Isothiazolo(5,4-b)pyridin-3(2H)-one, 2,4,6-trimethyl-, 1,1-dioxide

Base Information

• Chemical Name: Isothiazolo(5,4-b)pyridin-3(2H)-one, 2,4,6-trimethyl-, 1,1-dioxide
• CAS No.: 108361-80-4
• Molecular Formula: C9H10 N2 O3 S
• Molecular Weight: 0
• DSSTox Substance ID: DTXSID90148521
• Wikidata: Q83014066
• Mol file: 108361-80-4.mol

Synonyms:108361-80-4;Isothiazolo(5,4-b)pyridin-3(2H)-one, 2,4,6-trimethyl-, 1,1-dioxide;2,4,6-Trimethylisothiazolo(5,4-b)pyridin-3(2H)-one 1,1-dioxide;DTXSID90148521;LS-86361

Chemical Property of Isothiazolo(5,4-b)pyridin-3(2H)-one, 2,4,6-trimethyl-, 1,1-dioxide

Chemical Property:

• Vapor Pressure: 1.13E-07mmHg at 25°C
• Boiling Point: 432.2°Cat760mmHg
• Flash Point: 215.2°C
• PSA: 75.72000
• Density: 1.428g/cm³
• LogP: 1.49140
• XLogP3: 0.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 0
• Exact Mass: 226.04121336
• Heavy Atom Count: 15
• Complexity: 387

Purity/Quality:

99%min ^*data from raw suppliers

2,4,6-TRIMETHYLISOTHIAZOLO(5,4-B)PYRIDIN-3(2H)-ONE 1,1-DIOXIDE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC(=NC2=C1C(=O)N(S2(=O)=O)C)C