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methylisothiazolinone
4-Isothiazolin-3-one bearing a methyl group on the nitrogen atom. It is a powerful biocide and preservative.

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03. Biological Effects of Specific Chemicals

			antimicrobial agent [CHEBI:33281] (927)

methylisothiazolinone [CHEBI:53620] (1)

				antifungal agent [CHEBI:35718] (130)

methylisothiazolinone [CHEBI:53620] (1)

05. Industrial Uses

			pesticide [CHEBI:25944] (211)

				antifouling biocide [CHEBI:51076] (6)

methylisothiazolinone [CHEBI:53620] (1)

08. Chemical Category

			main group molecular entity [CHEBI:33579] (25650)

					s-block molecular entity [CHEBI:33674] (7287)

							hydrogen molecular entity [CHEBI:33608] (6932)

								hydrides [CHEBI:33692] (1374)

									organic hydride [CHEBI:37175] (1178)

organic fundamental parent [CHEBI:33245] (1178)

heterocyclic organic fundamental parent [CHEBI:35552] (537)

mancude organic heterocyclic parent [CHEBI:35571] (481)

mancude organic heteromonocyclic parent [CHEBI:35555] (392)

azole [CHEBI:68452] (357)

thiazoles [CHEBI:48901] (64)

1,2-thiazole [CHEBI:48902] (5)

methylisothiazolinone [CHEBI:53620] (1)

organic mancude parent [CHEBI:35573] (488)

mancude organic heterocyclic parent [CHEBI:35571] (481)

mancude organic heteromonocyclic parent [CHEBI:35555] (392)

azole [CHEBI:68452] (357)

thiazoles [CHEBI:48901] (64)

1,2-thiazole [CHEBI:48902] (5)

methylisothiazolinone [CHEBI:53620] (1)

					p-block molecular entity [CHEBI:33675] (25343)

						pnictogen molecular entity [CHEBI:33302] (10027)

								nitrogen molecular entity [CHEBI:51143] (7930)

									organonitrogen compound [CHEBI:35352] (6705)

organonitrogen heterocyclic compound [CHEBI:38101] (3202)

azole [CHEBI:68452] (357)

thiazoles [CHEBI:48901] (64)

1,2-thiazole [CHEBI:48902] (5)

methylisothiazolinone [CHEBI:53620] (1)

						chalcogen molecular entity [CHEBI:33304] (15225)

								sulfur molecular entity [CHEBI:26835] (1541)

organosulfur compound [CHEBI:33261] (1005)

organosulfur heterocyclic compound [CHEBI:38106] (367)

thiazoles [CHEBI:48901] (64)

1,2-thiazole [CHEBI:48902] (5)

methylisothiazolinone [CHEBI:53620] (1)

								organochalcogen compound [CHEBI:36962] (11874)

									organosulfur compound [CHEBI:33261] (1005)

organosulfur heterocyclic compound [CHEBI:38106] (367)

thiazoles [CHEBI:48901] (64)

1,2-thiazole [CHEBI:48902] (5)

methylisothiazolinone [CHEBI:53620] (1)

						carbon group molecular entity [CHEBI:33582] (23847)

							organic molecular entity [CHEBI:50860] (23769)

								organic fundamental parent [CHEBI:33245] (1178)

heterocyclic organic fundamental parent [CHEBI:35552] (537)

mancude organic heterocyclic parent [CHEBI:35571] (481)

mancude organic heteromonocyclic parent [CHEBI:35555] (392)

azole [CHEBI:68452] (357)

thiazoles [CHEBI:48901] (64)

1,2-thiazole [CHEBI:48902] (5)

methylisothiazolinone [CHEBI:53620] (1)

organic mancude parent [CHEBI:35573] (488)

mancude organic heterocyclic parent [CHEBI:35571] (481)

mancude organic heteromonocyclic parent [CHEBI:35555] (392)

azole [CHEBI:68452] (357)

thiazoles [CHEBI:48901] (64)

