Chloride's multifaceted nature makes it a compound of great interest in the fields of medicinal chemistry and materials science. As research continues, its full potential is yet to be discovered.

Synonyms
3468-07-3
4H-1-Benzopyran-8-carboxylic acid, 3-methyl-4-oxo-2-phenyl-, 3-(dimethylamino)propyl ester, hydrochloride
REC 7-0248