4,5-Dichloro-2H-octyl-3(2H)-isothiazolone

Systematic / IUPAC Name: 4,5-Dichloro-2-octyl-1,2-thiazol-3-one

ID: Reference8757

Other Names: Kathon 930;
3(2H)-Isothiazolone, 4,5-dichloro-2-octyl-;
4,5-Dichloro-2-n-octyl-3(2H)-isothiazolone;
4,5-Dichloro-2-n-octyl-3-isothiazolone;
4,5-Dichloro-2-n-octyl-4-isothiazolin-3-one ; more

Formula: C11H17Cl2NOS

Class: Extractables/Leachables Pesticides/Herbicides Textile Chemicals/Auxiliary/Dyes

Spectral Data

4,5-Dichloro-2H-octyl-3(2H)-isothiazolone mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

View Mass Spectra

Available MS Data

Used Instruments Orbitrap Fusion with FAIMS
No. of Spectral Trees 1
No. of Spectra 405
Tandem Spectra MS1, MS2, MS3
Ionization Methods NSI
Analyzers FT
Last Modification 3/29/2019 9:45:15 AM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C11H17Cl2NOS/c1-2-3-4-5-6-7-8-14-11(15)9(12)10(13)16-14/h2-8H2,1H3
InChI Key PORQOHRXAJJKGK-UHFFFAOYSA-N
Canonical SMILES CCCCCCCCN1C(=O)C(=C(S1)Cl)Cl
CAS 64359815
Splash
Other Names Kathon 930;
3(2H)-Isothiazolone, 4,5-dichloro-2-octyl-;
4,5-Dichloro-2-n-octyl-3(2H)-isothiazolone;
4,5-Dichloro-2-n-octyl-3-isothiazolone;
4,5-Dichloro-2-n-octyl-4-isothiazolin-3-one;
4,5-Dichloro-2-octyl-1,2-thiazol-3(2H)-one;
4,5-Dichloro-2-octyl-2,3-dihydro-1,2-thiazol-3-one;
4,5-Dichloro-2-octyl-2H-isothiazol-3-one;
4,5-Dichloro-2-octyl-3(2H)-isothiazolone;
4,5-Dichloro-2-octylisothiazol-3(2H)-one;
4,5-Dichloro-2-octyl-isothiazol-3-one;
4,5-Dichloro-2-octyl-isothiazolone;
4,5-Dichloro-n-octyl-3(2H)-isothiazolone;
Dichlorooctylisothiazolinone;
DCOIT

In Other Databases

ChemIDPlus 064359815
ChemSpider 82791
ChEBI CHEBI:83518
ChEMBL CHEMBL110764
PubChem 91688