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CS-W001157 4
Total: USD 88.00

1-Boc-Azepane-4-carboxylic acid

  • CAS No. 868284-36-0

  • Cat. No. CS-0036627
  • Purity≥97%
  • MDL No.None

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

1-Boc-Azepane-4-carboxylic acid|CS-0036627

Structure of 868284-36-0

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General Information

  • CAS No. 868284-36-0
  • Cat. No. CS-0036627
  • Purity ≥97%
  • MDL No. None
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₂₁NO₄
  • Molecular Weight 243.30
  • Synonym(s) None
  • SMILES CC(C)(C)OC(=O)N1CCCC(CC1)C(=O)O

Description

1-Boc-Azepane-4-carboxylic acid is a bench-stable, moisture-tolerant building block featuring a protected azepane core with a carboxylic acid handle at the 4-position. This versatile scaffold integrates readily into peptide-like architectures and medicinal chemistry campaigns requiring constrained heterocyclic frameworks with tunable polarity and solubility.

Application

1-Boc-Azepane-4-carboxylic acid serves as a versatile scaffold for medicinal chemistry and process development, enabling efficient access to nitrogen-containing heterocycles. The Boc group provides excellent bench stability and orthogonal protection, facilitating selective deprotection and functionalization. It participates reliably in standard coupling reactions, amide formation, and reductive amination protocols, making it ideal for building complex molecular architectures with high reproducibility and ease of purification.

Synthesis

  • Route1

    References

    • EP1736472 A1, ; Page/Page column 14-15 ;

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

Quality Control

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Computational Chemistry Data

  • TPSA   66.84
  • LogP   2.1082
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   1

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