456-22-4
Chemical Structure
4-Fluorobenzoic acid
- CAS No.: 456-22-4
- Formula:C7H5FO2
- Molecular Weight:140.11
IUPAC Name: 4-fluorobenzoic acid
InChIKey: BBYDXOIZLAWGSL-UHFFFAOYSA-N
SMILES: O=C(C1=CC=C(C=C1)F)O
Biological Activity: 4-Fluorobenzoic acid is a monofluorinated benzoate and a fluorinated aromatic carboxylic acid. 4-Fluorobenzoic acid is the major metabolite formed from 4-Fluorobenzyl alcohol by Pseudomonas strains, accumulating transiently and being gradually biotransformed by Pseudomonas aeruginosa strain IE653. 4-Fluorobenzoic acid acts as a fluorinated benzoate ligand/chromophore, sensitizing lanthanide luminescence through the antenna effect. 4-Fluorobenzoic acid serves as a synthetic precursor for aromatic ethers, ketones, esters, and amides[1][2][3][4].
| Cat. No. | Product Name | Purity | Description | Pricing | |||||||||||||||||||
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4-Fluorobenzoic acid | 98.78% | 4-Fluorobenzoic acid is a monofluorinated benzoate and a fluorinated aromatic carboxylic acid. 4-Fluorobenzoic acid is the major metabolite formed from 4-Fluorobenzyl alcohol by Pseudomonas strains, accumulating transiently and being gradually biotransformed by Pseudomonas aeruginosa strain IE653. 4-Fluorobenzoic acid acts as a fluorinated benzoate ligand/chromophore, sensitizing lanthanide luminescence through the antenna effect. 4-Fluorobenzoic acid serves as a synthetic precursor for aromatic ethers, ketones, esters, and amides. | ||||||||||||||||||||
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4-Fluorobenzoic acid-d4 | 99.63% | 4-Fluorobenzoic acid-d4 is the d4-labeled 4-Fluorobenzoic acid (HY-W013677). 4-Fluorobenzoic acid is a monofluorinated benzoate and a fluorinated aromatic carboxylic acid. 4-Fluorobenzoic acid is the major metabolite formed from 4-Fluorobenzyl alcohol by Pseudomonas strains, accumulating transiently and being gradually biotransformed by Pseudomonas aeruginosa strain IE653. 4-Fluorobenzoic acid acts as a fluorinated benzoate ligand/chromophore, sensitizing lanthanide luminescence through the antenna effect. 4-Fluorobenzoic acid serves as a synthetic precursor for aromatic ethers, ketones, esters, and amides. | ||||||||||||||||||||
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4-Fluorobenzoic acid-13C,d4 | 4-Fluorobenzoic acid-13C,d4 is the d4, 13C-labeled 4-Fluorobenzoic acid (HY-W013677). 4-Fluorobenzoic acid is a monofluorinated benzoate and a fluorinated aromatic carboxylic acid. 4-Fluorobenzoic acid is the major metabolite formed from 4-Fluorobenzyl alcohol by Pseudomonas strains, accumulating transiently and being gradually biotransformed by Pseudomonas aeruginosa strain IE653. 4-Fluorobenzoic acid acts as a fluorinated benzoate ligand/chromophore, sensitizing lanthanide luminescence through the antenna effect. 4-Fluorobenzoic acid serves as a synthetic precursor for aromatic ethers, ketones, esters, and amides. | |||||||||||||||||||||
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Similarity Score 0.92
HY-W0157533-Fluorobenzoic acid -
Similarity Score 0.88
HY-W0133964-Iodobenzoic acid -
Similarity Score 0.88
HY-41465R4-Chlorobenzoic acid (Standard) -
Similarity Score 0.88
HY-787004-Bromobenzoic acid -
Similarity Score 0.87
HY-B1008R4-Aminobenzoic acid (Standard) -
Similarity Score 0.87
HY-Y02644-Hydroxybenzoic acid -
Similarity Score 0.87
HY-Y0264S4-Hydroxybenzoic acid-13C6 -
Similarity Score 0.87
HY-Y0264S24-Hydroxybenzoic acid-13C -
Similarity Score 0.87
HY-76547p-Toluic acid -
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References
- [1]. Li L, et al. Synthesis, structure and fluorescence studies of the lanthanide complexes with 4-fluorobenzoic acid[J]. Inorganica Chimica Acta, 2015, 426: 107-112.
- [2]. Maeda T, et al. Fluorine elimination from 4-fluorobenzyl alcohol by Pseudomonas spp[J]. J Environ Biotechnol, 2007, 7: 45-53.
- [3]. Li Y, et al. Revealing Solid–Liquid Equilibrium Behavior of 4-Fluorobenzoic Acid in 12 Pure Solvents from 283.15 to 323.15 K by Experiments and Molecular Simulations[J]. Journal of Chemical & Engineering Data, 2024, 69(3): 1314-1325.
- [4]. Vijayalakshmi G, et al. Unveiling the anticancer potential: Exploring 4-fluoro benzoic acid and piperazine through spectroscopic, X-ray diffraction, DFT and molecular docking analysis[J]. Journal of Molecular Structure, 2025, 1322: 140507.
