2-Methyl-2H-1,2-benzothiazin-3(4H)-one 1,1-dioxide

Base Information

• Chemical Name: 2-Methyl-2H-1,2-benzothiazin-3(4H)-one 1,1-dioxide
• CAS No.: 29209-01-6
• Molecular Formula: C9H9 N O3 S
• Molecular Weight: 211.24
• Hs Code.: 2914399090
• DSSTox Substance ID: DTXSID60951802
• Nikkaji Number: J41.970B
• Wikidata: Q82930240
• Mol file: 29209-01-6.mol

Synonyms:2-methyl-4-oxo-2H-1,2-benzothiazine-1,1-dioxide;2-MOBTDO

Chemical Property of 2-Methyl-2H-1,2-benzothiazin-3(4H)-one 1,1-dioxide

Chemical Property:

• Vapor Pressure: 9.62E-06mmHg at 25°C
• Boiling Point: 372.4°Cat760mmHg
• PKA: -13.29±0.20(Predicted)
• Flash Point: 179°C
• PSA: 62.83000
• Density: 1.404g/cm³
• LogP: 1.40850
• XLogP3: 0.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 211.03031432
• Heavy Atom Count: 14
• Complexity: 344

Purity/Quality:

99%min ^*data from raw suppliers

2-METHYL-2H-1,2-BENZOTHIAZIN-3(4H)-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: CN1C(=O)CC2=CC=CC=C2S1(=O)=O