Cas no 63290-58-4 (5-[4-Chloro-3-[(1,3-dioxo-2-benzofuran-5-yl)sulfanyl]phenyl]sulfanyl-2-benzofuran-1,3-dione)

5-[4-Chloro-3-[(1,3-dioxo-2-benzofuran-5-yl)sulfanyl]phenyl]sulfanyl-2-benzofuran-1,3-dione structure
63290-58-4 structure
Product Name:5-[4-Chloro-3-[(1,3-dioxo-2-benzofuran-5-yl)sulfanyl]phenyl]sulfanyl-2-benzofuran-1,3-dione
CAS No:63290-58-4
MF:C22H9ClO6S2
MW:468.886262655258
CID:2790273
PubChem ID:71373005
Update Time:2025-04-21

5-[4-Chloro-3-[(1,3-dioxo-2-benzofuran-5-yl)sulfanyl]phenyl]sulfanyl-2-benzofuran-1,3-dione Chemical and Physical Properties

Names and Identifiers

    • 5,5'-[(4-Chloro-1,3-phenylene)disulfanediyl]di(2-benzofuran-1,3-dione)
    • DTXSID40795847
    • 63290-58-4
    • 5-[4-Chloro-3-[(1,3-dioxo-2-benzofuran-5-yl)sulfanyl]phenyl]sulfanyl-2-benzofuran-1,3-dione
    • Inchi: 1S/C22H9ClO6S2/c23-17-6-3-12(30-10-1-4-13-15(7-10)21(26)28-19(13)24)9-18(17)31-11-2-5-14-16(8-11)22(27)29-20(14)25/h1-9H
    • InChI Key: ZSLHCOJWRDLKDI-UHFFFAOYSA-N
    • SMILES: ClC1=CC=C(C=C1SC1C=CC2C(=O)OC(C=2C=1)=O)SC1C=CC2C(=O)OC(C=2C=1)=O

Computed Properties

  • Exact Mass: 467.9529080Da
  • Monoisotopic Mass: 467.9529080Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 8
  • Heavy Atom Count: 31
  • Rotatable Bond Count: 4
  • Complexity: 790
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 5.4
  • Topological Polar Surface Area: 137?2
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