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Ethyl 5-acetoxy-6-bromo-2-(bromomethyl)-1-methyl-1H-indole-3-carboxylate

  • CAS No. 110543-98-1

  • Cat. No. CS-0438660
  • Purity≥98%
  • MDL No.MFCD00407019

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

Ethyl 5-acetoxy-6-bromo-2-(bromomethyl)-1-methyl-1H-indole-3-carboxylate|CS-0438660

Structure of 110543-98-1

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General Information

  • CAS No. 110543-98-1
  • Cat. No. CS-0438660
  • Purity ≥98%
  • MDL No. MFCD00407019
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₅H₁₅Br₂NO₄
  • Molecular Weight 433.09
  • Synonym(s) ethyl 5-(acetyloxy)-6-bromo-2-(bromomethyl)-1-methyl-1H-indole-3-carboxylate
  • SMILES O=C(C1=C(CBr)N(C)C2=C1C=C(OC(C)=O)C(Br)=C2)OCC

Synthesis

  • Route1

    References

    • Trofimov, F.A.; Tsyshkova, N.G.; Zotova, S.A.; Grinev, A.N. Pharmaceutical Chemistry Journal, 1993 , vol. 27, # 1 p. 75 - 76 Khimiko-Farmatsevticheskii Zhurnal, 1993 , vol. 27, # 1 p. 70 - 71
  • Route2
    • In-stock
      Ethyl 5-acetoxy-1,2-dimethyl-1H-indole-3-carboxylate|CS-0312842
      40945-79-7
    • ~19%
    • Arbidol Impurity 10|CS-0914875
      1312943-26-2
    • In-stock
      Ethyl 5-acetoxy-6-bromo-2-(bromomethyl)-1-methyl-1H-indole-3-carboxylate|CS-0438660
      110543-98-1

    References

    • Journal of Heterocyclic Chemistry, , vol. 48, # 3 p. 724 - 728

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS05
Signal Word : Danger
UN#: 1759
Class : 8
Packing Group : Ⅲ
Hazard Statements : H302-H314
Precautionary Statements : P260-P264-P270-P280-P301+P330+P331-P304+P340-P330-P363-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   57.53
  • LogP   3.9377
  • H_Acceptors   5
  • H_Donors   0
  • Rotatable_Bonds   4

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