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CAS 221121-36-4

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Ethyl 3-fluoro-β-oxobenzenebutanoate

Description:
Ethyl 3-fluoro-β-oxobenzenebutanoate is an organic compound characterized by its ester functional group, which is derived from the reaction of an alcohol and a carboxylic acid. This compound features a fluoro substituent, which can influence its reactivity and physical properties, such as polarity and boiling point. The presence of the β-oxo group indicates that it contains a carbonyl (C=O) adjacent to a carbon atom that is part of a benzene ring, contributing to its potential as a building block in organic synthesis. The ethyl group enhances its solubility in organic solvents and may affect its volatility. Additionally, the compound's structure suggests potential applications in pharmaceuticals or agrochemicals, where fluorinated compounds are often valued for their biological activity and stability. As with many organic compounds, its reactivity can be influenced by the presence of functional groups, making it a candidate for various chemical reactions, including nucleophilic substitutions and condensation reactions. Safety and handling precautions should be observed due to its chemical nature.
Formula:C12H13FO3
InChI:InChI=1/C12H13FO3/c1-2-16-12(15)8-11(14)7-9-4-3-5-10(13)6-9/h3-6H,2,7-8H2,1H3
InChI key:InChIKey=WLQMLHGMFCBMLJ-UHFFFAOYSA-N
SMILES:C(C(CC(OCC)=O)=O)C1=CC(F)=CC=C1
Synonyms:
  • 4-(3-Fluoro-phenyl)-3-oxo-butyric acid ethyl ester
  • 4-(3-Fluorophenyl)-3-oxobutyric acid ethyl ester
  • Benzenebutanoic acid, 3-fluoro-β-oxo-, ethyl ester
  • Ethyl 3-fluoro-β-oxobenzenebutanoate
  • Ethyl 4-(3-Fluorophenyl)-3-oxobutanoate
  • CHEMBRDG-BB 4002002
  • ethyl 4-(3-fluorophenyl)-3-oxobutanoate(SALTDATA: FREE)
  • 4-(3-Fluorophenyl)-3-oxobutanoic acid ethyl ester
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