OCTHILINONE

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 Search

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

PubMed

Title	Date	PubMed
Fungal colonization and succession on newly painted buildings and the effect of biocide.	2002 Feb 1	19709196
Occupational contact allergy and dermatitis from methylisothiazolinone after contact with wallcovering glue and after a chemical burn from a biocide.	2004 Dec	15842065
Contact dermatitis from 2-n-octyl-4-isothiazolin-3-one in a PhD student.	2004 Jan	15059108
Influence of starvation, surface attachment and biofilm growth on the biocide susceptibility of the biodeteriogenic yeast Aureobasidium pullulans.	2006 Aug	16882139
Analysis of isothiazolinones in environmental waters by gas chromatography-mass spectrometry.	2007 Sep 14	17681349
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 Apr 18	18313196
Analyzing cytotoxic effects of selected isothiazol-3-one biocides using the toxic ratio concept and structure-activity relationship considerations.	2009 Dec	19928874
A critical cysteine residue in monoacylglycerol lipase is targeted by a new class of isothiazolinone-based enzyme inhibitors.	2009 Jul	19486005
Analysis of isothiazolinone biocides in paper for food packaging by ultra-high-performance liquid chromatography-tandem mass spectrometry.	2010 Dec	20960358
Non-occupational allergic contact dermatitis from 2-N-octyl-4-isothiazolin-3-one in a Japanese mattress gel-sheet used for cooling.	2010 May	20536482

Patents

Substance Class	Chemical Created by `admin` on `Sat Dec 16 18:27:32 GMT 2023` Edited by `admin` on `Sat Dec 16 18:27:32 GMT 2023`
Record UNII	4LFS24GD0V
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

OCTHILINONE

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

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