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2-Piperazineacetic acid, 1-[(1,1-dimethylethoxy)carbonyl]-, methyl ester

  • CAS No. 183852-65-5

  • Cat. No. CS-0030209
  • Purity≥95%
  • MDL No.MFCD00674204

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

2-Piperazineacetic acid, 1-[(1,1-dimethylethoxy)carbonyl]-, methyl ester|CS-0030209

Structure of 183852-65-5

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General Information

  • CAS No. 183852-65-5
  • Cat. No. CS-0030209
  • Purity ≥95%
  • MDL No. MFCD00674204
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₂₂N₂O₄
  • Molecular Weight 258.31
  • Synonym(s) 1-Boc-2-methoxycarbonylmethylpiperazine
  • SMILES O=C(OC)CC1N(C(OC(C)(C)C)=O)CCNC1

Description

This methyl ester derivative of 2-piperazineacetic acid features a tert-butoxycarbonyl-protected amine and a terminal ester group, enabling straightforward incorporation into peptide-coupling workflows. The protected piperazine scaffold offers enhanced solubility and stability under standard conditions, facilitating its use in medicinal chemistry campaigns targeting GPCR modulators and kinase inhibitors.

Application

Methyl 2-piperazineacetic acid, 1-[(1,1-dimethylethoxy)carbonyl]-, serves as a versatile building block for the synthesis of piperazine-based pharmaceutical intermediates. The Boc-protected amine and methyl ester functionalities enable orthogonal manipulation in multi-step syntheses. Its bench-stable nature and compatibility with standard coupling and deprotection protocols facilitate efficient access to diverse heterocyclic scaffolds relevant to medicinal chemistry.

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-P330-P362-P405-P501

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Computational Chemistry Data

  • TPSA   67.87
  • LogP   0.7584
  • H_Acceptors   5
  • H_Donors   1
  • Rotatable_Bonds   2

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