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CS-W001157 4
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3-Chloro-5-fluorobenzoic acid

  • CAS No. 25026-64-6

  • Cat. No. CS-W017483
  • Molecule weight174.56
  • Purity≥98%
  • MDL No.MFCD00973904

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

3-Chloro-5-fluorobenzoic acid|CS-W017483

Structure of 25026-64-6

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General Information

  • CAS No. 25026-64-6
  • Cat. No. CS-W017483
  • Purity ≥98%
  • MDL No. MFCD00973904
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₄ClFO₂
  • Molecular Weight 174.56
  • Synonym(s) Benzoic acid, 3-chloro-5-fluoro-
  • SMILES O=C(O)C1=CC(F)=CC(Cl)=C1

Description

3-Chloro-5-fluorobenzoic acid features a strategically positioned chloro and fluoro substituent on the aromatic ring, delivering enhanced electron-withdrawing character and improved metabolic stability. This combination enables efficient incorporation into bioactive scaffolds and synthetic intermediates requiring halogen-directed functionalization under standard conditions.

Application

3-Chloro-5-fluorobenzoic acid serves as a valuable building block for pharmaceutical and agrochemical synthesis, offering orthogonal reactivity between chlorine and fluorine substituents. Its carboxylic acid functionality enables direct amidation, esterification, or coupling reactions under standard conditions. The molecule exhibits excellent bench stability and facilitates efficient purification via recrystallization, making it well-suited for scalable synthesis workflows.

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-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   37.3
  • LogP   2.1773
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   1

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