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CS-W001157 4
Total: USD 88.00

3,5-Dimethylthiophene-2-carboxylic acid

  • CAS No. 65613-27-6

  • Cat. No. CS-0246262
  • Purity≥98%
  • MDL No.None

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

3,5-Dimethylthiophene-2-carboxylic acid|CS-0246262

Structure of 65613-27-6

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General Information

  • CAS No. 65613-27-6
  • Cat. No. CS-0246262
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₈O₂S
  • Molecular Weight 156.20
  • Synonym(s) None
  • SMILES CC1=C(C(=O)O)SC(=C1)C

Synthesis

  • Route1
    • null|null
      85895-83-6
    • ~56%
    • 3,5-Dimethylthiophene-2-carboxylic acid|CS-0246262
      65613-27-6

    References

    • Belen'kii; Gromova; Kolotaev; Nabatov; Krayushkin Russian Chemical Bulletin, 2005 , vol. 54, # 5 p. 1208 - 1213
  • Route2

    References

    • Gould, Norman P.; Lee, Ta-Jyh Journal of Organic Chemistry, 1980 , vol. 45, # 22 p. 4528 - 4530
  • Route3

    References

    • Lin, Ronghui; Connolly, Peter J.; Huang, Shenlin; Wetter, Steven K.; Lu, Yanhua; Murray, William V.; Emanuel, Stuart L.; Gruninger, Robert H.; Fuentes-Pesquera, Angel R.; Rugg, Catherine A.; Middleton, Steven A.; Jolliffe, Linda K. Journal of Medicinal Chemistry, 2005 , vol. 48, # 13 p. 4208 - 4211

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

Quality Control

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Computational Chemistry Data

  • TPSA   37.3
  • LogP   2.06314
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   1

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