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5-Chloro-2-n-octyl-4-isothiazolin-3-one-[d17]

General Information
Catalog: BLP-003013
CAS: 1189719-53-6
Molecular Formula: C11HD17ClNOS
Molecular Weight: 264.89
Chemical Structure
5-Chloro-2-n-octyl-4-isothiazolin-3-one-[d17]
Synonyms 5-Chloro-2-(n-octyl-d17)-4-isothiazolin-3-one; 5-chloro-2-octyl-1,2-thiazol-3-one-d17
IUPAC Name 5-chloro-2-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecadeuteriooctyl)-1,2-thiazol-3-one
Related CAS 26530-24-5 (unlabelled)
Canonical SMILES CCCCCCCCN1C(=O)C=C(S1)Cl
InChI InChI=1S/C11H18ClNOS/c1-2-3-4-5-6-7-8-13-11(14)9-10(12)15-13/h9H,2-8H2,1H3/i1D3,2D2,3D2,4D2,5D2,6D2,7D2,8D2
InChI Key PTMXFIUOGSODQW-OISRNESJSA-N
Solubility Soluble in Chloroform, Dichloromethane, Dimethyl Sulfoxide, Methanol
Appearance Light Yellow Oil

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