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CAS 68449-31-0

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4-(2-Chlorophenyl)butanoic acid

Description:
4-(2-Chlorophenyl)butanoic acid, with the CAS number 68449-31-0, is an organic compound characterized by its butanoic acid backbone substituted with a 2-chlorophenyl group at the fourth position. This compound typically appears as a solid or crystalline substance and is known for its potential applications in pharmaceuticals and agrochemicals. The presence of the chlorophenyl group can influence its chemical reactivity and biological activity, often enhancing lipophilicity and modulating interactions with biological targets. The carboxylic acid functional group (-COOH) imparts acidic properties, allowing it to participate in various chemical reactions, such as esterification and amidation. Additionally, the compound may exhibit specific solubility characteristics, being soluble in organic solvents while having limited solubility in water. Its structural features suggest potential for use in drug development, particularly in the design of compounds with specific pharmacological profiles. As with many chemical substances, safety and handling precautions should be observed due to potential toxicity or environmental impact.
Formula:C10H11ClO2
InChI:InChI=1S/C10H11ClO2/c11-9-6-2-1-4-8(9)5-3-7-10(12)13/h1-2,4,6H,3,5,7H2,(H,12,13)
InChI key:InChIKey=JNJQMOCBSVJQSM-UHFFFAOYSA-N
SMILES:C(CCC(O)=O)C1=C(Cl)C=CC=C1
Synonyms:
  • 2-Chlorobenzenebutanoic acid
  • 4-(2-Chlorophenyl)butanoic acid
  • Butyric acid, 4-(o-chlorophenyl)-
  • Benzenebutanoic acid, 2-chloro-
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