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CS-W001157 4
Total: USD 88.00

4,6-Di-tert-butylbenzene-1,3-diol

  • CAS No. 5374-06-1

  • Cat. No. CS-0435415
  • Purity≥98%
  • MDL No.None

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

4,6-Di-tert-butylbenzene-1,3-diol|CS-0435415

Structure of 5374-06-1

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General Information

  • CAS No. 5374-06-1
  • Cat. No. CS-0435415
  • Purity ≥98%
  • MDL No. None
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₄H₂₂O₂
  • Molecular Weight 222.32
  • Synonym(s) 4,6-Di-tert-butylresorcinol
  • SMILES OC1=C(C(C)(C)C)C=C(C(C)(C)C)C(O)=C1

Description

This sterically shielded diol features two tert-butyl groups flanking a conjugated phenolic core, enhancing solubility and stability. The ortho-diol arrangement enables chelation in metal coordination and serves as a robust ligand scaffold in catalytic systems.

Application

4,6-Di-tert-butylbenzene-1,3-diol serves as a sterically hindered phenolic building block with enhanced stability due to ortho-tert-butyl protection. Its two hydroxyl groups enable selective derivatization in multistep syntheses, while the bulky substituents minimize unwanted side reactions. This compound functions effectively in the construction of functionalized aromatic scaffolds and acts as a robust ligand precursor or antioxidant intermediate in industrial R&D applications.

Synthesis

  • Route1
    • null|null
      75-65-0
    • null|null
      108-46-3
    • ~94%
    • In-stock
      4,6-Di-tert-butylbenzene-1,3-diol|CS-0435415
      5374-06-1

    References

    • Korneev, S. M.; Nikolaev, V. A. Journal of Organic Chemistry USSR (English Translation), 1990 , vol. 26, # 8 p. 1493 - 1495 Zhurnal Organicheskoi Khimii, 1990 , vol. 26, # 8 p. 1724 - 1728
  • Route2
    • null|null
      115-11-7
    • null|null
      108-46-3
    • ~65%
    • In-stock
      4,6-Di-tert-butylbenzene-1,3-diol|CS-0435415
      5374-06-1

    References

    • Horner, L.; Simons, G. Phosphorus and Sulfur and the Related Elements, 1983 , vol. 14, p. 189 - 210
  • Route3
    • null|null
      507-19-7
    • null|null
      108-46-3
    • ~85%
    • In-stock
      4,6-Di-tert-butylbenzene-1,3-diol|CS-0435415
      5374-06-1

    References

    • Kamitori, Yasuhiro; Hojo, Masaru; Masuda, Ryoichi; Izumi, Tatsuo; Tsukamoto, Shuichi Journal of Organic Chemistry, 1984 , vol. 49, # 22 p. 4161 - 4165

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-H413
Precautionary Statements : P261-P264-P271-P273-P280-P302+P352-P304+P340-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   40.46
  • LogP   3.6928
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   0

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