7-Nitro-2-phenyl-1,3-benzothiazole-5,6-diol

Base Information

• Chemical Name: 7-Nitro-2-phenyl-1,3-benzothiazole-5,6-diol
• CAS No.: 921197-35-5
• Molecular Formula: C13H8N2O4S
• DSSTox Substance ID: DTXSID20580773
• Wikidata: Q82471721

Synonyms:7-Nitro-2-phenyl-1,3-benzothiazole-5,6-diol;921197-35-5;SCHEMBL1609346;DTXSID20580773

Chemical Property of 7-Nitro-2-phenyl-1,3-benzothiazole-5,6-diol

Chemical Property:

• XLogP3: 3.7
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 1
• Exact Mass: 288.02047791
• Heavy Atom Count: 20
• Complexity: 372

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)C2=NC3=CC(=C(C(=C3S2)[N+](=O)[O-])O)O

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