4-Chloro-2-fluorobenzoic acid

CAS: 446-30-0

Ref. 3D-FC35008

Product Information

• Name: 4-Chloro-2-fluorobenzoic acid
• Synonyms: 2-Fluoro-4-Chlorobenzoic Acid, 4-Chloro-2-Fluorobenzoate, 4-Chloro-2-Fluorobenzoic Acid 2-Fluoro-4-Chlorobenzoic Acid, 4-Chloro-2-Fluorobenzoic Acid 98%(Hpl&, Benzoic acid, 4-chloro-2-fluoro-, Buttpark 19\01-70, NSC 190363, Rarechem Al Bo 0755, Timtec-Bb Sbb003797
• CAS: 446-30-0

Description

4-Chloro-2-fluorobenzoic acid is a molecule that can be obtained by the reaction of aniline and proton. It is a strong electron acceptor that has been studied in molecular modeling studies. 4-Chloro-2-fluorobenzoic acid has been found to have intermolecular hydrogen bonding with hexadecyl, dodecyl, and other molecules. The homologues of this molecule are 2,4-dichlorobenzoic acid and fluvoxamine maleate. This molecule is used as a tool for calculating the solvation energy of electrons in molecules and to study the interactions between molecules.

• Brand: Biosynth

Chemical properties

• Molecular weight: 174.56 g/mol
• Formula: C₇H₄ClFO₂
• Purity: Min. 95%
• InChI: InChI=1S/C7H4ClFO2/c8-4-1-2-5(7(10)11)6(9)3-4/h1-3H,(H,10,11)
• InChI key: InChIKey=ZLPXBWMVZANJJQ-UHFFFAOYSA-N
• SMILES: O=C(O)c1ccc(Cl)cc1F