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CS-W001157 4
Total: USD 88.00

2-Hydroxy-3-isopropyl-6-methylbenzoic acid

  • CAS No. 548-51-6

  • Cat. No. CS-0327006
  • Molecule weight194.23
  • Purity95+%
  • MDL No.None

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

2-Hydroxy-3-isopropyl-6-methylbenzoic acid|CS-0327006

Structure of 548-51-6

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General Information

  • CAS No. 548-51-6
  • Cat. No. CS-0327006
  • Purity 95+%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₄O₃
  • Molecular Weight 194.23
  • Synonym(s) o-Thymotic acid
  • SMILES CC(C)C1=C(C(=C(C)C=C1)C(=O)O)O

Synthesis

  • Route1

    References

    • Tetrahedron, , vol. 43, # 7 p. 1519 - 1540
  • Route2

    References

    • Atti della Accademia Nazionale dei Lincei, Classe di Scienze Fisiche, Matematiche e Naturali, Rendiconti, , vol. <5> 10 II, p. 241 Gazzetta Chimica Italiana, , vol. 39 II, p. 326 Gazzetta Chimica Italiana, , vol. 36 II, p. 306
  • Route3
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      112404-71-4
    • ~%
    • 2-Hydroxy-3-isopropyl-6-methylbenzoic acid|CS-0327006
      548-51-6

    References

    • Tetrahedron, , vol. 43, # 7 p. 1519 - 1540

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H315-H319-H335
Precautionary Statements : P261-P264-P271-P280-P302+P352-P304+P340-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   57.53
  • LogP   2.52222
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   2

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