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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
Molecular Formula C11H19NOS
Molecular Weight 213.34
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

2012
608
PubMed

PubMed

TitleDatePubMed
Analysis of isothiazolinone biocides in paper for food packaging by ultra-high-performance liquid chromatography-tandem mass spectrometry.
2010-12
Non-occupational allergic contact dermatitis from 2-N-octyl-4-isothiazolin-3-one in a Japanese mattress gel-sheet used for cooling.
2010-05
Analyzing cytotoxic effects of selected isothiazol-3-one biocides using the toxic ratio concept and structure-activity relationship considerations.
2009-12
A critical cysteine residue in monoacylglycerol lipase is targeted by a new class of isothiazolinone-based enzyme inhibitors.
2009-07
Structure-activity relationships for the impact of selected isothiazol-3-one biocides on glutathione metabolism and glutathione reductase of the human liver cell line Hep G2.
2008-04-18
Occupational allergic contact dermatitis to 2-N-octyl-4-isothiazolin-3-one.
2008
Analysis of isothiazolinones in environmental waters by gas chromatography-mass spectrometry.
2007-09-14
Occupational allergic contact dermatitis from 2-N-octyl-4-isothiazolin-3-one.
2007-03
Influence of starvation, surface attachment and biofilm growth on the biocide susceptibility of the biodeteriogenic yeast Aureobasidium pullulans.
2006-08
Fungal colonization of soil-buried plasticized polyvinyl chloride (pPVC) and the impact of incorporated biocides.
2006-06
Occupational contact allergy and dermatitis from methylisothiazolinone after contact with wallcovering glue and after a chemical burn from a biocide.
2004-12
Contact dermatitis from 2-n-octyl-4-isothiazolin-3-one in a PhD student.
2004-01
In situ quantification of biocide efficacy using GFP transformed Aureobasidium pullulans.
2004
Fungal colonization and succession on newly painted buildings and the effect of biocide.
2002-02-01
Patents

Patents

05118681
1
05300672
2
JP2000053510A
2
JP2002128608A
4
JP2002544144A
1
JP2003095828A
2
JP2004315507A
1
JP2008195938A
1
JP2010235512A
1
JP2012500865A
16
JPH04134001A
1
JPH0525319A
1
JPH08325102A
1
JPH10168069A
1
JPH10273408A
1
JPS06197204A
1
Substance Class Chemical
Created
by admin
on Wed Apr 02 11:13:00 GMT 2025
Edited
by admin
on Wed Apr 02 11:13:00 GMT 2025
Record UNII
4LFS24GD0V
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
OCTHILINONE
ISO   MI  
Common Name English
OCTYLISOTHIAZOLINONE
INCI  
INCI  
Preferred 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
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 Wed Apr 02 11:13:00 GMT 2025 , Edited by admin on Wed Apr 02 11:13:00 GMT 2025
Food Contact Sustance Notif, (FCN No.) FCN NO. 788
Created by admin on Wed Apr 02 11:13:00 GMT 2025 , Edited by admin on Wed Apr 02 11:13:00 GMT 2025
EPA PESTICIDE CODE 99901
Created by admin on Wed Apr 02 11:13:00 GMT 2025 , Edited by admin on Wed Apr 02 11:13:00 GMT 2025
Code System Code Type Description
EVMPD
SUB20858
Created by admin on Wed Apr 02 11:13:00 GMT 2025 , Edited by admin on Wed Apr 02 11:13:00 GMT 2025
PRIMARY
CAS
26530-20-1
Created by admin on Wed Apr 02 11:13:00 GMT 2025 , Edited by admin on Wed Apr 02 11:13:00 GMT 2025
PRIMARY
SMS_ID
100000086789
Created by admin on Wed Apr 02 11:13:00 GMT 2025 , Edited by admin on Wed Apr 02 11:13:00 GMT 2025
PRIMARY
FDA UNII
4LFS24GD0V
Created by admin on Wed Apr 02 11:13:00 GMT 2025 , Edited by admin on Wed Apr 02 11:13:00 GMT 2025
PRIMARY
ECHA (EC/EINECS)
247-761-7
Created by admin on Wed Apr 02 11:13:00 GMT 2025 , Edited by admin on Wed Apr 02 11:13:00 GMT 2025
PRIMARY
PUBCHEM
33528
Created by admin on Wed Apr 02 11:13:00 GMT 2025 , Edited by admin on Wed Apr 02 11:13:00 GMT 2025
PRIMARY
MESH
C035331
Created by admin on Wed Apr 02 11:13:00 GMT 2025 , Edited by admin on Wed Apr 02 11:13:00 GMT 2025
PRIMARY
DAILYMED
4LFS24GD0V
Created by admin on Wed Apr 02 11:13:00 GMT 2025 , Edited by admin on Wed Apr 02 11:13:00 GMT 2025
PRIMARY
ALANWOOD
octhilinone
Created by admin on Wed Apr 02 11:13:00 GMT 2025 , Edited by admin on Wed Apr 02 11:13:00 GMT 2025
PRIMARY
CHEBI
81936
Created by admin on Wed Apr 02 11:13:00 GMT 2025 , Edited by admin on Wed Apr 02 11:13:00 GMT 2025
PRIMARY
MERCK INDEX
m8114
Created by admin on Wed Apr 02 11:13:00 GMT 2025 , Edited by admin on Wed Apr 02 11:13:00 GMT 2025
PRIMARY Merck Index
EPA CompTox
DTXSID1025805
Created by admin on Wed Apr 02 11:13:00 GMT 2025 , Edited by admin on Wed Apr 02 11:13:00 GMT 2025
PRIMARY
NIH
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