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CAS 62625-31-4

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Phenol, 4,4′-(2,2-dioxido-3H-1,2-benzoxathiol-3-ylidene)bis[3-methyl-, sodium salt (1:1)

Description:
Phenol, 4,4′-(2,2-dioxido-3H-1,2-benzoxathiol-3-ylidene)bis[3-methyl-, sodium salt (1:1), known by its CAS number 62625-31-4, is a chemical compound characterized by its complex structure that includes a phenolic group and a benzoxathiol moiety. This compound typically exhibits properties associated with both phenols and thiophenes, such as potential antioxidant and antimicrobial activities. As a sodium salt, it is likely to be soluble in water, which can enhance its bioavailability and reactivity in various applications. The presence of the dioxido group suggests that it may participate in redox reactions, making it useful in various chemical processes. Additionally, the methyl groups attached to the phenolic structure can influence its stability and reactivity. Overall, this compound may find applications in fields such as pharmaceuticals, materials science, and biochemistry, although specific applications would depend on further research into its properties and behavior in different environments.
Formula:C21H18O5S·Na
InChI:InChI=1S/C21H18O5S.Na/c1-13-11-15(22)7-9-17(13)21(18-10-8-16(23)12-14(18)2)19-5-3-4-6-20(19)26-27(21,24)25;/h3-12,22-23H,1-2H3;
InChI key:InChIKey=MTQREAZUSGRPEO-UHFFFAOYSA-N
SMILES:O=S1(=O)C(C=2C(O1)=CC=CC2)(C3=C(C)C=C(O)C=C3)C4=C(C)C=C(O)C=C4.[Na]
Synonyms:
  • 2-[(Z)-(4-hydroxy-2-methylphenyl)(2-methyl-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]benzenesulfonate
  • 3H-1,2-Benzoxathiole, phenol deriv.
  • Phenol, 4,4'-(2,2-dioxido-3H-1,2-benzoxathiol-3-ylidene)bis(3-methyl-, monosodium salt
  • Phenol, 4,4'-(2,2-dioxido-3H-1,2-benzoxathiol-3-ylidene)bis(3-methyl-, sodium salt (1:1)
  • Phenol, 4,4′-(3H-1,2-benzoxathiol-3-ylidene)bis[3-methyl-, S,S-dioxide, monosodium salt
  • sodium 2-[(Z)-(4-hydroxy-2-methylphenyl)(2-methyl-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]benzenesulfonate
  • sodium 4-[3-(4-hydroxy-2-methylphenyl)-1,1-dioxido-3H-2,1-benzoxathiol-3-yl]-3-methylphenolate
  • Sodium hydrogen 4,4'-(3H-1,2-benzoxathiol-3-ylidene)bis(3-methylphenolate) S,S-dioxide
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