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Benzodioxole-chlorofluorophenylpropenone

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Identification
Molecular formula
C16H10ClFO3
CAS number
83723-23-7
IUPAC name
1-(1,3-benzodioxol-5-yl)-3-(2-chloro-4-fluoro-phenyl)prop-2-en-1-one
State
State

At room temperature, this compound exists as a solid due to its relatively high molecular weight and specific intermolecular interactions.

Melting point (Celsius)
93.00
Melting point (Kelvin)
366.15
Boiling point (Celsius)
418.00
Boiling point (Kelvin)
691.15
General information
Molecular weight
290.71g/mol
Molar mass
290.7100g/mol
Density
1.2950g/cm3
Appearence

This compound typically appears as a yellow crystalline powder. The yellow color arises due to the extended conjugation in the molecule, affecting its electronic properties and absorption spectrum.

Comment on solubility

Solubility of 1-(1,3-benzodioxol-5-yl)-3-(2-chloro-4-fluoro-phenyl)prop-2-en-1-one

The solubility of the compound 1-(1,3-benzodioxol-5-yl)-3-(2-chloro-4-fluoro-phenyl)prop-2-en-1-one is influenced by its unique molecular structure that includes both hydrophobic and hydrophilic components. The varying properties can lead to interesting results regarding its solubility in different solvents.

Key Solubility Factors:

  • Molecular Structure: The presence of the 1benzodioxole and halogen substituents contributes to the potential for varying solubility based on polarity.
  • Solvent Interaction: This compound may display increased solubility in organic solvents such as ethanol and DMSO compared to polar solvents like water.
  • Temperature Dependence: Solubility might increase with temperature, making heat a factor in its application.
  • pH Sensitivity: The solubility can also be influenced by the pH of the solution, affecting ionization and solubility behavior.

In summary, while the solubility profile can vary widely, it is generally observed that the balance of hydrophobic and hydrophilic characteristics plays a crucial role. As a rule of thumb, non-polar compounds tend to be less soluble in polar solvents and vice versa, making it essential to consider the solvent choice carefully when working with this compound.

Interesting facts

Interesting Facts About 1-(1,3-benzodioxol-5-yl)-3-(2-chloro-4-fluoro-phenyl)prop-2-en-1-one

This compound, widely recognized for its complex structure, belongs to a class of chemicals known as chalcones. Chalcones are characterized by their fascinating role in medicinal chemistry and are often investigated for their potential therapeutic properties.

Chemical Characteristics

1-(1,3-benzodioxol-5-yl)-3-(2-chloro-4-fluoro-phenyl)prop-2-en-1-one exhibits unique features:

  • Structural Diversity: Its structure combines a benzodioxole moiety with a substituted phenyl ring, creating a compound with diverse interactions.
  • Fluorinated Phenyl Ring: The presence of fluorine enhances lipophilicity and can influence biological activity.
  • Potential Biological Activities: Various studies suggest that chalcones possess anti-inflammatory, anti-cancer, and antimicrobial properties.

Applications in Research

This compound is not just of theoretical interest; it has practical applications too:

  • Pharmaceutical Development: Researchers often explore its derivatives for drug development due to their favorable biological activity.
  • Natural Product Synthesis: Chalcones serve as intermediates in synthesizing more complex natural products.
  • Chemosensitization: Some studies highlight their role in enhancing the efficacy of existing treatments in cancer therapy.

Conclusion

In summary, 1-(1,3-benzodioxol-5-yl)-3-(2-chloro-4-fluoro-phenyl)prop-2-en-1-one is an intriguing compound with rich potential for future research and applications. As the field of medicinal chemistry continues to evolve, compounds like this may play a pivotal role in developing new therapies, showcasing the importance of studying chemical structures in depth. Remember the words of renowned chemist Marie Curie: “Nothing in life is to be feared, it is only to be understood.” Embracing the complexity of compounds such as this one can lead to remarkable discoveries!