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CAS 193818-13-2

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3-[4-(tertbutoxycarbonyl)piperazin-1-yl]benzoic acid

Description:
3-[4-(tert-Butoxycarbonyl)piperazin-1-yl]benzoic acid is a chemical compound characterized by its structure, which includes a benzoic acid moiety and a piperazine ring substituted with a tert-butoxycarbonyl (Boc) group. The presence of the benzoic acid functional group imparts acidic properties, allowing it to participate in various chemical reactions, such as esterification or amidation. The piperazine ring contributes to the compound's potential biological activity, as piperazine derivatives are often found in pharmaceuticals. The tert-butoxycarbonyl group serves as a protective group for amines, facilitating the synthesis of more complex molecules by preventing unwanted reactions. This compound is typically used in organic synthesis and medicinal chemistry, particularly in the development of drug candidates. Its solubility and stability can vary depending on the solvent and conditions, making it important to consider these factors during experimental procedures. Overall, this compound exemplifies the intersection of organic chemistry and medicinal applications, showcasing the importance of functional group manipulation in drug design.
Formula:C16H22N2O4
InChI:InChI=1/C16H22N2O4/c1-16(2,3)22-15(21)18-9-7-17(8-10-18)13-6-4-5-12(11-13)14(19)20/h4-6,11H,7-10H2,1-3H3,(H,19,20)
SMILES:CC(C)(C)OC(=O)N1CCN(CC1)c1cccc(c1)C(=O)O
Synonyms:
  • 3-(4-Boc-piperazin-1-yl)benzoic acid
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