2-(2-Ethylhexane-1-sulfonyl)-6-nitro-1,3-benzothiazole

Base Information

• Chemical Name: 2-(2-Ethylhexane-1-sulfonyl)-6-nitro-1,3-benzothiazole
• CAS No.: 76151-63-8
• Molecular Formula: C15H20N2O4S2
• DSSTox Substance ID: DTXSID50504967

Synonyms:76151-63-8;2-(2-Ethylhexane-1-sulfonyl)-6-nitro-1,3-benzothiazole;DTXSID50504967

Chemical Property of 2-(2-Ethylhexane-1-sulfonyl)-6-nitro-1,3-benzothiazole

Chemical Property:

• XLogP3: 5.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 7
• Exact Mass: 356.08644947
• Heavy Atom Count: 23
• Complexity: 501

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MSDS Files:

SDS file from LookChem

Useful:

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

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