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CAS 84449-64-9

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Benzo[b]thiophene-6-ol, 2-[4-(benzoyloxy)phenyl]-, 6-benzoate

Description:
Benzo[b]thiophene-6-ol, 2-[4-(benzoyloxy)phenyl]-, 6-benzoate, identified by the CAS number 84449-64-9, is a chemical compound that features a benzo[b]thiophene core structure, which is a fused bicyclic compound containing both benzene and thiophene rings. This compound is characterized by the presence of a hydroxyl group (-OH) at the 6-position and a benzoyloxy group attached to a phenyl ring at the 2-position. The benzoate moiety indicates that it has an ester functional group derived from benzoic acid. The presence of these functional groups suggests potential applications in organic synthesis, pharmaceuticals, or as a dye or pigment due to the conjugated system that may provide interesting optical properties. Additionally, the compound may exhibit biological activity, making it of interest in medicinal chemistry. Its solubility, stability, and reactivity would depend on the specific conditions and solvents used in experiments or applications.
Formula:C28H18O4S
InChI:InChI=1S/C28H18O4S/c29-27(20-7-3-1-4-8-20)31-23-14-11-19(12-15-23)25-17-22-13-16-24(18-26(22)33-25)32-28(30)21-9-5-2-6-10-21/h1-18H
InChI key:InChIKey=ZKKFYIZBFKMUHT-UHFFFAOYSA-N
SMILES:O(C(=O)C1=CC=CC=C1)C=2C=C3C(C=C(S3)C4=CC=C(OC(=O)C5=CC=CC=C5)C=C4)=CC2
Synonyms:
  • 4-[6-(Benzoyloxy)-1-benzothiophen-2-yl]phenyl benzoate
  • 2-[4-(Benzoyloxy)Phenyl]Benzo[B]Thiophene-6-Ol 6-Benzoate
  • Benzo[b]thiophene-6-ol, 2-[4-(benzoyloxy)phenyl]-, benzoate
  • Benzo[b]thiophene-6-ol, 2-[4-(benzoyloxy)phenyl]-, 6-benzoate
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