CAS 101513-73-9
:5-Chloro-2,3,4-trifluorobenzoic acid
Description:
5-Chloro-2,3,4-trifluorobenzoic acid is an aromatic carboxylic acid characterized by the presence of a benzoic acid structure substituted with a chlorine atom and three fluorine atoms. The chlorine atom is located at the 5-position, while the trifluoromethyl group is situated at the 2, 3, and 4 positions of the benzene ring. This compound is typically a white to off-white solid and is known for its relatively high stability due to the strong electronegative influence of the fluorine atoms, which can enhance its acidity compared to non-fluorinated benzoic acids. It is soluble in organic solvents and exhibits moderate solubility in water. The presence of both chlorine and fluorine atoms contributes to its unique chemical reactivity, making it useful in various applications, including pharmaceuticals and agrochemicals. Additionally, its structure allows for potential interactions in biological systems, which can be of interest in medicinal chemistry. Safety data should be consulted for handling, as halogenated compounds can pose environmental and health risks.
Formula:C7H2ClF3O2
InChI:InChI=1S/C7H2ClF3O2/c8-3-1-2(7(12)13)4(9)6(11)5(3)10/h1H,(H,12,13)
InChI key:InChIKey=GWEORAFZBMNWGX-UHFFFAOYSA-N
SMILES:C(O)(=O)C1=C(F)C(F)=C(F)C(Cl)=C1
Synonyms:- 5-Chloro-2,3,4-trifluorobenzoic acid
- Benzoic acid, 5-chloro-2,3,4-trifluoro-
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