CAS 99585-15-6

2-[(2-Chlorophenyl)thio]propanoic acid

Description:

2-[(2-Chlorophenyl)thio]propanoic acid, with the CAS number 99585-15-6, is an organic compound characterized by its thioether and carboxylic acid functional groups. This substance features a propanoic acid backbone, which is substituted at the second carbon with a thioether group linked to a 2-chlorophenyl moiety. The presence of the chlorine atom on the phenyl ring can influence the compound's reactivity and biological activity, often enhancing its lipophilicity and potential interactions with biological targets. The thioether linkage contributes to the compound's overall stability and may affect its solubility in various solvents. Typically, compounds of this nature are studied for their potential applications in pharmaceuticals, agrochemicals, or as intermediates in organic synthesis. The specific properties, such as melting point, boiling point, and solubility, would depend on the molecular structure and the surrounding conditions. Safety data should be consulted for handling and usage, as compounds with similar structures may exhibit varying degrees of toxicity or environmental impact.

Formula: C₉H₉ClO₂S

InChI: InChI=1S/C9H9ClO2S/c1-6(9(11)12)13-8-5-3-2-4-7(8)10/h2-6H,1H3,(H,11,12)

InChI key: InChIKey=IEIAJSOBRQNLOX-UHFFFAOYSA-N

SMILES: S(C(C(O)=O)C)C1=C(Cl)C=CC=C1

Synonyms:

• Propionic acid, 2-(o-chlorophenylthio)-
• 2-[(2-Chlorophenyl)sulfanyl]propanoic acid
• 2-[(2-Chlorophenyl)thio]propanoic acid
• 2-(2-Chlorophenylthio)propionic acid
• Propanoic acid, 2-[(2-chlorophenyl)thio]-

2-[(2-Chlorophenyl)sulfanyl]propanoic acid

CAS: 99585-15-6

Versatile small molecule scaffold

Formula: C₉H₉ClO₂S

Purity: Min. 95%

Molecular weight: 216.68 g/mol

Ref: 3D-ZDA58515