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1-(tert-Butoxycarbonyl)-2,5-dihydro-1H-pyrrole-3-carboxylic acid

  • CAS No. 1499189-46-6

  • Cat. No. CS-0077677
  • Molecule weight213.23
  • Purity≥95%
  • MDL No.MFCD28965055

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

1-(tert-Butoxycarbonyl)-2,5-dihydro-1H-pyrrole-3-carboxylic acid|CS-0077677

Structure of 1499189-46-6

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General Information

  • CAS No. 1499189-46-6
  • Cat. No. CS-0077677
  • Purity ≥95%
  • MDL No. MFCD28965055
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₅NO₄
  • Molecular Weight 213.23
  • Synonym(s) None
  • SMILES O=C(O)C1=CCN(C(OC(C)(C)C)=O)C1

Description

This protected pyrrole carboxylic acid features a tert-butyl carbamate group that enables stable, orthogonal functionalization in peptide and heterocyclic synthesis. The dihydro-pyrrole scaffold provides a reactive platform for transition-metal-catalyzed couplings and cycloadditions under mild conditions.

Application

1-(tert-Butoxycarbonyl)-2,5-dihydro-1H-pyrrole-3-carboxylic acid serves as a versatile building block for the synthesis of pyrrolidine-based scaffolds and bioactive molecules. The tert-butyl ester group provides excellent bench stability and facilitates straightforward deprotection under mild acidic conditions. It functions as a key intermediate in the construction of heterocyclic frameworks via standard coupling reactions and enables efficient incorporation into peptide-like structures and medicinal chemistry campaigns.

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-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   66.84
  • LogP   1.2481
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   1

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