5-chloro-2-mercaptobenzothiazole

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 2
Total Number of Articles : 1
PubChem 2723842
Molecular Formula

C7H4ClNS2

SMILES

C1=CC2=C(C=C1Cl)NC(=S)S2

InChI

InChI=1S/C7H4ClNS2/c8-4-1-2-6-5(3-4)9-7(10)11-6/h1-3H,(H,9,10)

synonyms
  • 5-Chloro-2-mercaptobenzothiazole
  • 5331-91-9
  • 5-chloro-1,3-benzothiazole-2-thiol
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Properties
Property Value
MW 201.7 g/mol
HBD 1
HBA 2
Rotatable Bond Count 0
Exact Mass 200.9473692 g/mol
Monoisotopic Mass 200.9473692 g/mol
Heavy Atom Count 11
Isotope Atom Count 0
Atom Stereo Count 0
Covalent Unit Count 1
Complexity 185
xlogp 3
Topological Polar Surface Area 69.4