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CAS 133167-77-8

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Benzenesulfonic acid, 4-[(1,3-dioxobutyl)amino]-5-methoxy-2-methyl-, sodium salt (1:1)

Description:
Benzenesulfonic acid, 4-[(1,3-dioxobutyl)amino]-5-methoxy-2-methyl-, sodium salt (1:1) is a chemical compound characterized by its sulfonic acid functional group, which contributes to its solubility in water and its ability to act as a strong acid. The presence of the 1,3-dioxobutyl amino group indicates that it has potential applications in biological systems, possibly as a pharmaceutical or biochemical agent. The methoxy and methyl substituents on the benzene ring suggest that the compound may exhibit specific electronic and steric properties, influencing its reactivity and interaction with other molecules. As a sodium salt, it is likely to be more stable and easier to handle compared to its acid form. This compound may be used in various applications, including as a reagent in organic synthesis or as an intermediate in the production of other chemical substances. Its unique structure and functional groups may also impart specific biological activities, making it of interest in medicinal chemistry.
Formula:C12H15NO6S·Na
InChI:InChI=1S/C12H15NO6S.Na/c1-7-4-9(13-12(15)5-8(2)14)10(19-3)6-11(7)20(16,17)18;/h4,6H,5H2,1-3H3,(H,13,15)(H,16,17,18);
InChI key:InChIKey=BLXXIGHGYWSNIA-UHFFFAOYSA-N
SMILES:N(C(CC(C)=O)=O)C1=C(OC)C=C(S(=O)(=O)O)C(C)=C1.[Na]
Synonyms:
  • 3-(Acetoacetamido)-4-methoxytoluene-6-sulfonic acid sodium salt
  • 3-Acetoacetylamino-4-methoxytoluene-6-sulfonic acid sodium salt
  • 4-[(1,3-Dioxobutyl)amino]-5-methoxy-2-methyl-benzenesulfonic acid monosodium salt
  • Benzenesulfonic acid, 4-[(1,3-dioxobutyl)amino]-5-methoxy-2-methyl-, monosodium salt
  • Benzenesulfonic acid, 4-[(1,3-dioxobutyl)amino]-5-methoxy-2-methyl-, sodium salt (1:1)
  • Sodium 5-Methoxy-2-Methyl-4-[(3-Oxobutanoyl)Amino]Benzenesulfonate
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