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CS-W001157 4
Total: USD 88.00

Methyl 3-amino-4-chloro-1-benzothiophene-2-carboxylate

  • CAS No. 35212-86-3

  • Cat. No. CS-0213488
  • Purity≥98%
  • MDL No.MFCD01566406

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

Methyl 3-amino-4-chloro-1-benzothiophene-2-carboxylate|CS-0213488

Structure of 35212-86-3

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General Information

  • CAS No. 35212-86-3
  • Cat. No. CS-0213488
  • Purity ≥98%
  • MDL No. MFCD01566406
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₈ClNO₂S
  • Molecular Weight 241.69
  • Synonym(s) Methyl 3-aMino-4-chlorobenzo[b]thiophene-2-carboxylate
  • SMILES COC(=O)C1=C(C2=C(C=CC=C2S1)Cl)N

Synthesis

  • Route1
    • 2-Chloro-6-nitrobenzonitrile|CS-W017085
      6575-07-1
    • null|null
      2365-48-2
    • ~87%
    • In-stock
      Methyl 3-amino-4-chloro-1-benzothiophene-2-carboxylate|CS-0213488
      35212-86-3

    References

    • KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY Patent: WO2009/48274 A2, 2009 ; Location in patent: Page/Page column 23 ;
  • Route2

    References

    • Liebigs Annalen der Chemie, , # 5 p. 768 - 778
  • Route3
    • null|null
      96-34-4
    • In-stock
      4-Chlorobenzo[d]isothiazole|CS-0961433
      25380-61-4
    • ~%
    • In-stock
      Methyl 3-amino-4-chloro-1-benzothiophene-2-carboxylate|CS-0213488
      35212-86-3

    References

    • Liebigs Annalen der Chemie, , # 5 p. 768 - 778

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   52.32
  • LogP   2.9235
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   1

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