4,5-Dichloro-2-octylisothiazol-3(2H)-one

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 7
Total Number of Articles : 6
PubChem 91688
Molecular Formula

C11H17Cl2NOS

SMILES

CCCCCCCCN1C(=O)C(=C(S1)Cl)Cl

InChI

InChI=1S/C11H17Cl2NOS/c1-2-3-4-5-6-7-8-14-11(15)9(12)10(13)16-14/h2-8H2,1H3

synonyms
  • 64359-81-5
  • 4,5-Dichloro-2-octylisothiazol-3(2H)-one
  • Kathon 930
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Properties
Property Value
MW 282.2 g/mol
HBD 0
HBA 2
Rotatable Bond Count 7
Exact Mass 281.0407907 g/mol
Monoisotopic Mass 281.0407907 g/mol
Heavy Atom Count 16
Isotope Atom Count 0
Atom Stereo Count 0
Covalent Unit Count 1
Complexity 281
xlogp 5.1
Topological Polar Surface Area 45.6