1,2-thiazole [CHEBI:48902] (5)

methylisothiazolinone [CHEBI:53620] (1)

								heteroorganic entity [CHEBI:33285] (15197)

organic heterocyclic compound [CHEBI:24532] (5243)

organic heteromonocyclic compound [CHEBI:25693] (2004)

mancude organic heteromonocyclic parent [CHEBI:35555] (392)

azole [CHEBI:68452] (357)

thiazoles [CHEBI:48901] (64)

1,2-thiazole [CHEBI:48902] (5)

methylisothiazolinone [CHEBI:53620] (1)

heteroarene [CHEBI:33833] (1648)

monocyclic heteroarene [CHEBI:38179] (375)

azole [CHEBI:68452] (357)

thiazoles [CHEBI:48901] (64)

1,2-thiazole [CHEBI:48902] (5)

methylisothiazolinone [CHEBI:53620] (1)

organonitrogen heterocyclic compound [CHEBI:38101] (3202)

azole [CHEBI:68452] (357)

thiazoles [CHEBI:48901] (64)

1,2-thiazole [CHEBI:48902] (5)

methylisothiazolinone [CHEBI:53620] (1)

organosulfur heterocyclic compound [CHEBI:38106] (367)

thiazoles [CHEBI:48901] (64)

1,2-thiazole [CHEBI:48902] (5)

methylisothiazolinone [CHEBI:53620] (1)

organonitrogen compound [CHEBI:35352] (6705)

organonitrogen heterocyclic compound [CHEBI:38101] (3202)

azole [CHEBI:68452] (357)

thiazoles [CHEBI:48901] (64)

1,2-thiazole [CHEBI:48902] (5)

methylisothiazolinone [CHEBI:53620] (1)

organochalcogen compound [CHEBI:36962] (11874)

organosulfur compound [CHEBI:33261] (1005)

organosulfur heterocyclic compound [CHEBI:38106] (367)

thiazoles [CHEBI:48901] (64)

1,2-thiazole [CHEBI:48902] (5)

methylisothiazolinone [CHEBI:53620] (1)

								organic molecule [CHEBI:72695] (11399)

									organic cyclic compound [CHEBI:33832] (7633)

organic heterocyclic compound [CHEBI:24532] (5243)

organic heteromonocyclic compound [CHEBI:25693] (2004)

mancude organic heteromonocyclic parent [CHEBI:35555] (392)

azole [CHEBI:68452] (357)

thiazoles [CHEBI:48901] (64)

1,2-thiazole [CHEBI:48902] (5)

methylisothiazolinone [CHEBI:53620] (1)

heteroarene [CHEBI:33833] (1648)

monocyclic heteroarene [CHEBI:38179] (375)

azole [CHEBI:68452] (357)

thiazoles [CHEBI:48901] (64)

1,2-thiazole [CHEBI:48902] (5)

methylisothiazolinone [CHEBI:53620] (1)

organonitrogen heterocyclic compound [CHEBI:38101] (3202)

azole [CHEBI:68452] (357)

thiazoles [CHEBI:48901] (64)

1,2-thiazole [CHEBI:48902] (5)

methylisothiazolinone [CHEBI:53620] (1)

organosulfur heterocyclic compound [CHEBI:38106] (367)

thiazoles [CHEBI:48901] (64)

1,2-thiazole [CHEBI:48902] (5)

methylisothiazolinone [CHEBI:53620] (1)

organic aromatic compound [CHEBI:33659] (3593)

heteroarene [CHEBI:33833] (1648)

monocyclic heteroarene [CHEBI:38179] (375)

azole [CHEBI:68452] (357)

thiazoles [CHEBI:48901] (64)

1,2-thiazole [CHEBI:48902] (5)

methylisothiazolinone [CHEBI:53620] (1)

			mancude ring [CHEBI:35568] (488)

					organic mancude parent [CHEBI:35573] (488)

						mancude organic heterocyclic parent [CHEBI:35571] (481)

							mancude organic heteromonocyclic parent [CHEBI:35555] (392)

								azole [CHEBI:68452] (357)

									thiazoles [CHEBI:48901] (64)

