Thiocyanic acid, 5-acetyl-2-nitro-3-thienyl ester

Base Information

• Chemical Name: Thiocyanic acid, 5-acetyl-2-nitro-3-thienyl ester
• CAS No.: 96450-56-5
• Molecular Formula: C7H4N2O3S2
• DSSTox Substance ID: DTXSID10356626
• Wikidata: Q82136091

Synonyms:Thiocyanic acid, 5-acetyl-2-nitro-3-thienyl ester;96450-56-5;DTXSID10356626;AKOS000530732

Chemical Property of Thiocyanic acid, 5-acetyl-2-nitro-3-thienyl ester

Chemical Property:

• XLogP3: 2.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 2
• Exact Mass: 227.96633434
• Heavy Atom Count: 14
• Complexity: 306

Purity/Quality:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)C1=CC(=C(S1)[N+](=O)[O-])SC#N

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