5-(4-Amino-1H-Imidazol-5-Yl)-1,2-Dihydro-3H-1,2,4-Triazol-3-One
[CAS# 502143-23-9]

Identification

• Name: 5-(4-Amino-1H-Imidazol-5-Yl)-1,2-Dihydro-3H-1,2,4-Triazol-3-One
• Synonyms: 5-(5-amino-1H-imidazol-4-yl)-1H-1,2,4-triazol-3(2H)-one; NSC235778
• Molecular Formula: C₅H₆N₆O
• Molecular Weight: 166.14
• CAS Registry Number: 502143-23-9
• SMILES: O=C2/N=C(/c1ncnc1N)NN2
• InChI: 1S/C5H6N6O/c6-3-2(7-1-8-3)4-9-5(12)11-10-4/h1H,6H2,(H,7,8)(H2,9,10,11,12)
• InChIKey: WUAAXIOHKNBLKM-UHFFFAOYSA-N

Properties

• Density: 2.257g/cm³ (Cal.)
• Refractive index: 2.072 (Cal.)