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CS-W001157 4
Total: USD 88.00

4-Chlorobenzene-1,3-diol

  • CAS No. 95-88-5

  • Cat. No. CS-W016374
  • Purity≥97%
  • MDL No.MFCD00002273

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

4-Chlorobenzene-1,3-diol|CS-W016374

Structure of 95-88-5

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General Information

  • CAS No. 95-88-5
  • Cat. No. CS-W016374
  • Purity ≥97%
  • MDL No. MFCD00002273
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₅ClO₂
  • Molecular Weight 144.56
  • Synonym(s) None
  • SMILES OC1=CC=C(Cl)C(O)=C1

Description

4-Chlororesorcinol features a vicinal trihydroxy arrangement with a chlorine substituent at the para position, delivering enhanced electrophilicity and stability under standard bench conditions. This electron-deficient phenolic scaffold integrates readily into synthetic routes requiring selective functionalization or as a building block for bioactive heterocycles.

Application

4-Chlororesorcinol serves as a versatile building block in synthetic organic chemistry, enabling efficient access to substituted phenolic scaffolds. Its ortho-dihydroxy functionality supports directed metalation and selective functionalization, while the chlorine substituent facilitates palladium-catalyzed coupling reactions. The compound exhibits excellent bench stability and compatibility with common protecting group strategies, making it well-suited for multi-step synthesis of bioactive molecules and heterocyclic systems.

Synthesis

  • Route1
    • null|null
      108-46-3
    • ~92%
    • In-stock
      4-Chlorobenzene-1,3-diol|CS-W016374
      95-88-5

    References

    • Bovicelli; Mincione; Antonioletti; Bernini; Colombari Synthetic Communications, 2001 , vol. 31, # 19 p. 2955 - 2963
  • Route2
    • 4-Chlorobenzene-1,3-diamine|CS-W018268
      5131-60-2
    • ~%
    • In-stock
      4-Chlorobenzene-1,3-diol|CS-W016374
      95-88-5

    References

    • Journal of the American Chemical Society, , vol. 55, p. 319 Journal of the American Chemical Society, , vol. 56, p. 2456,2458
  • Route3

    References

    • Arzneimittel-Forschung/Drug Research, , vol. 23, # 12 p. 1745 - 1758

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS05,GHS07,GHS09
Signal Word : Danger
UN#: 3077
Class : 9
Packing Group : Ⅲ
Hazard Statements : H302-H315-H317-H318-H401-H411
Precautionary Statements : P261-P264-P270-P272-P273-P280-P302+P352-P362-P391-P501

Quality Control

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Computational Chemistry Data

  • TPSA   40.46
  • LogP   1.7512
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   0

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