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CAS 620-05-3

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alpha-iodotoluene

Description:
Alpha-iodotoluene, also known as 2-iodotoluene, is an organic compound characterized by the presence of an iodine atom attached to the aromatic ring of toluene at the alpha position (the second carbon). Its molecular formula is C7H7I, and it features a benzene ring substituted with a methyl group and an iodine atom. This compound is typically a colorless to pale yellow liquid with a characteristic odor. Alpha-iodotoluene is known for its reactivity, particularly in electrophilic substitution reactions due to the electron-withdrawing nature of the iodine atom, which can influence the reactivity of the aromatic ring. It is used in organic synthesis, particularly in the preparation of various pharmaceuticals and agrochemicals. Additionally, it can serve as a reagent in coupling reactions and other transformations in synthetic organic chemistry. Safety precautions should be taken when handling this compound, as iodine is a hazardous substance, and proper storage conditions are necessary to maintain its stability and prevent degradation.
Formula:C7H7I
InChI:InChI=1/C7H7I/c8-6-7-4-2-1-3-5-7/h1-5H,6H2
InChI key:InChIKey=XJTQJERLRPWUGL-UHFFFAOYSA-N
SMILES:c1ccc(cc1)CI
Synonyms:
  • (Iodomethyl)Benzene
  • Benzene, (iodomethyl)-
  • Benzyl iodide
  • Iodophenylmethane
  • Toluene, α-iodo-
  • α-Iodotoluene
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