CAS 844856-61-7

(1R,2S)-2-(4-methylsulfanylbenzoyl)cyclohexane-1-carboxylic acid

Description:

The chemical substance known as (1R,2S)-2-(4-methylsulfanylbenzoyl)cyclohexane-1-carboxylic acid, with the CAS number 844856-61-7, is characterized by its specific stereochemistry and functional groups. This compound features a cyclohexane ring, which is a six-membered carbon structure, substituted at the 1 and 2 positions with a carboxylic acid group and a 4-methylsulfanylbenzoyl moiety, respectively. The presence of the carboxylic acid group indicates that it can participate in acid-base reactions, while the aromatic ring contributes to its potential for π-π interactions and hydrophobic characteristics. The methylsulfanyl group enhances the compound's lipophilicity and may influence its biological activity. The stereochemistry, denoted by (1R,2S), suggests specific spatial arrangements that can affect the compound's reactivity and interactions with biological targets. Overall, this compound may exhibit unique properties relevant to medicinal chemistry, particularly in the development of pharmaceuticals.

Formula: C₁₅H₁₈O₃S

InChI: InChI=1/C15H18O3S/c1-19-11-8-6-10(7-9-11)14(16)12-4-2-3-5-13(12)15(17)18/h6-9,12-13H,2-5H2,1H3,(H,17,18)/t12-,13+/m0/s1

Synonyms:

• CIS-2-(4-METHYLSULFANYLBENZOYL)CYCLOHEXANE-1-CARBOXYLIC ACID
• Cyclohexanecarboxylic acid, 2-[4-(methylthio)benzoyl]-, (1R,2S)-rel-
• (1R,2S)-2-(4-(methylthio)benzoyl)cyclohexane-1-carboxylic acid
• CIS-2-(4-THIOMETHYLBENZOYL)CYCLOHEXANE-1-CARBOXYLIC ACID
• 3-Methylsulfanylbenzenethiol