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CS-W001157 4
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5-Bromo-2-hydroxy-4-methylbenzoic acid

  • CAS No. 6623-35-4

  • Cat. No. CS-0153581
  • Molecule weight231.04
  • Purity≥97%
  • MDL No.MFCD11044841

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

5-Bromo-2-hydroxy-4-methylbenzoic acid|CS-0153581

Structure of 6623-35-4

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General Information

  • CAS No. 6623-35-4
  • Cat. No. CS-0153581
  • Purity ≥97%
  • MDL No. MFCD11044841
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₇BrO₃
  • Molecular Weight 231.04
  • Synonym(s) 5-BroMo-2-hydroxy-4-Methyl-benzoic acid
  • SMILES CC1=C(C=C(C(=C1)O)C(=O)O)Br

Description

5-Bromo-2-hydroxy-4-methylbenzoic acid features a bromine atom at the 5-position, a hydroxyl group at the 2-position, and a methyl substituent at the 4-position on a benzoic acid core. This substitution pattern imparts enhanced solubility and reactivity in coupling reactions, making it valuable for synthesizing functionalized aromatic intermediates under standard conditions.

Application

5-Bromo-2-hydroxy-4-methylbenzoic acid serves as a versatile building block in medicinal chemistry and agrochemical synthesis, enabling efficient access to substituted benzimidazoles and heterocyclic scaffolds. The carboxylic acid group facilitates direct coupling reactions, while the bromine and hydroxyl functionalities offer orthogonal handles for further functionalization via cross-coupling or derivatization. Bench-stable and readily purified by recrystallization, it supports scalable synthesis workflows.

Synthesis

  • Route1

    References

    • Gibbs; Robertson Journal of the Chemical Society, 1914 , vol. 105, p. 1891
  • Route2

    References

    • Marzin Journal fuer Praktische Chemie (Leipzig), 1933 , vol. <2> 138, p. 103,106
  • Route3
    • null|null
      106-42-3
    • ~%
    • In-stock
      5-Bromo-2-hydroxy-4-methylbenzoic acid|CS-0153581
      6623-35-4

    References

    • Marzin Journal fuer Praktische Chemie (Leipzig), 1933 , vol. <2> 138, p. 103,106

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   57.53
  • LogP   2.16132
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   1

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