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1-N-BOC-piperazine-2-carboxylic acid methyl ester

  • CAS No. 129799-15-1

  • Cat. No. CS-B0413
  • Purity≥97%
  • MDL No.MFCD01861779

*For research and further manufacturing use only, not for direct human use.

1-N-BOC-piperazine-2-carboxylic acid methyl ester|CS-B0413

Structure of 129799-15-1

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General Information

  • CAS No. 129799-15-1
  • Cat. No. CS-B0413
  • Purity ≥97%
  • MDL No. MFCD01861779
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₂₀N₂O₄
  • Molecular Weight 244.29
  • Synonym(s) N-1-BOC-2-PIPERAZINECARBOXYLIC ACID METHYL ESTER
  • SMILES O=C(OC(C)(C)C)N1C(CNCC1)C(OC)=O

Description

This methyl ester derivative of 1-N-BOC-piperazine-2-carboxylic acid features a protected piperazine core with a sterically accessible carboxylate handle. It integrates readily into peptide and macrocyclic syntheses, offering a stable, moisture-tolerant scaffold for C-terminal functionalization.

Application

1-N-BOC-piperazine-2-carboxylic acid methyl ester serves as a versatile building block for the synthesis of piperazine-based pharmaceutical intermediates. The BOC-protected amine and ester functionalities enable orthogonal manipulation, facilitating downstream derivatization in multistep syntheses. Its bench-stable nature and compatibility with standard coupling and reduction protocols make it well-suited for medicinal chemistry campaigns requiring precise heterocyclic scaffold elaboration.

Synthesis

  • Route1

    References

    • Bischoff, Alexander; Subramanya, Hosahalli; Sundaresan, Kumar; Sammeta, Srinivasa Raju; Vaka, Anil Kumar Patent: US2010/160323 A1, 2010 ; Location in patent: Page/Page column 47 ; US 20100160323 A1

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   67.87
  • LogP   0.3683
  • H_Acceptors   5
  • H_Donors   1
  • Rotatable_Bonds   1

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