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CAS 863111-55-1

:

1-Iodo-2-methyl-3-(trifluoromethyl)benzene

Description:
1-Iodo-2-methyl-3-(trifluoromethyl)benzene, with the CAS number 863111-55-1, is an aromatic compound characterized by the presence of an iodine atom, a methyl group, and a trifluoromethyl group attached to a benzene ring. This compound features a molecular structure that includes a benzene ring substituted at the 1, 2, and 3 positions, which influences its chemical reactivity and physical properties. The iodine substituent typically enhances the compound's reactivity in nucleophilic substitution reactions, while the trifluoromethyl group can impart unique electronic properties, making it a valuable building block in organic synthesis and medicinal chemistry. The presence of fluorine atoms contributes to the compound's lipophilicity and stability, affecting its solubility in various solvents. Additionally, the compound may exhibit interesting biological activities, making it of interest in pharmaceutical research. Overall, 1-Iodo-2-methyl-3-(trifluoromethyl)benzene is a versatile compound with potential applications in various fields, including materials science and drug development.
Formula:C8H6F3I
InChI:InChI=1S/C8H6F3I/c1-5-6(8(9,10)11)3-2-4-7(5)12/h2-4H,1H3
InChI key:InChIKey=RGOUOPUELKSWEC-UHFFFAOYSA-N
SMILES:C(F)(F)(F)C1=C(C)C(I)=CC=C1
Synonyms:
  • 3-Iodo-2-methylbenzotrifluoride
  • Benzene, 1-iodo-2-methyl-3-(trifluoromethyl)-
  • 1-Iodo-2-methyl-3-(trifluoromethyl)benzene
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