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CAS 175596-02-8

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4-Cyano-2-fluorobenzoyl chloride

Description:
4-Cyano-2-fluorobenzoyl chloride is an organic compound characterized by the presence of a cyano group (-CN), a fluorine atom, and an acyl chloride functional group. Its molecular structure features a benzene ring substituted at the 2-position with a fluorine atom and at the 4-position with a cyano group, along with a carbonyl chloride functional group. This compound is typically a colorless to pale yellow liquid or solid, depending on its physical state at room temperature. It is known for its reactivity, particularly due to the presence of the acyl chloride, which can readily undergo nucleophilic substitution reactions. The cyano group contributes to its polarity and potential for further chemical transformations, while the fluorine atom can influence the compound's electronic properties and stability. 4-Cyano-2-fluorobenzoyl chloride is utilized in various synthetic applications, including the preparation of pharmaceuticals and agrochemicals, owing to its ability to serve as an acylating agent in organic synthesis. Proper handling and storage are essential due to its reactive nature and potential hazards associated with acyl chlorides.
Formula:C8H3ClFNO
InChI:InChI=1S/C8H3ClFNO/c9-8(12)6-2-1-5(4-11)3-7(6)10/h1-3H
InChI key:InChIKey=WUFOPFHPVDSXHL-UHFFFAOYSA-N
SMILES:C(Cl)(=O)C1=C(F)C=C(C#N)C=C1
Synonyms:
  • 4-Cyano-2-fluorobenzoyl chloride
  • Benzoyl chloride, 4-cyano-2-fluoro-
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