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CS-W001157 4
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2-[(tert-Butoxy)carbonyl]-octahydrocyclopenta[c]pyrrole-3a-carboxylic acid

  • CAS No. 1314394-96-1

  • Cat. No. CS-0057491
  • Purity≥98%
  • MDL No.MFCD20230745

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

2-[(tert-Butoxy)carbonyl]-octahydrocyclopenta[c]pyrrole-3a-carboxylic acid|CS-0057491

Structure of 1314394-96-1

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General Information

  • CAS No. 1314394-96-1
  • Cat. No. CS-0057491
  • Purity ≥98%
  • MDL No. MFCD20230745
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₂₁NO₄
  • Molecular Weight 255.31
  • Synonym(s) 2-Boc-octahydrocyclopenta[c]-pyrrole-3a-carboxylic acid
  • SMILES O=C(C1(CCC2)C2CN(C(OC(C)(C)C)=O)C1)O

Description

This protected pyrrolidine derivative features a tert-butoxycarbonyl group enabling stable incorporation into peptide syntheses. The octahydrocyclopenta[c]pyrrole scaffold provides a rigid, electron-rich core ideal for conformationally constrained analogs in medicinal chemistry and chemical biology applications.

Application

2-[(tert-Butoxy)carbonyl]-octahydrocyclopenta[c]pyrrole-3a-carboxylic acid serves as a versatile scaffold for the synthesis of pyrrolidine-based heterocycles, enabling efficient access to biologically relevant frameworks. Its tert-butyl carbamate group provides excellent stability and orthogonal deprotection compatibility, while the carboxylic acid functionality facilitates amide coupling and conjugation in peptide-like architectures. The molecule exhibits robust bench stability and clean reaction profiles, making it well-suited for iterative synthetic strategies in medicinal chemistry and process development.

Safety Information

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GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H312-H332
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P501

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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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