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CS-W001157 4
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Methyl 3-amino-5-bromobenzo[b]thiophene-2-carboxylate

  • CAS No. 1036380-75-2

  • Cat. No. CS-0039503
  • Purity≥97%
  • MDL No.None

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

Methyl 3-amino-5-bromobenzo[b]thiophene-2-carboxylate|CS-0039503

Structure of 1036380-75-2

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General Information

  • CAS No. 1036380-75-2
  • Cat. No. CS-0039503
  • Purity ≥97%
  • MDL No. None
  • Storage RT, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₈BrNO₂S
  • Molecular Weight 286.15
  • Synonym(s) Benzo[b]thiophene-2-carboxylic acid, 3-amino-5-bromo-, methyl ester
  • SMILES O=C(C1=C(N)C2=CC(Br)=CC=C2S1)OC

Synthesis

  • Route1
    • null|null
      2365-48-2
    • 5-Bromo-2-fluorobenzonitrile Olaparib Impurity|CS-0214082
      179897-89-3
    • ~96%
    • In-stock
      Methyl 3-amino-5-bromobenzo[b]thiophene-2-carboxylate|CS-0039503
      1036380-75-2

    References

    • Tao, Zhi-Fu; Hasvold, Lisa A.; Leverson, Joel D.; Han, Edward K.; Guan, Ran; Johnson, Eric F.; Stoll, Vincent S.; Stewart, Kent D.; Stamper, Geoff; Soni, Nirupama; Bouska, Jennifer J.; Luo, Yan; Sowin, Thomas J.; Lin, Nan-Horng; Giranda, Vincent S.; Rosenberg, Saul H.; Penning, Thomas D. Journal of Medicinal Chemistry, 2009 , vol. 52, # 21 p. 6621 - 6636

Safety Information

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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+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   52.32
  • LogP   3.0326
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   1

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