Kathon (HCID 41679)

概要

industrial biocide & cosmetic preservative formulation; contains methylcholoro-isothiazolinone and methylcholoroisothiazolinone

名称と識別子

優先名称: Kathon
IUPAC: 5-chloro-2-methyl-1,2-thiazol-3-one;2-methyl-1,2-thiazol-3-one
現地名: イソチアゾリノン
英語名: Methylchloroisothiazolinone/methylisothiazolinone mixture (MCIT/MIT)
分子式: C4H5NOS.C4H4ClNOS
分子量: 264.75

名称と別名

55965-84-9Kathon 886Kathon LX15O9QS218W3(2H)-Isothiazolone, 5-chloro-2-methyl-, mixt. with 2-methyl-3(2H)-isothiazoloneKathon 886 biocideMBC-215RefChem:151011KathonKathon biocideKathon CGKathon 886MW

名称をさらに表示

イソチアゾリノンカトン8862-メチル-5-クロロイソチアゾール-3(2H)-オン/2-メチルイソチアゾール-3(2H)-オンカトン866MW2-メチル-4-イソチアゾリン-3-オン/5-クロロ-2-メチル-4-イソチアゾリン-3-オンIsothiazolinone chloride5-Chloro-2-methyl-3(2H)-isothiazolone with 2-methyl-3(2H)-isothiazoloneCon WTNeoCideSidchem 715CMIT/MIT 1.5CGCMIT/MIT B/PLUSCMI/MI Kathon 886

Zonen FProClin 3002-Methylisothiazol-3(2H)-one compound with 5-chloro-2-methylisothiazol-3(2H)-one(14%in H2O)2-Methylisothiazol-3(2H)-one compound with 5-chloro-2-methylisothiazol-3(2H)-one5-chloro-2-methyl-1,2-thiazol-3-one;2-methyl-1,2-thiazol-3-oneBio-Perge5-Chloro-2-methyl-3(2H)-isothiazolone mixt. with 2-methyl-3(2H)-isothiazoloneKathon WT

データベース識別子

CAS: 55965-84-9
PubChem CID: 41679
ChEMBL: CHEMBL108095
EC Number: 611-341-5、911-418-6、932-593-5

物性

構造計算による物性

極性表面積: 91.2 Å²
水素結合供与体数: 0
水素結合受容体数: 4
回転可能結合数: 0
重原子数: 15
形式電荷: 0
複雑度: 277

実験および物理化学的性質

FragrancesFragrance Ingredient (3(2H)_-_Isothiazolone, 5-_chloro-_2-_methyl-_, mixt. with 2-_methyl-_3(2H)_-_isothiazolone) -> IFRA transparency List

Food Contact SubstancesFCS -> FDA Inventory of Food Contact Substances Listed in 21 CFR

Physical DescriptionLiquid

物理化学的性質

沸点: 100.1 ℃ · 100.1℃ at 101.325kPa
比重(密度): 20 · d20 1.19
蒸気圧: 0.003 · 0.003-17Pa at 20-45℃
貯蔵温度: Sealed in dry,Room Temperature
溶解性: Chloroform (Soluble), DMSO (Slightly), Methanol (Slightly), Water
外見: Liquid
色: Colorless to light yellow
PH: 3.43 at · 3.43 at 20℃ and 10g/L
InChI: InChI=1S/C4H4ClNOS.C4H5NOS/c1-6-4(7)2-3(5)8-6;1-5-4(6)2-3-7-5/h2H,1H3;2-3H,1H3
InChIKey: QYYMDNHUJFIDDQ-UHFFFAOYSA-N
SMILES: O=C1C=C(SN1C)Cl.O=C1C=CSN1C
LogP: -0.34 · -0.34-0.81 at 10-30℃ and pH5-9
表面張力: 72.6 · 72.6-73mN/m at 1-1.106g/L and 19.5-20℃
EPAの化学物質情報: 5 · 5-Chloro-2-methyl-3(2H)-isothiazolone mixt. with 2-methyl-3(2H)-isothiazolone (55965-84-9)

安全と法規制

GHS分類

GHS Classification · 6 件

Danger

H301: Toxic if swallowed [Danger Acute toxicity, oral]

P260, P261, P262, P264, P264+P265, P270, P271, P272, P273, P280, P284, P301+P316, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P320, P321, P330, P333+P317, P361+P364, P362+P364, P363, P391, P403+P233, P405, and P501 (click each P-code to see the statement)

This chemical does not meet GHS hazard criteria for < 0.1% (1 of 1945) of reports.

Danger

H301 (99.8%): Toxic if swallowed [Danger Acute toxicity, oral]

危険有害性情報

Regulatory Information · 3 件

3(2H)-Isothiazolone, 5-chloro-2-methyl-, mixt. with 2-methyl-3(2H)-isothiazolone is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 3(2H)-Isothiazolone, 5-chloro-2-methyl-, mixt. with 2-methyl-3(2H)-isothiazolone are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)

Status: Active Update: 14-03-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/23870

Mixture of methylchloroisothiazolinone and methylisothiazolinone: Does not have an individual approval but may be used under an appropriate group standard

Other Safety InformationPEC / SN / Other assessments - Common skin sensitisersâhazard classification: Health

Hazard Classes and Categories · 5 件

Acute Tox. 3 (99.8%)

Acute Tox. 3 (100%)

Acute Tox. 4 (100%)

Acute toxicity (inhalation) - category 2

Acute Tox. 2

安全データ

毒性: LD50 (mg/kg) orally in rabbits: 30; i.p. in male, female rats: 4.6, 4.3; LC50 (6 day) in trout, sunfish (mg/l): 0.14, 0.54; LC50 (8 day dietary) in Bobwhite quail, Peking duck (mg/kg/day): >60, >100 (J. Am. Coll. Toxicol.)

化学と産業

薬理情報

MeSH Pharmacological ClassificationChemical agents that increase the rate of genetic mutation by interfering with the function of nucleic acids. A clastogen is a specific mutagen that causes breaks in chromosomes.

用途と製造

U.S. Production2023: <50,000 lb

Consumer UsesNot Known or Reasonably Ascertainable

Industry UsesNot Known or Reasonably Ascertainable

Household ProductsInformation on 63 consumer products that contain Kathon biocide in the following categories is provided:

Use ClassificationFragrance Ingredients

General Manufacturing InformationNot Known or Reasonably Ascertainable

応用分野 · 2 件

説明Kathon 886 metalwork fluid is a mixture of the two isothiazoliones contained in Kathon CG, at a 13.9% concentration. It is mainly contained in metalwork fluids. As an active component of Aigezid Ⅱ and contained in a water bath used for phtotographic development, it caused contact dermatitis in a photograph developer.

使用Antimicrobial preservative in cosmetics, hygeine products, paints, emulsions, cutting oils, paper coatings, and water storage and cooling units.

上流・下流製品情報

上流原料

メチルアミン

サプライヤー50 社

郑州阿尔法化工有限公司+86-18530059196 · [email protected]

湖北永阔科技有限公司027-59223108 15972152991 · [email protected]

湖北万得化工有限公司15377098680 15377098680 · [email protected]

南通润丰石油化工有限公司66017690 19952660367 · [email protected]

武汉欣扬瑞和化学科技有限公司13720274133 · [email protected]

イソチアゾリノン

基本情報

概要