2-(Methanesulfonyl)benzene-1-sulfonyl isocyanate

Base Information

• Chemical Name: 2-(Methanesulfonyl)benzene-1-sulfonyl isocyanate
• CAS No.: 82126-74-7
• Molecular Formula: C8H7NO5S2
• DSSTox Substance ID: DTXSID10517972

Synonyms:82126-74-7;2-(Methanesulfonyl)benzene-1-sulfonyl isocyanate;SCHEMBL10747298;DTXSID10517972;GEUWGNYLBKLCQW-UHFFFAOYSA-N;2-methylsulfonylbenzenesulfonylisocyanate;2-methylsulfonylbenzenesulfonyl isocyanate

Chemical Property of 2-(Methanesulfonyl)benzene-1-sulfonyl isocyanate

Chemical Property:

• XLogP3: 1.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 3
• Exact Mass: 260.97656467
• Heavy Atom Count: 16
• Complexity: 490

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CS(=O)(=O)C1=CC=CC=C1S(=O)(=O)N=C=O

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