1,2-thiazole [CHEBI:48902] (5)

methylisothiazolinone [CHEBI:53620] (1)

			polyatomic entity [CHEBI:36357] (18777)

				molecule [CHEBI:25367] (11520)

						cyclic compound [CHEBI:33595] (7817)

								aromatic compound [CHEBI:33655] (3799)

organic aromatic compound [CHEBI:33659] (3593)

heteroarene [CHEBI:33833] (1648)

monocyclic heteroarene [CHEBI:38179] (375)

azole [CHEBI:68452] (357)

thiazoles [CHEBI:48901] (64)

1,2-thiazole [CHEBI:48902] (5)

methylisothiazolinone [CHEBI:53620] (1)

								monocyclic compound [CHEBI:33661] (2007)

heteromonocyclic compound [CHEBI:33670] (2004)

organic heteromonocyclic compound [CHEBI:25693] (2004)

mancude organic heteromonocyclic parent [CHEBI:35555] (392)

azole [CHEBI:68452] (357)

thiazoles [CHEBI:48901] (64)

1,2-thiazole [CHEBI:48902] (5)

methylisothiazolinone [CHEBI:53620] (1)

								organic cyclic compound [CHEBI:33832] (7633)

organic heterocyclic compound [CHEBI:24532] (5243)

organic heteromonocyclic compound [CHEBI:25693] (2004)

mancude organic heteromonocyclic parent [CHEBI:35555] (392)

azole [CHEBI:68452] (357)

thiazoles [CHEBI:48901] (64)

1,2-thiazole [CHEBI:48902] (5)

methylisothiazolinone [CHEBI:53620] (1)

heteroarene [CHEBI:33833] (1648)

monocyclic heteroarene [CHEBI:38179] (375)

azole [CHEBI:68452] (357)

thiazoles [CHEBI:48901] (64)

1,2-thiazole [CHEBI:48902] (5)

methylisothiazolinone [CHEBI:53620] (1)

organonitrogen heterocyclic compound [CHEBI:38101] (3202)

azole [CHEBI:68452] (357)

thiazoles [CHEBI:48901] (64)

1,2-thiazole [CHEBI:48902] (5)

methylisothiazolinone [CHEBI:53620] (1)

organosulfur heterocyclic compound [CHEBI:38106] (367)

thiazoles [CHEBI:48901] (64)

1,2-thiazole [CHEBI:48902] (5)

methylisothiazolinone [CHEBI:53620] (1)

organic aromatic compound [CHEBI:33659] (3593)

heteroarene [CHEBI:33833] (1648)

monocyclic heteroarene [CHEBI:38179] (375)

azole [CHEBI:68452] (357)

thiazoles [CHEBI:48901] (64)

1,2-thiazole [CHEBI:48902] (5)

methylisothiazolinone [CHEBI:53620] (1)

								heterocyclic compound [CHEBI:5686] (5275)

									organic heterocyclic compound [CHEBI:24532] (5243)

organic heteromonocyclic compound [CHEBI:25693] (2004)

mancude organic heteromonocyclic parent [CHEBI:35555] (392)

azole [CHEBI:68452] (357)

thiazoles [CHEBI:48901] (64)

1,2-thiazole [CHEBI:48902] (5)

methylisothiazolinone [CHEBI:53620] (1)

heteroarene [CHEBI:33833] (1648)

monocyclic heteroarene [CHEBI:38179] (375)

azole [CHEBI:68452] (357)

thiazoles [CHEBI:48901] (64)

1,2-thiazole [CHEBI:48902] (5)

methylisothiazolinone [CHEBI:53620] (1)

organonitrogen heterocyclic compound [CHEBI:38101] (3202)

azole [CHEBI:68452] (357)

thiazoles [CHEBI:48901] (64)

1,2-thiazole [CHEBI:48902] (5)

methylisothiazolinone [CHEBI:53620] (1)

organosulfur heterocyclic compound [CHEBI:38106] (367)

thiazoles [CHEBI:48901] (64)

