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CAS 1057670-02-6

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2-Chloro-1-ethynyl-4-fluorobenzene

Description:
2-Chloro-1-ethynyl-4-fluorobenzene is an organic compound characterized by its aromatic structure, which includes a benzene ring substituted with both a chloro group and a fluorine atom, as well as an ethynyl group. The presence of the ethynyl group introduces a triple bond, contributing to the compound's reactivity and potential applications in organic synthesis. This compound is typically a colorless to pale yellow liquid or solid, depending on its state at room temperature. Its molecular structure suggests it may exhibit properties such as moderate volatility and solubility in organic solvents, while being less soluble in water due to its hydrophobic aromatic nature. The chloro and fluorine substituents can influence the compound's electronic properties, potentially enhancing its reactivity in electrophilic aromatic substitution reactions. Additionally, 2-Chloro-1-ethynyl-4-fluorobenzene may have applications in pharmaceuticals, agrochemicals, or materials science, although specific uses would depend on further research and development. Safety data should be consulted for handling and potential hazards associated with this compound.
Formula:C8H4ClF
InChI:InChI=1S/C8H4ClF/c1-2-6-3-4-7(10)5-8(6)9/h1,3-5H
InChI key:InChIKey=CLQZYRBIKLGCQL-UHFFFAOYSA-N
SMILES:C(#C)C1=C(Cl)C=C(F)C=C1
Synonyms:
  • Benzene, 2-chloro-1-ethynyl-4-fluoro-
  • 2-Chloro-1-ethynyl-4-fluorobenzene
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