4-Nitro-6-(trifluoromethyl)-2H-1,3-benzodithiol-2-one

Base Information

• Chemical Name: 4-Nitro-6-(trifluoromethyl)-2H-1,3-benzodithiol-2-one
• CAS No.: 62558-16-1
• Molecular Formula: C8H2F3NO3S2
• DSSTox Substance ID: DTXSID50494056
• Wikidata: Q82341140

Synonyms:4-Nitro-6-(trifluoromethyl)-2H-1,3-benzodithiol-2-one;62558-16-1;SCHEMBL11537061;DTXSID50494056;4-nitro-6-trifluoromethyl-1,3-benzodithiole-2-one

Chemical Property of 4-Nitro-6-(trifluoromethyl)-2H-1,3-benzodithiol-2-one

Chemical Property:

• XLogP3: 3.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 0
• Exact Mass: 280.94281976
• Heavy Atom Count: 17
• Complexity: 357

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=C(C=C2C(=C1[N+](=O)[O-])SC(=O)S2)C(F)(F)F

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