CAS 100517-43-9

3-(3-Chlorophenyl)-5-isoxazolecarboxylic acid

Description:

3-(3-Chlorophenyl)-5-isoxazolecarboxylic acid is a chemical compound characterized by its isoxazole ring, which is a five-membered heterocyclic structure containing both nitrogen and oxygen. The presence of the 3-chlorophenyl group indicates that a chlorine atom is substituted on the phenyl ring, influencing the compound's reactivity and potential biological activity. This compound typically exhibits properties such as moderate solubility in organic solvents and limited solubility in water, which is common for many aromatic carboxylic acids. Its carboxylic acid functional group contributes to its acidity and potential for forming salts or esters. The compound may also exhibit interesting pharmacological properties, making it a subject of interest in medicinal chemistry. Additionally, its structural features suggest potential applications in agrochemicals or pharmaceuticals, particularly in the development of compounds with specific biological activities. As with many chemical substances, safety data and handling precautions should be considered due to potential toxicity or environmental impact.

Formula: C₁₀H₆ClNO₃

InChI: InChI=1S/C10H6ClNO3/c11-7-3-1-2-6(4-7)8-5-9(10(13)14)15-12-8/h1-5H,(H,13,14)

InChI key: InChIKey=HNYLKRYOMWDUOY-UHFFFAOYSA-N

SMILES: C(O)(=O)C1=CC(=NO1)C2=CC(Cl)=CC=C2

Synonyms:

• 5-Isoxazolecarboxylic acid, 3-(m-chlorophenyl)-
• 5-Isoxazolecarboxylic acid, 3-(3-chlorophenyl)-
• 3-(3-Chlorophenyl)-5-isoxazolecarboxylic acid
• 3-(3-Chlorophenyl)isoxazole-5-carboxylic acid
• JR-13507, 3-(3-Chlorophenyl)isoxazole-5-carboxylic acid, 97%
• 3-(3-CHLOROPHENYL)-1,2-OXAZOLE-5-CARBOXYLIC ACID
• 3-(3-CHLORO-PHENYL)-ISOXAZOLE-5-CARBOXYLIC ACID