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CAS 951889-56-8

:

4-Chloro-2-fluoro-δ-oxobenzenepentanoic acid

Description:
4-Chloro-2-fluoro-δ-oxobenzenepentanoic acid, with the CAS number 951889-56-8, is a chemical compound characterized by its unique functional groups and structural features. It contains a benzenoid structure substituted with a chlorine atom at the para position and a fluorine atom at the ortho position relative to the carboxylic acid group. The presence of the δ-oxobenzene moiety indicates a ketone functional group adjacent to the aromatic ring, contributing to its reactivity and potential applications in organic synthesis. This compound is likely to exhibit moderate solubility in polar solvents due to the carboxylic acid group, while the halogen substituents may influence its electronic properties and reactivity. The presence of both chlorine and fluorine can enhance its biological activity, making it of interest in pharmaceutical research. Additionally, the pentanoic acid chain adds to its molecular complexity, potentially affecting its physical properties such as melting point and boiling point. Overall, this compound's unique structure positions it as a candidate for various chemical applications, particularly in medicinal chemistry.
Formula:C11H10ClFO3
InChI:InChI=1S/C11H10ClFO3/c12-7-4-5-8(9(13)6-7)10(14)2-1-3-11(15)16/h4-6H,1-3H2,(H,15,16)
InChI key:InChIKey=BDHWHYSJITXKRD-UHFFFAOYSA-N
SMILES:C(CCCC(O)=O)(=O)C1=C(F)C=C(Cl)C=C1
Synonyms:
  • Benzenepentanoic acid, 4-chloro-2-fluoro-δ-oxo-
  • 4-Chloro-2-fluoro-δ-oxobenzenepentanoic acid
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