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

Base Information

• Chemical Name: 6-Nitro-4-(trifluoromethyl)-2H-1,3-benzodithiol-2-one
• CAS No.: 62558-22-9
• Molecular Formula: C8H2F3NO3S2
• DSSTox Substance ID: DTXSID00494061
• Wikidata: Q82341149

Synonyms:6-Nitro-4-(trifluoromethyl)-2H-1,3-benzodithiol-2-one;62558-22-9;SCHEMBL11563370;DTXSID00494061;HXFBOXFACOJNJG-UHFFFAOYSA-N

Chemical Property of 6-Nitro-4-(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

Purity/Quality:

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=C(C=C2C(=C1C(F)(F)F)SC(=O)S2)[N+](=O)[O-]

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