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CAS 99358-36-8

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{[4-(methylsulfonyl)-2-nitrophenyl]sulfanyl}acetic acid

Description:
The chemical substance known as {[4-(methylsulfonyl)-2-nitrophenyl]sulfanyl}acetic acid, with the CAS number 99358-36-8, is characterized by its complex molecular structure that includes a nitrophenyl group, a methylsulfonyl moiety, and a sulfanyl (thioether) functional group attached to an acetic acid backbone. This compound is likely to exhibit polar characteristics due to the presence of sulfonyl and carboxylic acid groups, which can engage in hydrogen bonding. The nitro group contributes to its potential reactivity and may influence its electronic properties, making it useful in various chemical applications. Additionally, the presence of sulfur in the sulfanyl group may impart unique properties, such as increased reactivity or specific interactions with biological targets. The compound's solubility, stability, and reactivity can be influenced by its functional groups, making it of interest in medicinal chemistry and material science. Overall, this substance represents a unique combination of functional groups that can lead to diverse applications in research and industry.
Formula:C9H9NO6S2
InChI:InChI=1/C9H9NO6S2/c1-18(15,16)6-2-3-8(17-5-9(11)12)7(4-6)10(13)14/h2-4H,5H2,1H3,(H,11,12)
SMILES:CS(=O)(=O)c1ccc(c(c1)N(=O)=O)SCC(=O)O
Synonyms:
  • Acetic Acid, 2-[[4-(Methylsulfonyl)-2-Nitrophenyl]Thio]-
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