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CS-W001157 4
Total: USD 88.00

5-Isopropyl-1H-pyrrole-2-carboxylic acid

  • CAS No. 90607-16-2

  • Cat. No. CS-0187152
  • Molecule weightNone
  • Purity≥97%
  • MDL No.MFCD13174829

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

5-Isopropyl-1H-pyrrole-2-carboxylic acid|CS-0187152

Structure of 90607-16-2

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General Information

  • CAS No. 90607-16-2
  • Cat. No. CS-0187152
  • Purity ≥97%
  • MDL No. MFCD13174829
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₁₁NO₂
  • Molecular Weight None
  • Synonym(s) Pyrrole-2-carboxylic acid, 5-isopropyl- (7CI)
  • SMILES O=C(C1=CC=C(C(C)C)N1)O

Description

5-Isopropyl-1H-pyrrole-2-carboxylic acid features a sterically hindered isopropyl group at the 5-position, enhancing metabolic stability and modulating electronic properties. This electron-rich pyrrole scaffold integrates readily into bioactive scaffolds, enabling direct coupling in peptide and heterocyclic synthesis under standard conditions.

Application

5-Isopropyl-1H-pyrrole-2-carboxylic acid serves as a versatile building block for heterocyclic synthesis, offering a readily functionalizable pyrrole core with orthogonal reactivity. The carboxylic acid group enables direct amidation, esterification, or coupling reactions, while the isopropyl substituent provides steric bulk and enhanced metabolic stability. This compound exhibits excellent bench stability and facilitates efficient purification, making it well-suited for medicinal chemistry campaigns and process-scale applications in API development.

Safety Information

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

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Computational Chemistry Data

  • TPSA   53.09
  • LogP   1.8363
  • H_Acceptors   1
  • H_Donors   2
  • Rotatable_Bonds   2

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