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CS-W001157 4
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2,3-Difluoro-6-hydroxybenzoic acid

  • CAS No. 749230-47-5

  • Cat. No. CS-W017532
  • Purity≥98%
  • MDL No.MFCD07368161

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

2,3-Difluoro-6-hydroxybenzoic acid|CS-W017532

Structure of 749230-47-5

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General Information

  • CAS No. 749230-47-5
  • Cat. No. CS-W017532
  • Purity ≥98%
  • MDL No. MFCD07368161
  • Storage RT, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₄F₂O₃
  • Molecular Weight 174.10
  • Synonym(s) 2,3-BISHYDROXYAMINO-2-METHYLBUTANE,HYDROCHLORIDE
  • SMILES O=C(O)C1=C(O)C=CC(F)=C1F

Description

This difluorinated benzoic acid features a hydroxyl group at the para position relative to the carboxylate, delivering enhanced polarity and hydrogen-bonding capacity. The ortho-fluorine substituents confer electron-withdrawing effects and metabolic stability, making it valuable for bioactive molecule design.

Application

2,3-Difluoro-6-hydroxybenzoic acid serves as a versatile building block in medicinal chemistry, enabling direct incorporation of fluorinated aromatic scaffolds with orthogonal hydroxyl and carboxylic acid functionalities. Its bench-stable nature facilitates straightforward derivatization via esterification, amide coupling, or Suzuki-Miyaura cross-coupling, while the difluoro substitution enhances metabolic stability and modulates electronic properties for target engagement.

Safety Information

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GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H320-H335
Precautionary Statements : P264-P270-P330

Quality Control

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Computational Chemistry Data

  • TPSA   57.53
  • LogP   1.3686
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   1

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