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CS-W001157 4
Total: USD 88.00

5-Chloro-2-fluorobenzoic acid

  • CAS No. 394-30-9

  • Cat. No. CS-W002658
  • Purity≥98%
  • MDL No.MFCD00665762

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

5-Chloro-2-fluorobenzoic acid|CS-W002658

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General Information

  • CAS No. 394-30-9
  • Cat. No. CS-W002658
  • Purity ≥98%
  • MDL No. MFCD00665762
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₄ClFO₂
  • Molecular Weight 174.56
  • Synonym(s) 5-Chloro-2-fluorobenzoicacid
  • SMILES Clc1ccc(c(c1)C(=O)O)F

Description

5-Chloro-2-fluorobenzoic acid features a strategically positioned chloro and fluoro substituent on the aromatic ring, enhancing electron deficiency and metabolic stability. This ortho-substituted benzoic acid derivative integrates readily into pharmaceutical scaffolds and serves as a key intermediate in the synthesis of bioactive molecules requiring halogenated aromatic cores.

Application

5-Chloro-2-fluorobenzoic acid serves as a versatile building block in medicinal chemistry and agrochemical synthesis, offering orthogonal reactivity from its ortho-fluoro and meta-chloro substituents. The carboxylic acid functionality enables direct amidation, esterification, and coupling reactions, while the electron-withdrawing halogens facilitate palladium-catalyzed cross-couplings. Its bench-stable solid form and predictable regioselectivity support efficient downstream transformations in multi-step syntheses.

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
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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