3-Hydroxy-5-(methylsulfanyl)-1,2-thiazole-4-carbonitrile

Base Information

• Chemical Name: 3-Hydroxy-5-(methylsulfanyl)-1,2-thiazole-4-carbonitrile
• CAS No.: 4886-02-6
• Molecular Formula: C5H4N2OS2
• Molecular Weight: 172.232
• DSSTox Substance ID: DTXSID90351694
• Wikidata: Q82128298
• Mol file: 4886-02-6.mol

Synonyms:3-hydroxy-5-(methylsulfanyl)-1,2-thiazole-4-carbonitrile;4886-02-6;3-hydroxy-5-(methylsulfanyl)-4-isothiazolecarbonitrile;5-methylsulfanyl-3-oxo-1,2-thiazole-4-carbonitrile;4-cyano-3-hydroxy-5-methylthioisothiazole;TimTec1_005674;SCHEMBL5639428;DTXSID90351694;DMKPBSKKJZGMPL-UHFFFAOYSA-N;HMS1550B20;MFCD00172842;STK131178;AKOS005402960;AT21232;NCGC00173620-01;3-hydroxy-4-cyano-5-methylthioisothiazole;FT-0761792;EN300-42950;3E-928;SR-01000421304;SR-01000421304-1;3-hydroxy-5-methylsulfanyl-isothiazole-4-carbonitrile;F0914-1111;Z431981682;3-HYDROXY-5-(METHYLTHIO)ISOTHIAZOLE-4-CARBONITRILE;5-(methylsulfanyl)-3-oxo-2,3-dihydro-1,2-thiazole-4-carbonitrile

Chemical Property of 3-Hydroxy-5-(methylsulfanyl)-1,2-thiazole-4-carbonitrile

Chemical Property:

• XLogP3: 0.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 171.97650510
• Heavy Atom Count: 10
• Complexity: 250

Purity/Quality:

95% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CSC1=C(C(=O)NS1)C#N