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Home> Hot Product Listed B   > Benzothiazole, 2-(1,3,4-oxadiazol-2-yl)- (9CI)
39455-50-0 structure

Benzothiazole, 2-(1,3,4-oxadiazol-2-yl)- (9CI)

CAS No.:39455-50-0
Molecular Weight:216.4009
Molecular Formula:C9H5N3S2 (isomer)
Names and Identifiers
Synonyms

Inchi
InChI=1/2ClH.Ta/h2*1H;/q;;+2/p-2
Canonical Smiles
[Cl-].[Ta]
Reach Info
Computational chemical data
  • Molecular Weight:216.4009g/mol
  • Molecular Formula:C9H5N3S2
  • Exact Mass:215.916849
  • Monoisotopic Mass:215.916849
  • Complexity:0
  • Rotatable Bond Count:0
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:1
  • Topological Polar Surface Area:0
  • Heavy Atom Count:2
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:2
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