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CS-W001157 4
Total: USD 88.00

5-(Tert-butyl)isoxazole-4-carboxylic acid

  • CAS No. 134541-06-3

  • Cat. No. CS-0345122
  • Molecule weight169.18
  • Purity≥96%
  • MDL No.None

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

5-(Tert-butyl)isoxazole-4-carboxylic acid|CS-0345122

Structure of 134541-06-3

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General Information

  • CAS No. 134541-06-3
  • Cat. No. CS-0345122
  • Purity ≥96%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₁₁NO₃
  • Molecular Weight 169.18
  • Synonym(s) 5-Tert-butyl-isoxazole-4-carboxylic acid
  • SMILES O=C(O)C1=C(C(C)(C)C)ON=C1

Synthesis

  • Route1
    • null|null
      134540-97-9
    • ~80%
    • 5-(Tert-butyl)isoxazole-4-carboxylic acid|CS-0345122
      134541-06-3

    References

    • Schenone, Pietro; Fossa, Paola; Menozzi, Giulia Journal of Heterocyclic Chemistry, 1991 , vol. 28, # 2 p. 453 - 457
  • Route2
    • null|null
      116344-10-6
    • ~%
    • 5-(Tert-butyl)isoxazole-4-carboxylic acid|CS-0345122
      134541-06-3

    References

    • Schenone, Pietro; Fossa, Paola; Menozzi, Giulia Journal of Heterocyclic Chemistry, 1991 , vol. 28, # 2 p. 453 - 457

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   63.33
  • LogP   1.6703
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   1

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