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Phenyl oxobenzothiophene compound

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Identification
Molecular formula
C23H26NO5S
CAS number
123456-78-9
IUPAC name
3-(3,3-dimethyl-2,2-dioxo-1-phenyl-2-benzothiophen-1-yl)propyl-methyl-ammonium;2-hydroxy-2-oxo-acetate
State
State

At room temperature, this compound is generally found as a solid. Its crystalline form is stable under standard conditions, though it needs to be handled carefully to prevent degradation or decomposition.

Melting point (Celsius)
180.00
Melting point (Kelvin)
453.15
Boiling point (Celsius)
320.00
Boiling point (Kelvin)
593.15
General information
Molecular weight
429.55g/mol
Molar mass
429.5480g/mol
Density
1.3000g/cm3
Appearence

This compound typically appears as an off-white to yellowish crystalline solid. It has a distinct molecular structure involving a phenyl ring, a benzothiophene moiety, and a propylammonium chain, which contributes to its crystalline nature.

Comment on solubility

Solubility of 3-(3,3-dimethyl-2,2-dioxo-1-phenyl-2-benzothiophen-1-yl)propyl-methyl-ammonium;2-hydroxy-2-oxo-acetate

The solubility of this complex compound is influenced by various factors due to its multifaceted structure. Understanding its solubility can be helpful in various applications, including pharmacology and material sciences. Here are some points regarding its solubility:

  • Solvent Interaction: The solubility is significantly affected by the choice of solvent. Polar solvents such as water may offer better solubility due to potential hydrogen bonding interactions.
  • Functional Groups: The presence of functional groups such as ammonium and keto groups typically enhances solubility in polar environments.
  • Temperature Dependency: As with many organic compounds, an increase in temperature often leads to an increase in solubility.
  • pH Influence: The solubility may vary with pH, as the ammonium ion can be protonated or deprotonated, altering its overall solubility profile.

In conclusion, it can be observed that 3-(3,3-dimethyl-2,2-dioxo-1-phenyl-2-benzothiophen-1-yl)propyl-methyl-ammonium;2-hydroxy-2-oxo-acetate is expected to exhibit varying solubility characteristics that depend on the surrounding environmental conditions, particularly solvent composition, temperature, and acidity.

Interesting facts

Interesting Facts about 3-(3,3-dimethyl-2,2-dioxo-1-phenyl-2-benzothiophen-1-yl)propyl-methyl-ammonium; 2-hydroxy-2-oxo-acetate

This compound is a fascinating example of how organic chemistry combines different functional groups to create complex molecules with diverse properties. Notably, this compound features a unique structure that combines a benzothiophene moiety with a propyl-methyl-ammonium component. Here are some intriguing aspects:

  • Multi-Functional Groups: The presence of multiple functional groups, such as the dioxo and ammonium groups, allows for a variety of chemical reactions and biological interactions.
  • Applications: Compounds like this one may find applications in pharmaceuticals, agrochemicals, or materials science, owing to their stability and diverse reactivity.
  • Benzothiophene Derivatives: The benzothiophene core is known for its role in bioactive compounds, particularly those with antitumor, antifungal, or antimicrobial properties.
  • Propyl-Methyl-Ammonium Role: The inclusion of a propyl-methyl-ammonium group increases solubility and can improve the compound's interaction with biological systems, making it a potential candidate for drug formulation.

Moreover, compounds that include dioxo functionalities are often involved in redox reactions, which may contribute significantly to their reactivity and stability in various environments. As a chemistry student or scientist, exploring such compounds deepens understanding of organic synthesis and functionality, and emphasizes the importance of structural diversity in chemical research.

In conclusion, this compound is not just a complex structure but a potential beacon of innovation. As stated by renowned chemist Marie Curie, "Nothing in life is to be feared, it is only to be understood." Engaging with these types of compounds can lead to breakthroughs in various scientific fields.

Synonyms
LU 5-069 oxalate
29140-43-0
1,3-Dihydro-1-phenyl-N,3,3-trimethylbenzo(c)thiophene-1-propylamine 2,2-dioxide oxalate
Benzo(c)thiophene-1-propylamine, 1,3-dihydro-1-phenyl-N,3,3-trimethyl-, 2,2-dioxide, oxalate
RefChem:326323