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CS-W001157 4
Total: USD 88.00

Methyl 1-benzothiophene-4-carboxylate

  • CAS No. 100590-43-0

  • Cat. No. CS-0054504
  • Purity≥98%
  • MDL No.None

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

Methyl 1-benzothiophene-4-carboxylate|CS-0054504

Structure of 100590-43-0

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General Information

  • CAS No. 100590-43-0
  • Cat. No. CS-0054504
  • Purity ≥98%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₈O₂S
  • Molecular Weight 192.23
  • Synonym(s) Methyl benzo[b]thiophene-4-carboxylate
  • SMILES COC(=O)C1=CC=CC2=C1C=CS2

Synthesis

  • Route1
    • null|null
      67-56-1
    • In-stock
      4-Bromobenzothiophene|CS-W019783
      5118-13-8
    • null|null
      201230-82-2
    • ~83%
    • In-stock
      Methyl 1-benzothiophene-4-carboxylate|CS-0054504
      100590-43-0

    References

    • Dahnke, Karl Robert; Lin, Ho-Shen; Richett, Michael Enrico; Shih, Chuan; Wang, Q May; Zhang, Bo Patent: US2008/306082 A1, 2008 ; Location in patent: Page/Page column 17 ;
  • Route2
    • null|null
      100590-46-3
    • ~27%
    • In-stock
      Methyl 1-benzothiophene-4-carboxylate|CS-0054504
      100590-43-0

    References

    • Abarca, Belen; Ballesteros, Rafael; Enriquez, Emilio; Jones, Gurnos Tetrahedron, 1985 , vol. 41, # 12 p. 2435 - 2440

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
Precautionary Statements : P261-P304+P340

Quality Control

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Computational Chemistry Data

  • TPSA   26.3
  • LogP   2.6879
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   1

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