CAS 1186194-96-6

Benzoic acid, 4-chloro-3-(trifluoromethyl)-, anhydride with 4-chloro-3-(trifluoromethyl)benzoic acid

Description:

Benzoic acid, 4-chloro-3-(trifluoromethyl)-, anhydride with 4-chloro-3-(trifluoromethyl)benzoic acid is a chemical compound characterized by its anhydride functional group, which is derived from benzoic acid. This compound features a trifluoromethyl group and a chloro substituent on the aromatic ring, contributing to its unique chemical properties. The presence of the trifluoromethyl group typically enhances the compound's lipophilicity and can influence its reactivity, making it useful in various chemical syntheses and applications. The chloro substituent can also affect the compound's electronic properties, potentially increasing its acidity compared to unsubstituted benzoic acids. This compound may exhibit significant biological activity, making it of interest in pharmaceutical and agrochemical research. Additionally, its anhydride form suggests it may participate in acylation reactions, which are valuable in organic synthesis. As with many halogenated compounds, safety precautions should be taken due to potential toxicity and environmental impact.

Formula: C₁₆H₆Cl₂F₆O₃

InChI: InChI=1S/C16H6Cl2F6O3/c17-11-3-1-7(5-9(11)15(19,20)21)13(25)27-14(26)8-2-4-12(18)10(6-8)16(22,23)24/h1-6H

InChI key: InChIKey=BGYYITZPEBFGQF-UHFFFAOYSA-N

SMILES: C(F)(F)(F)C1=CC(C(OC(=O)C2=CC(C(F)(F)F)=C(Cl)C=C2)=O)=CC=C1Cl

Synonyms:

• Benzoic acid, 4-chloro-3-(trifluoromethyl)-, anhydride with 4-chloro-3-(trifluoromethyl)benzoic acid