3-Amino-2,4,5,8,10-Pentazabicyclo[4.4.0]Deca-2,4,11-Triene-7,9-Dione
[CAS# 1501-47-9]

Identification

• Name: 3-Amino-2,4,5,8,10-Pentazabicyclo[4.4.0]Deca-2,4,11-Triene-7,9-Dione
• Synonyms: 3-Amino-5H-Pyrimido[6,5-E][1,2,4]Triazine-6,8-Quinone; Nsc21958; A4150/0176849
• Molecular Formula: C₅H₄N₆O₂
• Molecular Weight: 180.13
• CAS Registry Number: 1501-47-9
• SMILES: C1(=NC2=C(N=N1)C(=O)NC(=O)N2)N
• InChI: 1S/C5H4N6O2/c6-4-7-2-1(10-11-4)3(12)9-5(13)8-2/h(H4,6,7,8,9,11,12,13)
• InChIKey: XMMKYOZIGTXQMC-UHFFFAOYSA-N

Properties

• Density: 1.744g/cm³ (Cal.)