6-Nitro-2-(prop-2-ene-1-sulfonyl)-1,3-benzothiazole

Base Information

• Chemical Name: 6-Nitro-2-(prop-2-ene-1-sulfonyl)-1,3-benzothiazole
• CAS No.: 76151-62-7
• Molecular Formula: C10H8N2O4S2
• DSSTox Substance ID: DTXSID30504965
• Wikidata: Q82359767

Synonyms:76151-62-7;6-Nitro-2-(prop-2-ene-1-sulfonyl)-1,3-benzothiazole;6-nitro-2-prop-2-enylsulfonyl-1,3-benzothiazole;DTXSID30504965

Chemical Property of 6-Nitro-2-(prop-2-ene-1-sulfonyl)-1,3-benzothiazole

Chemical Property:

• XLogP3: 2.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 3
• Exact Mass: 283.99254909
• Heavy Atom Count: 18
• Complexity: 440

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MSDS Files:

Useful:

• Canonical SMILES: C=CCS(=O)(=O)C1=NC2=C(S1)C=C(C=C2)[N+](=O)[O-]

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