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Methyl 3,5-dimethylisoxazole-4-carboxylate

  • CAS No. 56328-87-1

  • Cat. No. CS-0326972
  • Purity≥98%
  • MDL No.None

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

Methyl 3,5-dimethylisoxazole-4-carboxylate|CS-0326972

Structure of 56328-87-1

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General Information

  • CAS No. 56328-87-1
  • Cat. No. CS-0326972
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₉NO₃
  • Molecular Weight 155.15
  • Synonym(s) 4-Isoxazolecarboxylicacid,3,5-dimethyl-,methylester(9CI)
  • SMILES CC1=NOC(=C1C(=O)OC)C

Synthesis

  • Route1

    References

    • TEMPERO PHARMACEUTICALS, INC.; BALOGLU, Erkan; GHOSH, Shomir; LOBERA, Mercedes; SCHMIDT, Darby, R. Patent: WO2013/19626 A1, 2013 ; Location in patent: Page/Page column 25; 26 ; WO 2013/019626 A1
  • Route2
    • null|null
      60753-84-6
    • null|null
      7063-95-8
    • ~40%
    • Methyl 3,5-dimethylisoxazole-4-carboxylate|CS-0326972
      56328-87-1

    References

    • Lasri, Jamal; Mukhopadhyay, Suman; Charmier, M. Adilia Januario Journal of Heterocyclic Chemistry, 2008 , vol. 45, # 5 p. 1385 - 1389

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

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Computational Chemistry Data

  • TPSA   52.33
  • LogP   1.07804
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   1

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