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CS-W001157 4
Total: USD 88.00

Ethyl 5-(p-tolyl)isoxazole-3-carboxylate

  • CAS No. 88958-15-0

  • Cat. No. CS-0579437
  • Purity≥98%
  • MDL No.None

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

Ethyl 5-(p-tolyl)isoxazole-3-carboxylate|CS-0579437

Structure of 88958-15-0

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General Information

  • CAS No. 88958-15-0
  • Cat. No. CS-0579437
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₁₃NO₃
  • Molecular Weight 231.25
  • Synonym(s) ETHYL 5-P-TOLYLISOXAZOLE-3-CARBOXYLATE
  • SMILES CCOC(=O)C1=NOC(=C1)C2=CC=C(C=C2)C

Synthesis

  • Route1
    • null|null
      113503-90-5
    • ~87%
    • Ethyl 5-(p-tolyl)isoxazole-3-carboxylate|CS-0579437
      88958-15-0

    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

    References

    • Chary, R. Gangadhara; Reddy, G. Rajeshwar; Ganesh; Prasad, K. Vara; Raghunadh, Akula; Krishna; Mukherjee, Soumita; Pal, Manojit Advanced Synthesis and Catalysis, 2014 , vol. 356, # 1 p. 160 - 164
  • Route3
    • Ethyl 2-(4-methylphenyl)cyclopropane-1-carboxylate|CS-0240405
      97023-67-1
    • ~95%
    • Ethyl 5-(p-tolyl)isoxazole-3-carboxylate|CS-0579437
      88958-15-0

    References

    • Kadzhaeva; Trofimova; Fedotov; Potekhin; Gazzaeva; Mochalov; Zefirov Chemistry of Heterocyclic Compounds, 2009 , vol. 45, # 5 p. 595 - 605

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   2.82672
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   3

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