4,5-Diethyl-2,4-Dihydro-3H-1,2,4-Triazol-3-One
[CAS# 52883-26-8]

Identification

• Name: 4,5-Diethyl-2,4-Dihydro-3H-1,2,4-Triazol-3-One
• Synonyms: Nsc680859; 3H-1,2,4-Triazol-3-One, 4,5-Diethyl-2,4-Dihydro-; Aids-075643
• Molecular Formula: C₆H₁₁N₃O
• Molecular Weight: 141.17
• CAS Registry Number: 52883-26-8
• EINECS: 258-233-0
• SMILES: C(N1C(=NNC1=O)CC)C
• InChI: 1S/C6H11N3O/c1-3-5-7-8-6(10)9(5)4-2/h3-4H2,1-2H3,(H,8,10)
• InChIKey: UEUMMYRZUZKMRI-UHFFFAOYSA-N

Properties

• Density: 1.215g/cm³ (Cal.)

References

• (1): N. Ocak Ãskeleli, S. Isik, K. Sancak, S. Sasmaz, Y. Ãœnver and M. Er. 4,4'-Butane-1,4-diylbis[3-ethyl-1H-1,2,4-triazol-5(4H)-one] and 4-hydroxy-3-n-propyl-1H-1,2,4-triazol-5(4H)-one, Acta Cryst. (2005). C61, o363-o365