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CS-W001157 4
Total: USD 88.00

Ethyl 5-(4-Bromophenyl)isoxazole-3-carboxylate

  • CAS No. 33277-15-5

  • Cat. No. CS-0061609
  • Molecule weight296.12
  • Purity≥97%
  • MDL No.None

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

Ethyl 5-(4-Bromophenyl)isoxazole-3-carboxylate|CS-0061609

Structure of 33277-15-5

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General Information

  • CAS No. 33277-15-5
  • Cat. No. CS-0061609
  • Purity ≥97%
  • MDL No. None
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₀BrNO₃
  • Molecular Weight 296.12
  • Synonym(s) 3-Isoxazolecarboxylic acid, 5-(4-bromophenyl)-, ethyl ester
  • SMILES CCOC(=O)C1=NOC(=C1)C2=CC=C(C=C2)Br

Synthesis

  • Route1
    • null|null
      1221821-65-3
    • ~83%
    • In-stock
      Ethyl 5-(4-Bromophenyl)isoxazole-3-carboxylate|CS-0061609
      33277-15-5

    References

    • Andrzejak, Virginie; Muccioli, Giulio G.; Body-Malapel, Mathilde; El Bakali, Jamal; Djouina, Madjid; Renault, Nicolas; Chavatte, Philippe; Desreumaux, Pierre; Lambert, Didier M.; Millet, Regis Bioorganic and Medicinal Chemistry, 2011 , vol. 19, # 12 p. 3777 - 3786
  • Route2
    • null|null
      151646-30-9
    • ~%
    • In-stock
      Ethyl 5-(4-Bromophenyl)isoxazole-3-carboxylate|CS-0061609
      33277-15-5

    References

    • US2010/63041 A1, ; Page/Page column 33 ;
  • Route3
    • Ethyl 4-(4-bromophenyl)-2,4-dioxobutanoate|CS-0122071
      40155-54-2
    • ~%
    • In-stock
      Ethyl 5-(4-Bromophenyl)isoxazole-3-carboxylate|CS-0061609
      33277-15-5

    References

    • Synthesis, , # 15 p. 2325 - 2330

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   52.33
  • LogP   3.2808
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   3

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