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CAS 126538-86-1

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1-Chloro-2-fluoro-3-iodo-5-(trifluoromethyl)benzene

Description:
1-Chloro-2-fluoro-3-iodo-5-(trifluoromethyl)benzene, with the CAS number 126538-86-1, is an aromatic halogenated compound characterized by the presence of multiple halogen substituents on a benzene ring. This compound features a chlorine atom, a fluorine atom, and an iodine atom, along with a trifluoromethyl group (-CF3) at specific positions on the benzene ring, which significantly influences its chemical properties. The presence of these electronegative halogens contributes to the compound's reactivity, making it useful in various chemical syntheses and applications, particularly in the fields of pharmaceuticals and agrochemicals. The trifluoromethyl group enhances lipophilicity and can affect the compound's biological activity. Additionally, the compound's structure suggests potential for participation in electrophilic aromatic substitution reactions, as well as nucleophilic substitutions due to the presence of the iodine atom, which is a good leaving group. Overall, this compound's unique combination of halogen substituents provides a versatile platform for further chemical modifications and applications in research and industry.
Formula:C7H2ClF4I
InChI:InChI=1S/C7H2ClF4I/c8-4-1-3(7(10,11)12)2-5(13)6(4)9/h1-2H
InChI key:InChIKey=NAWVVUAXVXAEGT-UHFFFAOYSA-N
SMILES:C(F)(F)(F)C1=CC(Cl)=C(F)C(I)=C1
Synonyms:
  • 1-Chloro-2-fluoro-3-iodo-5-(trifluoromethyl)benzene
  • Benzene, 1-chloro-2-fluoro-3-iodo-5-(trifluoromethyl)-
  • 3-Chloro-4-fluoro-5-iodotrifluoromethylbenzene
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