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5-Chloro-2-methyl-3-isothiazolone-[d3]

General Information
Catalog: BLP-003015
CAS: 1329611-34-8
Molecular Formula: C4HD3ClNOS
Molecular Weight: 152.62
Chemical Structure
5-Chloro-2-methyl-3-isothiazolone-[d3]
Description 5-Chloro-2-methyl-3-isothiazolone-[d3] is the labelled analogue of 5-Chloro-2-methyl-4-Isothiazolin-3-one, which is an isothiazolinone-derived biocide used for controlling microbial growth in water-containing solutions. It can inhibit the active action of PCAF.
Synonyms 5-Chloro-2-methyl-3-isothiazolone D3; 5-Chloro-2-methyl-3(2H)-isothiazolone-d3; 2-Methyl-5-chloro-3-isothiazolone-d3; 2-Methyl-5-chloroisothiazolin-3-one-d3; Kathon CG 5243-d3; Kathon IXE-d3; Methylchloroisothiazolinone-d3
IUPAC Name 5-chloro-2-(trideuteriomethyl)-1,2-thiazol-3-one
Related CAS 26172-55-4 (unlabelled)
Canonical SMILES CN1C(=O)C=C(S1)Cl
InChI InChI=1S/C4H4ClNOS/c1-6-4(7)2-3(5)8-6/h2H,1H3/i1D3
InChI Key DHNRXBZYEKSXIM-FIBGUPNXSA-N
Melting Point 52-54 °C
Purity ≥ 99% by HPLC; ≥ 98% atom D
Solubility Slightly soluble in Chloroform, Methanol
Appearance Off-white to Light Yellow Solid
Storage 2-8 °C

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