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CAS 1234615-79-2

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Phenylmethyl 3-iodo-1-pyrrolidinecarboxylate

Description:
Phenylmethyl 3-iodo-1-pyrrolidinecarboxylate, identified by its CAS number 1234615-79-2, is a chemical compound that features a pyrrolidine ring, which is a five-membered nitrogen-containing heterocycle. This compound is characterized by the presence of a phenylmethyl group and an iodo substituent at the 3-position of the pyrrolidine ring, along with a carboxylate functional group. The molecular structure suggests that it may exhibit interesting reactivity due to the presence of the iodine atom, which can participate in nucleophilic substitution reactions. Additionally, the carboxylate group can engage in various chemical interactions, including hydrogen bonding and coordination with metal ions. The compound's properties, such as solubility, boiling point, and melting point, would depend on its molecular interactions and the presence of functional groups. Overall, this compound may have potential applications in organic synthesis and medicinal chemistry, particularly in the development of pharmaceuticals or agrochemicals.
Formula:C12H14INO2
InChI:InChI=1S/C12H14INO2/c13-11-6-7-14(8-11)12(15)16-9-10-4-2-1-3-5-10/h1-5,11H,6-9H2
InChI key:InChIKey=PHSGVWBPCLSEFX-UHFFFAOYSA-N
SMILES:C(OCC1=CC=CC=C1)(=O)N2CC(I)CC2
Synonyms:
  • Phenylmethyl 3-iodo-1-pyrrolidinecarboxylate
  • 1-Pyrrolidinecarboxylic acid, 3-iodo-, phenylmethyl ester
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