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3-(1h-Pyrrol-1-yl)thiophene-2-carboxylic acid

  • CAS No. 74772-17-1

  • Cat. No. CS-0243628
  • Purity≥95%
  • MDL No.None

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

3-(1h-Pyrrol-1-yl)thiophene-2-carboxylic acid|CS-0243628

Structure of 74772-17-1

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General Information

  • CAS No. 74772-17-1
  • Cat. No. CS-0243628
  • Purity ≥95%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₇NO₂S
  • Molecular Weight 193.22
  • Synonym(s) 3-(1H-PYRROL-1-YL)-2-THIOPHENECARBOXYLIC ACID
  • SMILES C1=CN(C=C1)C2=C(C(=O)O)SC=C2

Synthesis

  • Route1
    • Methyl 3-(1H-pyrrol-1-yl)thiophene-2-carboxylate|CS-0314570
      74772-16-0
    • ~74%
    • 3-(1h-Pyrrol-1-yl)thiophene-2-carboxylic acid|CS-0243628
      74772-17-1

    References

    • Adir et Compagnie Patent: US5627203 A1, 1997 ;
  • Route2

    References

    • Journal of Medicinal Chemistry, , vol. 39, # 10 p. 2068 - 2080

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-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   42.23
  • LogP   2.237
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   2

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