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CAS 176508-81-9

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4-Cyano-3-fluorobenzoic acid

Description:
4-Cyano-3-fluorobenzoic acid is an aromatic compound characterized by the presence of a cyano group (-CN) and a fluorine atom (-F) attached to a benzoic acid structure. This compound features a carboxylic acid functional group (-COOH), which contributes to its acidic properties. The cyano group introduces a strong electron-withdrawing effect, enhancing the acidity of the carboxylic acid. The fluorine atom, being highly electronegative, can influence the compound's reactivity and polarity. 4-Cyano-3-fluorobenzoic acid is typically a solid at room temperature and may exhibit moderate solubility in polar solvents due to its polar functional groups. It is often used in organic synthesis and may serve as an intermediate in the production of pharmaceuticals or agrochemicals. The compound's unique combination of functional groups allows for various chemical reactions, including nucleophilic substitutions and coupling reactions, making it valuable in synthetic organic chemistry. Safety data should be consulted for handling, as with any chemical substance, to ensure proper precautions are taken.
Formula:C8H4FNO2
InChI:InChI=1/C8H4FNO2/c9-7-3-5(8(11)12)1-2-6(7)4-10/h1-3H,(H,11,12)
InChI key:InChIKey=ZWKNDLMYSLLMRF-UHFFFAOYSA-N
SMILES:C(O)(=O)C1=CC(F)=C(C#N)C=C1
Synonyms:
  • 3-Fluoro-4-Cyanobenzoic acid
  • Benzoic acid, 4-cyano-3-fluoro-
  • 4-Cyano-3-fluorobenzoic acid
  • 4-Cyabo-3-fluorobenzoic acid
  • 3-FLUORO-4-CYANOBENZOIC ACID,98+%
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