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Ethyl 5-formylthiophene-2-carboxylate

  • CAS No. 67808-65-5

  • Cat. No. CS-0377026
  • Molecule weight184.21
  • Purity≥98%
  • MDL No.None

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

Ethyl 5-formylthiophene-2-carboxylate|CS-0377026

Structure of 67808-65-5

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General Information

  • CAS No. 67808-65-5
  • Cat. No. CS-0377026
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₈O₃S
  • Molecular Weight 184.21
  • Synonym(s) None
  • SMILES O=C(C1=CC=C(C=O)S1)OCC

Synthesis

  • Route1

    References

    • Ahmed, S. Kaleem; Etoga, Jean-Louis G.; Patel, Sarjubhai A.; Bridges, Richard J.; Thompson, Charles M. Bioorganic and Medicinal Chemistry Letters, 2011 , vol. 21, # 14 p. 4358 - 4362
  • Route2

    References

    • ELI LILLY AND COMPANY Patent: EP1856090 B1, 2009 ; Location in patent: Page/Page column 49; 57 ;
  • Route3
    • 2-(Diethoxymethyl)thiophene|CS-0445686
      13959-97-2
    • null|null
      7732-18-5
    • ~%
    • Ethyl 5-formylthiophene-2-carboxylate|CS-0377026
      67808-65-5

    References

    • SRI International Patent: US4456618 A1, 1984 ;

Safety Information

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GHS Pictogram : N/A
GHS No : N/A
Signal Word : N/A
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

Quality Control

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Computational Chemistry Data

  • TPSA   43.37
  • LogP   1.7373
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   3

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