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CS-W001157 4
Total: USD 88.00

3-Amino-5-fluorobenzoic acid

  • CAS No. 786616-54-4

  • Cat. No. CS-W016258
  • Purity≥97%
  • MDL No.MFCD07779526

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

3-Amino-5-fluorobenzoic acid|CS-W016258

Structure of 786616-54-4

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General Information

  • CAS No. 786616-54-4
  • Cat. No. CS-W016258
  • Purity ≥97%
  • MDL No. MFCD07779526
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₆FNO₂
  • Molecular Weight 155.13
  • Synonym(s) benzoic acid, 3-amino-5-fluoro-
  • SMILES NC1=CC(=CC(=C1)C(=O)O)F

Description

3-Amino-5-fluorobenzoic acid features a strategically positioned amino group flanked by fluorine and carboxylic acid functionalities, enabling precise tuning of electronic properties and solubility. This combination supports direct integration into pharmaceutical scaffolds and functional materials under standard conditions.

Application

3-Amino-5-fluorobenzoic acid serves as a versatile building block in medicinal chemistry, enabling the synthesis of fluorinated aromatic scaffolds via standard amide coupling, Suzuki-Miyaura, and Buchwald-Hartwig reactions. Its ortho-amino and meta-fluoro functionalities offer complementary reactivity for sequential functionalization, while the carboxylic acid group facilitates direct derivatization or salt formation. Bench-stable and readily purified by recrystallization, it supports scalable synthesis of API intermediates and heterocyclic systems.

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

Quality Control

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Computational Chemistry Data

  • TPSA   63.32
  • LogP   1.1061
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   1

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