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CAS 920023-51-4

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1,1-Dimethylethyl 4-(2-bromophenyl)-4-cyano-1-piperidinecarboxylate

Description:
1,1-Dimethylethyl 4-(2-bromophenyl)-4-cyano-1-piperidinecarboxylate, identified by its CAS number 920023-51-4, is a chemical compound that features a piperidine ring, which is a six-membered nitrogen-containing heterocycle. This compound is characterized by the presence of a cyano group (-CN) and a bromophenyl substituent, which contribute to its reactivity and potential biological activity. The tert-butyl group (1,1-dimethylethyl) enhances the lipophilicity of the molecule, potentially influencing its solubility and permeability in biological systems. The presence of the cyano group may also impart unique electronic properties, making it a candidate for various chemical reactions, including nucleophilic substitutions. This compound may be of interest in medicinal chemistry for its potential pharmacological properties, although specific biological activities would require further investigation. Overall, its structural features suggest it could be utilized in synthetic organic chemistry or as a lead compound in drug development.
Formula:C17H21BrN2O2
InChI:InChI=1S/C17H21BrN2O2/c1-16(2,3)22-15(21)20-10-8-17(12-19,9-11-20)13-6-4-5-7-14(13)18/h4-7H,8-11H2,1-3H3
InChI key:InChIKey=GFNKYSDJZBSDQR-UHFFFAOYSA-N
SMILES:C(#N)C1(CCN(C(OC(C)(C)C)=O)CC1)C2=C(Br)C=CC=C2
Synonyms:
  • 1,1-Dimethylethyl 4-(2-bromophenyl)-4-cyano-1-piperidinecarboxylate
  • 1-Piperidinecarboxylic acid, 4-(2-bromophenyl)-4-cyano-, 1,1-dimethylethyl ester
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