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CS-W001157 4
Total: USD 88.00

Ethyl 1-benzothiophene-2-carboxylate

  • CAS No. 17890-55-0

  • Cat. No. CS-0206798
  • Purity≥96%
  • MDL No.MFCD00116430

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

Ethyl 1-benzothiophene-2-carboxylate|CS-0206798

Structure of 17890-55-0

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General Information

  • CAS No. 17890-55-0
  • Cat. No. CS-0206798
  • Purity ≥96%
  • MDL No. MFCD00116430
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₀O₂S
  • Molecular Weight 206.26
  • Synonym(s) Ethyl Benzo[b]thiophene-2-carboxylate
  • SMILES CCOC(=O)C1=CC2=CC=CC=C2S1

Synthesis

  • Route1
    • In-stock
      Benzo[b]thiophene|CS-D1193
      95-15-8
    • null|null
      109-94-4
    • ~74%
    • In-stock
      Ethyl 1-benzothiophene-2-carboxylate|CS-0206798
      17890-55-0

    References

    • Ushijima, Sousuke; Moriyama, Katsuhiko; Togo, Hideo Tetrahedron, 2012 , vol. 68, # 24 p. 4701 - 4709
  • Route2
    • null|null
      64-17-5
    • null|null
      201230-82-2
    • null|null
      1191415-24-3
    • ~65%
    • In-stock
      Ethyl 1-benzothiophene-2-carboxylate|CS-0206798
      17890-55-0

    References

    • Zeng, Fanlong; Alper, Howard Organic Letters, 2011 , vol. 13, # 11 p. 2868 - 2871
  • Route3
    • In-stock
      2-Fluorobenzaldehyde|CS-W008891
      446-52-6
    • null|null
      623-51-8
    • ~%
    • In-stock
      Ethyl 1-benzothiophene-2-carboxylate|CS-0206798
      17890-55-0

    References

    • Matthews, Jay M.; Qin, Ning; Colburn, Raymond W.; Dax, Scott L.; Hawkins, Mike; McNally, James J.; Reany, Laura; Youngman, Mark A.; Baker, Judith; Hutchinson, Tasha; Liu, Yi; Lubin, Mary Lou; Neeper, Michael; Brandt, Michael R.; Stone, Dennis J.; Flores, Christopher M. Bioorganic and Medicinal Chemistry Letters, 2012 , vol. 22, # 8 p. 2922 - 2926

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-P330-P362-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   26.3
  • LogP   3.078
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   2

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