3-Amino-7-nitro-1lambda~6~,2-benzothiazine-1,1(2H)-dione

Base Information

• Chemical Name: 3-Amino-7-nitro-1lambda~6~,2-benzothiazine-1,1(2H)-dione
• CAS No.: 128408-82-2
• Molecular Formula: C₈H₇N₃O₄S
• Molecular Weight: 241.227
• DSSTox Substance ID: DTXSID60562058
• Nikkaji Number: J438.153J
• Wikidata: Q82446044

Synonyms:128408-82-2;DTXSID60562058;3-Amino-7-nitro-1lambda~6~,2-benzothiazine-1,1(2H)-dione

Chemical Property of 3-Amino-7-nitro-1lambda~6~,2-benzothiazine-1,1(2H)-dione

Chemical Property:

• XLogP3: 0.4
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 0
• Exact Mass: 241.01572689
• Heavy Atom Count: 16
• Complexity: 433

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC2=C(C=C1[N+](=O)[O-])S(=O)(=O)NC(=C2)N

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