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CAS 126651-92-1

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Benzenecarbothioic acid, 2,4-dihydroxy-5-(3-hydroxybutyl)-3,6-dimethyl-, S-methyl ester

Description:
Benzenecarbothioic acid, 2,4-dihydroxy-5-(3-hydroxybutyl)-3,6-dimethyl-, S-methyl ester, identified by CAS number 126651-92-1, is an organic compound characterized by its complex structure that includes a benzenecarbothioic acid moiety and multiple functional groups. This compound features hydroxyl groups, which contribute to its potential solubility in polar solvents and may enhance its reactivity in various chemical reactions. The presence of the methyl ester group suggests that it can undergo hydrolysis to release the corresponding acid, which may exhibit biological activity. The branched hydroxybutyl chain adds to its molecular complexity and may influence its physical properties, such as boiling point and melting point. Additionally, the dimethyl substitution on the benzene ring can affect its electronic properties and steric hindrance, potentially impacting its interactions with biological systems. Overall, this compound may have applications in fields such as pharmaceuticals or agrochemicals, although specific biological activities and applications would require further investigation.
Formula:C14H20O4S
InChI:InChI=1/C14H20O4S/c1-7(15)5-6-10-8(2)11(14(18)19-4)13(17)9(3)12(10)16/h7,15-17H,5-6H2,1-4H3
InChI key:InChIKey=YIKHKZNDXADDGL-UHFFFAOYSA-N
SMILES:C(SC)(=O)C1=C(C)C(CCC(C)O)=C(O)C(C)=C1O
Synonyms:
  • Benzenecarbothioic acid, 2,4-dihydroxy-5-(3-hydroxybutyl)-3,6-dimethyl-, S-methyl ester (9CI)
  • Benzenecarbothioic acid, 2,4-dihydroxy-5-(3-hydroxybutyl)-3,6-dimethyl-, S-methyl ester
  • Ethanone, 1-(2,4-dihydroxy-5-(3-hydroxybutyl)-3-methyl-6-(methylthio)phenyl)-
  • S-methyl 2,4-dihydroxy-5-(3-hydroxybutyl)-3,6-dimethylbenzenecarbothioate
  • Resorthiomycin
  • 6-Acetyl-4-(3-hydroxybutyl)-2-methyl-5-methylthioresorcinol
  • 2,4-Dihydroxy-5-(3-hydroxybutyl)-3,6-dimethylthiobenzoic acid S-methyl ester
  • resorthiomycin
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