1H-1,2,4-Triazole-3,5-diamine, 1-acetyl-

Base Information

• Chemical Name: 1H-1,2,4-Triazole-3,5-diamine, 1-acetyl-
• CAS No.: 86147-15-1
• Molecular Formula: C4H7N5O
• Molecular Weight: 141.132
• DSSTox Substance ID: DTXSID90389619
• Wikidata: Q82185582

Synonyms:86147-15-1;1H-1,2,4-Triazole-3,5-diamine, 1-acetyl-;1-(3,5-diamino-1,2,4-triazol-1-yl)ethanone;1-acetyl-3,5-diamino-1,2,4-triazole;DTXSID90389619;FQKVFZZWHDTYJQ-UHFFFAOYSA-N;MFCD00457969;STK783257;AKOS005620031;1-Acetyl-1H-1,2,4-triazole-3,5-diamine;1-(diamino-1H-1,2,4-triazol-1-yl)ethan-1-one;1-(3,5-diamino-1H-1,2,4-triazol-1-yl)ethanone;1-(3,5-diamino-1H-1,2,4-triazol-1-yl)-1-ethanone;1-(3,5-diamino-1H-1,2,4-triazol-1-yl)ethan-1-one

Chemical Property of 1H-1,2,4-Triazole-3,5-diamine, 1-acetyl-

Chemical Property:

• Melting Point: 198-200 °C
• Boiling Point: 433.8±28.0 °C(Predicted)
• PSA: 101.28000
• Density: 1.79±0.1 g/cm3(Predicted)
• LogP: -1.03720
• XLogP3: -0.3
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 0
• Exact Mass: 141.06505986
• Heavy Atom Count: 10
• Complexity: 149

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)N1C(=NC(=N1)N)N

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