U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C11H19NOS
Molecular Weight 213.34
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of OCTHILINONE

SMILES

CCCCCCCCN1SC=CC1=O

InChI

InChIKey=JPMIIZHYYWMHDT-UHFFFAOYSA-N
InChI=1S/C11H19NOS/c1-2-3-4-5-6-7-9-12-11(13)8-10-14-12/h8,10H,2-7,9H2,1H3

HIDE SMILES / InChI

Approval Year

PubMed

PubMed

TitleDatePubMed
Fungal colonization and succession on newly painted buildings and the effect of biocide.
2002 Feb 1
Occupational contact allergy and dermatitis from methylisothiazolinone after contact with wallcovering glue and after a chemical burn from a biocide.
2004 Dec
Contact dermatitis from 2-n-octyl-4-isothiazolin-3-one in a PhD student.
2004 Jan
Analyzing cytotoxic effects of selected isothiazol-3-one biocides using the toxic ratio concept and structure-activity relationship considerations.
2009 Dec
A critical cysteine residue in monoacylglycerol lipase is targeted by a new class of isothiazolinone-based enzyme inhibitors.
2009 Jul
Analysis of isothiazolinone biocides in paper for food packaging by ultra-high-performance liquid chromatography-tandem mass spectrometry.
2010 Dec
Non-occupational allergic contact dermatitis from 2-N-octyl-4-isothiazolin-3-one in a Japanese mattress gel-sheet used for cooling.
2010 May
Patents
Name Type Language
OCTHILINONE
ISO   MI  
Common Name English
OCTYLISOTHIAZOLINONE [INCI]
Common Name English
OCTHILINONE [ISO]
Common Name English
3(2H)-ISOTHIAZOLONE, 2-OCTYL
Common Name English
2-OCTYL-1,2-THIAZOL-3(2H)-ONE
Systematic Name English
2-OCTYL-4-ISOTHIAZOLIN-3-ONE
Systematic Name English
KORALONE 500 PRESERVATIVE
Brand Name English
RH 893
Code English
RH-893
Code English
OCTYLISOTHIAZOLINONE
INCI  
INCI  
Official Name English
KATHON
Brand Name English
2-OCTYL-3(2H)-ISOTHIAZOLONE
Systematic Name English
OCTHILINONE [MI]
Common Name English
Classification Tree Code System Code
Food Contact Sustance Notif, (FCN No.) FCN NO. 698
Created by admin on Sat Dec 16 18:27:32 GMT 2023 , Edited by admin on Sat Dec 16 18:27:32 GMT 2023
Food Contact Sustance Notif, (FCN No.) FCN NO. 788
Created by admin on Sat Dec 16 18:27:32 GMT 2023 , Edited by admin on Sat Dec 16 18:27:32 GMT 2023
EPA PESTICIDE CODE 99901
Created by admin on Sat Dec 16 18:27:32 GMT 2023 , Edited by admin on Sat Dec 16 18:27:32 GMT 2023
Code System Code Type Description
EVMPD
SUB20858
Created by admin on Sat Dec 16 18:27:32 GMT 2023 , Edited by admin on Sat Dec 16 18:27:32 GMT 2023
PRIMARY
CAS
26530-20-1
Created by admin on Sat Dec 16 18:27:32 GMT 2023 , Edited by admin on Sat Dec 16 18:27:32 GMT 2023
PRIMARY
SMS_ID
100000086789
Created by admin on Sat Dec 16 18:27:32 GMT 2023 , Edited by admin on Sat Dec 16 18:27:32 GMT 2023
PRIMARY
FDA UNII
4LFS24GD0V
Created by admin on Sat Dec 16 18:27:32 GMT 2023 , Edited by admin on Sat Dec 16 18:27:32 GMT 2023
PRIMARY
ECHA (EC/EINECS)
247-761-7
Created by admin on Sat Dec 16 18:27:32 GMT 2023 , Edited by admin on Sat Dec 16 18:27:32 GMT 2023
PRIMARY
PUBCHEM
33528
Created by admin on Sat Dec 16 18:27:32 GMT 2023 , Edited by admin on Sat Dec 16 18:27:32 GMT 2023
PRIMARY
MESH
C035331
Created by admin on Sat Dec 16 18:27:32 GMT 2023 , Edited by admin on Sat Dec 16 18:27:32 GMT 2023
PRIMARY
DAILYMED
4LFS24GD0V
Created by admin on Sat Dec 16 18:27:32 GMT 2023 , Edited by admin on Sat Dec 16 18:27:32 GMT 2023
PRIMARY
ALANWOOD
octhilinone
Created by admin on Sat Dec 16 18:27:32 GMT 2023 , Edited by admin on Sat Dec 16 18:27:32 GMT 2023
PRIMARY
CHEBI
81936
Created by admin on Sat Dec 16 18:27:32 GMT 2023 , Edited by admin on Sat Dec 16 18:27:32 GMT 2023
PRIMARY
MERCK INDEX
m8114
Created by admin on Sat Dec 16 18:27:32 GMT 2023 , Edited by admin on Sat Dec 16 18:27:32 GMT 2023
PRIMARY Merck Index
EPA CompTox
DTXSID1025805
Created by admin on Sat Dec 16 18:27:32 GMT 2023 , Edited by admin on Sat Dec 16 18:27:32 GMT 2023
PRIMARY