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3-(tert-Butyl)-2-hydroxybenzoic acid

  • CAS No. 16094-30-7

  • Cat. No. CS-0563986
  • Purity≥98%
  • MDL No.None

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

3-(tert-Butyl)-2-hydroxybenzoic acid|CS-0563986

Structure of 16094-30-7

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General Information

  • CAS No. 16094-30-7
  • Cat. No. CS-0563986
  • Purity ≥98%
  • 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) 3-tert-Butylsalicylic acid
  • SMILES O=C(O)C1=CC=CC(C(C)(C)C)=C1O

Synthesis

  • Route1

    References

    • Yang, Jenny Y.; Nocera, Daniel G. Tetrahedron Letters, 2008 , vol. 49, # 32 p. 4796 - 4798
  • Route2

    References

    • Kawai, Tsuyoshi; Kuwabara, Takao; Yoshino, Katsumi Journal of the Chemical Society, Faraday Transactions, 1992 , vol. 88, # 14 p. 2041 - 2046

Safety Information

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Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   57.53
  • LogP   2.3879
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   1

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