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CS-W001157 4
Total: USD 88.00

Ethyl 3-aminobenzo[b]thiophene-2-carboxylate

  • CAS No. 34761-09-6

  • Cat. No. CS-0042027
  • Purity≥98%
  • MDL No.MFCD00661903

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

Ethyl 3-aminobenzo[b]thiophene-2-carboxylate|CS-0042027

Structure of 34761-09-6

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General Information

  • CAS No. 34761-09-6
  • Cat. No. CS-0042027
  • Purity ≥98%
  • MDL No. MFCD00661903
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₁NO₂S
  • Molecular Weight 221.28
  • Synonym(s) ethyl 3-aminobenzothiophene-2-carboxylate
  • SMILES O=C(C1=C(N)C2=CC=CC=C2S1)OCC

Synthesis

  • Route1
    • null|null
      394-47-8
    • null|null
      623-51-8
    • ~93%
    • In-stock
      Ethyl 3-aminobenzo[b]thiophene-2-carboxylate|CS-0042027
      34761-09-6

    References

    • BAELL, Jonathan Bayldon; STREET, Ian Philip; SLEEBS, Brad Edmund Patent: WO2012/131297 A1, 2012 ; Location in patent: Page/Page column 85 ; WO 2012/131297 A1
  • Route2
    • null|null
      623-51-8
    • In-stock
      2-Nitrobenzonitrile|CS-W016340
      612-24-8
    • ~69%
    • In-stock
      Ethyl 3-aminobenzo[b]thiophene-2-carboxylate|CS-0042027
      34761-09-6

    References

    • Romagnoli, Romeo; Baraldi, Pier Giovanni; Kimatrai Salvador, Maria; Preti, Delia; Aghazadeh Tabrizi, Mojgan; Bassetto, Marcella; Brancale, Andrea; Hamel, Ernest; Castagliuolo, Ignazio; Bortolozzi, Roberta; Basso, Giuseppe; Viola, Giampietro Journal of Medicinal Chemistry, 2013 , vol. 56, # 6 p. 2606 - 2618
  • Route3
    • 2-Sulfanylbenzonitrile|CS-0209230
      34761-11-0
    • null|null
      105-36-2
    • ~79%
    • In-stock
      Ethyl 3-aminobenzo[b]thiophene-2-carboxylate|CS-0042027
      34761-09-6

    References

    • Genevois-Borella, Arielle; Vuilhorgne, Marc; Mignani, Serge Heterocycles, 2002 , vol. 57, # 2 p. 317 - 322

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-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   52.32
  • LogP   2.6602
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   2

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