1H-1,2,4-Triazole, 1-methyl-3-(methylthio)-5-(5-nitro-2-furanyl)-

Base Information

• Chemical Name: 1H-1,2,4-Triazole, 1-methyl-3-(methylthio)-5-(5-nitro-2-furanyl)-
• CAS No.: 61323-55-5
• Molecular Formula: C8H8N4O3S
• DSSTox Substance ID: DTXSID50487645
• Wikidata: Q82329777

Synonyms:61323-55-5;1H-1,2,4-Triazole, 1-methyl-3-(methylthio)-5-(5-nitro-2-furanyl)-;DTXSID50487645

Chemical Property of 1H-1,2,4-Triazole, 1-methyl-3-(methylthio)-5-(5-nitro-2-furanyl)-

Chemical Property:

• XLogP3: 1.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 2
• Exact Mass: 240.03171130
• Heavy Atom Count: 16
• Complexity: 275

Purity/Quality:

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MSDS Files:

Useful:

• Canonical SMILES: CN1C(=NC(=N1)SC)C2=CC=C(O2)[N+](=O)[O-]

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