1,2-thiazole [CHEBI:48902] (5)

methylisothiazolinone [CHEBI:53620] (1)

									heteromonocyclic compound [CHEBI:33670] (2004)

organic heteromonocyclic compound [CHEBI:25693] (2004)

mancude organic heteromonocyclic parent [CHEBI:35555] (392)

azole [CHEBI:68452] (357)

thiazoles [CHEBI:48901] (64)

1,2-thiazole [CHEBI:48902] (5)

methylisothiazolinone [CHEBI:53620] (1)

						organic molecule [CHEBI:72695] (11399)

							organic cyclic compound [CHEBI:33832] (7633)

								organic heterocyclic compound [CHEBI:24532] (5243)

organic heteromonocyclic compound [CHEBI:25693] (2004)

mancude organic heteromonocyclic parent [CHEBI:35555] (392)

azole [CHEBI:68452] (357)

thiazoles [CHEBI:48901] (64)

1,2-thiazole [CHEBI:48902] (5)

methylisothiazolinone [CHEBI:53620] (1)

heteroarene [CHEBI:33833] (1648)

monocyclic heteroarene [CHEBI:38179] (375)

azole [CHEBI:68452] (357)

thiazoles [CHEBI:48901] (64)

1,2-thiazole [CHEBI:48902] (5)

methylisothiazolinone [CHEBI:53620] (1)

organonitrogen heterocyclic compound [CHEBI:38101] (3202)

azole [CHEBI:68452] (357)

thiazoles [CHEBI:48901] (64)

1,2-thiazole [CHEBI:48902] (5)

methylisothiazolinone [CHEBI:53620] (1)

organosulfur heterocyclic compound [CHEBI:38106] (367)

thiazoles [CHEBI:48901] (64)

1,2-thiazole [CHEBI:48902] (5)

methylisothiazolinone [CHEBI:53620] (1)

								organic aromatic compound [CHEBI:33659] (3593)

									heteroarene [CHEBI:33833] (1648)

monocyclic heteroarene [CHEBI:38179] (375)

azole [CHEBI:68452] (357)

thiazoles [CHEBI:48901] (64)

1,2-thiazole [CHEBI:48902] (5)

methylisothiazolinone [CHEBI:53620] (1)

				heteroatomic molecular entity [CHEBI:37577] (13672)

					hydrides [CHEBI:33692] (1374)

						organic hydride [CHEBI:37175] (1178)

							organic fundamental parent [CHEBI:33245] (1178)

								heterocyclic organic fundamental parent [CHEBI:35552] (537)

mancude organic heterocyclic parent [CHEBI:35571] (481)

mancude organic heteromonocyclic parent [CHEBI:35555] (392)

azole [CHEBI:68452] (357)

thiazoles [CHEBI:48901] (64)

1,2-thiazole [CHEBI:48902] (5)

methylisothiazolinone [CHEBI:53620] (1)

								organic mancude parent [CHEBI:35573] (488)

									mancude organic heterocyclic parent [CHEBI:35571] (481)

mancude organic heteromonocyclic parent [CHEBI:35555] (392)

azole [CHEBI:68452] (357)

thiazoles [CHEBI:48901] (64)

1,2-thiazole [CHEBI:48902] (5)

methylisothiazolinone [CHEBI:53620] (1)

ChEBI Compound Accession Identifier:

[CHEBI:53620]

ChEBI Compound Description:

4-Isothiazolin-3-one bearing a methyl group on the nitrogen atom. It is a powerful biocide and preservative.

ChEBI Compound Identification Number:

53620

ChEBI InChI Value:

InChI=1S/C4H5NOS/c1-5-4(6)2-3-7-5/h2-3H,1H3

ChEBI InChIKey Value:

BEGLCMHJXHIJLR-UHFFFAOYSA-N

ChEBI Compound Name:

methylisothiazolinone

ChEBI SMILES Value:

Cn1sccc1=O

ChEBI Substance ID:

87246489

ChEBI URL:

ChEBI:53620

ChemSpider ID:

36393

Ontomatica Chemical Accession Key (OnChAKey):

BEGLCMHJXHIJLR_UHFFFAOYSA_N_000_000000

PubChem Compound ID:

39800