Description

Benzoic acid, 2,3,4-trifluoro-, sodium salt (1:1) is a high-purity fluorinated organic compound with the molecular formula C₇H₂F₃NaO₂, widely used in pharmaceutical and agrochemical research. This sodium salt derivative of 2,3,4-trifluorobenzoic acid offers excellent solubility in polar solvents, making it ideal for synthetic applications. With a CAS number 402955-41-3, it is rigorously tested for quality, ensuring consistent performance in nucleophilic substitution reactions and as a building block for advanced fluorinated compounds. Packaged under inert conditions to maintain stability, it is a critical reagent for researchers developing novel bioactive molecules.

Properties

• CAS Number: 402955-41-3
• Complexity: 191
• IUPAC Name: sodium;2,3,4-trifluorobenzoate
• InChI: InChI=1S/C7H3F3O2.Na/c8-4-2-1-3(7(11)12)5(9)6(4)10;/h1-2H,(H,11,12);/q;+1/p-1
• InChI Key: NZIOVCZZRCWAHP-UHFFFAOYSA-M
• Exact Mass: 197.99045807
• Molecular Formula: C7H2F3NaO2
• Molecular Weight: 198.07
• SMILES: C1=CC(=C(C(=C1C(=O)[O-])F)F)F.[Na+]
• Topological: 40.1
• Monoisotopic Mass: 197.99045807
• Synonyms: 402955-41-3, Benzoic acid, 2,3,4-trifluoro-, sodium salt (1:1), 609-813-0, Sodium 2,3,4-trifluorobenzoate, sodium;2,3,4-trifluorobenzoate, SODIUM2,3,4-TRIFLUOROBENZOATE, sodium,2,3,4-trifluorobenzoate, MFCD08458003, C7H2F3NaO2, SCHEMBL6718928, DTXSID70660130, sodium 2,3,4-trifluorobenzoate;, NZIOVCZZRCWAHP-UHFFFAOYSA-M, CK2200, SBB092248, AKOS015995322, AS-82705, 2,3,4-trifluorobenzoic acid, sodium salt, CS-0452164

This compound serves as a key intermediate in the synthesis of fluorinated pharmaceuticals and specialty chemicals. It is commonly used in cross-coupling reactions to introduce trifluoromethylated aromatic groups into target molecules. Researchers leverage its reactivity in medicinal chemistry to develop potential drug candidates with enhanced metabolic stability. Additionally, it finds utility in material science for creating fluorinated polymers with unique properties.

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