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CS-W001157 4
Total: USD 88.00

3-Hydroxythiophene-2-carboxylic acid

  • CAS No. 5118-07-0

  • Cat. No. CS-0096798
  • Purity≥97%
  • MDL No.MFCD09414719

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

3-Hydroxythiophene-2-carboxylic acid|CS-0096798

Structure of 5118-07-0

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General Information

  • CAS No. 5118-07-0
  • Cat. No. CS-0096798
  • Purity ≥97%
  • MDL No. MFCD09414719
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₅H₄O₃S
  • Molecular Weight 144.15
  • Synonym(s) 2-Thiophenecarboxylicacid,3-hydroxy
  • SMILES O=C(C1=C(O)C=CS1)O

Synthesis

  • Route1
    • 3-(Benzyloxy)thiophene-2-carboxylic acid|CS-0318382
      186588-88-5
    • ~98%
    • 3-Hydroxythiophene-2-carboxylic acid|CS-0096798
      5118-07-0

    References

    • AstraZeneca Patent: WO2007/1225 A1, 2007 ; Location in patent: Page/Page column 16 ; WO 2007/001225 A1
  • Route2

    References

    • AVENTIS PHARMA DEUTSCHLAND GMBH Patent: WO2004/7517 A1, 2004 ; Location in patent: Page/Page column 66 ;
  • Route3
    • Ethyl 3-hydroxythiophene-2-carboxylate|CS-0582436
      2158-88-5
    • ~%
    • 3-Hydroxythiophene-2-carboxylic acid|CS-0096798
      5118-07-0

    References

    • Fiesselmann; Pfeiffer Chemische Berichte, 1954 , vol. 87, p. 848,855

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-P280-P302+P352

Quality Control

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Computational Chemistry Data

  • TPSA   57.53
  • LogP   1.1519
  • H_Acceptors   3
  • H_Donors   2
  • Rotatable_Bonds   1

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