Cas no 192704-35-1 (2-(Octyldisulfanyl)-1,3-benzothiazole)

2-(Octyldisulfanyl)-1,3-benzothiazole structure
192704-35-1 structure
Product Name:2-(Octyldisulfanyl)-1,3-benzothiazole
CAS No:192704-35-1
MF:C15H21NS3
MW:311.528939962387
CID:2787766
Update Time:2023-08-07

2-(Octyldisulfanyl)-1,3-benzothiazole Chemical and Physical Properties

Names and Identifiers

    • 2-(OCTYLDISULFANYL)-1,3-BENZOTHIAZOLE
    • 2-(Octyldisulfanyl)-1,3-benzothiazole
    • Inchi: 1S/C15H21NS3/c1-2-3-4-5-6-9-12-17-19-15-16-13-10-7-8-11-14(13)18-15/h7-8,10-11H,2-6,9,12H2,1H3
    • InChI Key: CYXWNSBYVBWROX-UHFFFAOYSA-N
    • SMILES: S(CCCCCCCC)SC1=NC2C=CC=CC=2S1

Computed Properties

  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 19
  • Rotatable Bond Count: 9
  • Complexity: 237
  • XLogP3: 6.7
  • Topological Polar Surface Area: 91.7
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