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CS-W001157 4
Total: USD 88.00

Ethyl 1H-pyrrole-3-carboxylate

  • CAS No. 37964-17-3

  • Cat. No. CS-0037715
  • Purity≥98%
  • MDL No.None

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

Ethyl 1H-pyrrole-3-carboxylate|CS-0037715

Structure of 37964-17-3

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General Information

  • CAS No. 37964-17-3
  • Cat. No. CS-0037715
  • Purity ≥98%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₉NO₂
  • Molecular Weight 139.15
  • Synonym(s) 1H-PYRROLE-3-CARBOXYLIC ACID ETHYL ESTER
  • SMILES CCOC(=O)C1=CNC=C1

Description

Ethyl 1H-pyrrole-3-carboxylate is a bench-stable, moisture-tolerant heterocyclic ester featuring a pyrrole ring with an electron-rich core. This compound integrates readily into synthetic sequences requiring nitrogen-containing building blocks, serving as a direct precursor for functionalized pyrroles via hydrolysis or reduction. Its compatibility with standard organic transformations enables efficient access to bioactive scaffolds and polymer intermediates.

Application

Ethyl 1H-pyrrole-3-carboxylate serves as a versatile building block in heterocyclic synthesis, enabling efficient access to substituted pyrroles via cross-coupling, electrophilic functionalization, and transition-metal-catalyzed transformations. Its ester group facilitates derivatization while maintaining compatibility with diverse reaction conditions. The molecule exhibits excellent bench stability and is readily purified by standard chromatographic methods, making it well-suited for iterative synthetic campaigns in medicinal chemistry and process development.

Synthesis

  • Route1
    • In-stock
      Pyrrole-3-carboxylic acid|CS-W002692
      931-03-3
    • null|null
      64-17-5
    • ~79%
    • In-stock
      Ethyl 1H-pyrrole-3-carboxylate|CS-0037715
      37964-17-3

    References

    • SUGEN, INC. Patent: WO2004/14368 A1, 2004 ; Location in patent: Page/Page column 66-67 ; WO 2004/014368 A1
  • Route2
    • null|null
      38622-91-2
    • null|null
      140-88-5
    • ~88%
    • In-stock
      Ethyl 1H-pyrrole-3-carboxylate|CS-0037715
      37964-17-3

    References

    • Jin, Yun-Zhou; Fu, Da-Xu; Ma, Nan; Li, Zhan-Cheng; Liu, Quan-Hai; Xiao, Lin; Zhang, Rong-Hua Molecules, 2011 , vol. 16, # 11 p. 9368 - 9385
  • Route3
    • null|null
      131202-44-3
    • ~99%
    • In-stock
      Ethyl 1H-pyrrole-3-carboxylate|CS-0037715
      37964-17-3

    References

    • Shim, Young Key; Youn, Jung In; Chun, Jae Sang; Park, Tae Ho; Kim, Moon Hwan; Kim, Wan Joo Synthesis, 1990 , # 9 p. 753 - 754

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

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Computational Chemistry Data

  • TPSA   42.09
  • LogP   1.1914
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   2

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