3-Sulfanylidene-1,2,4-triazinane-5,6-dione

Base Information

• Chemical Name: 3-Sulfanylidene-1,2,4-triazinane-5,6-dione
• CAS No.: 59166-43-7
• Molecular Formula: C3H3N3O2S
• Molecular Weight: 145.14000
• DSSTox Substance ID: DTXSID60368037
• Wikidata: Q82154315

Synonyms:3-sulfanylidene-1,2,4-triazinane-5,6-dione;59166-43-7;1,2,4-Triazine-5,6-dione, tetrahydro-3-thioxo-;SCHEMBL9864862;DTXSID60368037

Chemical Property of 3-Sulfanylidene-1,2,4-triazinane-5,6-dione

Chemical Property:

• Melting Point: 219-223 °C
• PSA: 117.93000
• Density: 1.75±0.1 g/cm3(Predicted)
• LogP: -0.42850
• XLogP3: -0.6
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 144.99459752
• Heavy Atom Count: 9
• Complexity: 190

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1(=O)C(=O)NNC(=S)N1

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