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MIT hydrochloride structure, CAS 26172-54-3

MIT hydrochloride

CAS Number26172-54-3

Synonyms2-Methyl-3-isothiazoloneHydrochloride; MIT,Methylisothiazolinone hydrochloride; 2-methyl-1,2-thiazol-3-one,hydrochloride; EINECS 247-499-3; MFCD06804636

Molecular FormulaC4H6ClNOS

Molecular Weight151.61500

Purity98%

Density

Boiling Point

Melting Point

Flash Point

Appearanceliquid

EINECS247-499-3

MSDSChineseEnglish

SymbolTransport

Signal WordWarning

Cat. No.: 2A-9008318 Purity: 98%
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Quality Control of [ 26172-54-3 ] Purity: 98% SDS Specification MoL

COA NMR CNMR HPLC LC-MS
Chemical & Physical Properties
CAS Number26172-54-3
Catalog No.2A-9008318
Chinese Name2-甲基-4-异噻唑啉-3-酮盐酸盐
Synonyms2-Methyl-3-isothiazoloneHydrochloride; MIT,Methylisothiazolinone hydrochloride; 2-methyl-1,2-thiazol-3-one,hydrochloride; EINECS 247-499-3; MFCD06804636
Molecular FormulaC4H6ClNOS
Molecular Weight151.61500
Purity98
Appearanceliquid
Storage Condition2-8°C
ApplicationMethylisothiazolinone hydrochloride, a component of the biocide Kathon CG, is an isothiazolone derivative widely used as a preservative. Methylisothiazolinone hydrochloride is also a moderate sensitiz
EINECS247-499-3
HTC2934999090
UN(IATA)UN 1759
SMILESCl.Cn1sccc1=O
InChI1S/C4H5NOS.ClH/c1-5-4(6)2-3-7-5;/h2-3H,1H3;1H
InChI KeySJXPQSRCFCPWQQ-UHFFFAOYSA-N
NACRES CodeNA.76
UNSPSC51102829
Hazard SymbolsTransport
Risk CodesR34;R42/43
Safety DescriptionS26;S36/37/39;S45
MSDSmsds/8318_1_26172_54_3.pdf
BioactivityMethylisothiazolinone hydrochloride is the constituent of the biocide Kathon CG. Methylisothiazolinone hydrochloride is an isothiazolone derivative widely used as a preservative. Methylisothiazolinone hydrochloride is also a moderate sensitizer and reacts with GSH[1][2]. Related Catalog Research Areas >> Infection Signaling Pathways >> Anti-infection >> Bacterial References [1]. Rubén Alvarez-Sánchez, et al. Covalent Binding of the 13C-labeled Skin Sensitizers 5-chloro-2-methylisothiazol-3-one (MCI) and 2-methylisothiazol-3-one (MI) to a Model Peptide and Glutathione. Bioorg Med Chem Lett. 2004 Jan 19;14(2):365-8. [2]. Aynur O Aptula, et al. From Experiment to Theory: Molecular Orbital Parameters to Interpret the Skin Sensitization Potential of 5-chloro-2-methylisothiazol-3-one and 2-methylisothiazol-3-one. Chem Res Toxicol. 2005 Feb;18(2):324-9. Chemical & Physical Properties Molecular Formula C4H6ClNOS Molecular Weight 151.61500 Exact Mass 150.98600 PSA 50.24000 LogP 1.24880 InChIKey SJXPQSRCFCPWQQ-UHFFFAOYSA-N SMILES Cl.Cn1sccc1=O Storage condition 2-8°C
Use ofMethylisothiazolinone hydrochloride is the constituent of the biocide Kathon CG. Methylisothiazolinone hydrochloride is an isothiazolone derivative widely used as a preservative. Methylisothiazolinone hydrochloride is also a moderate sensitizer and reacts with GSH[1][2]. Properties Articles31 Name 2-Methyl-3-isothiazolone Hydrochloride Synonym More Synonyms Methylisothiazolinone hydrochloride Biological Activity Description Methylisothiazolinone hydrochloride is the constituent of the biocide Kathon CG. Methylisothiazolinone hydrochloride is an isothiazolone derivative widely used as a preservative. Methylisothiazolinone hydrochloride is also a moderate sensitizer and reacts with GSH[1][2]. Related Catalog Research Areas >> Infection Signaling Pathways >> Anti-infection >> Bacterial References [2]. Aynur O Aptula, et al. From Experiment to Theory: Molecular Orbital Parameters to Interpret the Skin Sensitization Potential of 5-chloro-2-methylisothiazol-3-one and 2-methylisothiazol-3-one. Chem Res Toxicol. 2005 Feb;18(2):324-9. Chemical & Physical Properties Exact Mass 150.98600 PSA 50.24000 LogP 1.24880 InChIKey SJXPQSRCFCPWQQ-UHFFFAOYSA-N SMILES Cl.Cn1sccc1=O
Tax Rebate13.0%
SupervisionNone. MFN tariff: 6.5%. Ordinary tariff: 20.0%
Transport InfoShipping Name: UN
MSDS Transport InfoModule 14. Shipping information 14.1 UN dangerous goods number European Dangerous Regulations for land transport: 1759 International Dangerous Regulations for sea transport: 1759 International Dangerous Regulations for air transport: 1759 14.2 United Nations shipping name European Land Transport Dangerous Regulations: CORROSIVE SOLID, N.O.S. (2-Methyl-2H-isothiazol-3-one hydrochloride) IMDG: CORROSIVE SOLID, N.O.S. (2-Methyl-2H-isothiazol-3-one hydrochloride) International air transport hazard regulations: Corrosive solid, n.o.s. (2-Methyl-2H-isothiazol-3-one hydrochloride) 14.3 Transport hazard categories European Dangerous Regulations for land transport: 8 International Dangerous Regulations for sea transport: 8 International Dangerous Regulations for air transport: 8 14.4 Package group European Dangerous Regulations for land transport: II International Dangerous Regulations for sea transport: II International Dangerous Regulations for air transport: II 14.5 Environmental hazards European Land Transport Danger Regulations: No International Maritime Danger Regulations International Air Transport Danger Regulations: No Marine pollutants (yes/no): No 14.6 Special reminder to users No data available
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