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CS-W001157 4
Total: USD 88.00

methyl 5-chloro-1-benzothiophene-2-carboxylate

  • CAS No. 35212-96-5

  • Cat. No. CS-0021453
  • Molecule weight226.68
  • Purity≥98%
  • MDL No.MFCD09027104

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

methyl 5-chloro-1-benzothiophene-2-carboxylate|CS-0021453

Structure of 35212-96-5

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General Information

  • CAS No. 35212-96-5
  • Cat. No. CS-0021453
  • Purity ≥98%
  • MDL No. MFCD09027104
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₇ClO₂S
  • Molecular Weight 226.68
  • Synonym(s) 5-Chloro-benzo[b]thiophene-2-carboxylic acid methyl ester; 5-chloro-2-benzo[b]thiophenecarboxylic acid methyl ester
  • SMILES O=C(C1=CC2=CC(Cl)=CC=C2S1)OC

Synthesis

  • Route1
    • In-stock
      5-Chloro-2-nitrobenzaldehyde|CS-W007862
      6628-86-0
    • null|null
      2365-48-2
    • ~%
    • In-stock
      methyl 5-chloro-1-benzothiophene-2-carboxylate|CS-0021453
      35212-96-5

    References

    • Journal of Medicinal Chemistry, , vol. 50, # 20 p. 4793 - 4807

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+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   26.3
  • LogP   3.3413
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   1

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