4,6-Diethyl-2H-[1,2,3]Triazolo[4,5-d]Pyrimidine-5,7(4H,6H)-Dione
[CAS# 500691-91-8]

Identification

• Name: 4,6-Diethyl-2H-[1,2,3]Triazolo[4,5-d]Pyrimidine-5,7(4H,6H)-Dione
• Synonyms: 4,6-diethyl-1H-[1,2,3]triazolo[4,5-d]pyrimidine-5,7(4H,6H)-dione; NSC70468
• Molecular Formula: C₈H₁₁N₅O₂
• Molecular Weight: 209.21
• CAS Registry Number: 500691-91-8
• SMILES: O=C2N(c1nnnc1C(=O)N2CC)CC
• InChI: 1S/C8H11N5O2/c1-3-12-6-5(9-11-10-6)7(14)13(4-2)8(12)15/h3-4H2,1-2H3,(H,9,10,11)
• InChIKey: MSVQAGCSRCZYKT-UHFFFAOYSA-N

Properties

• Density: 1.383g/cm³ (Cal.)
• Boiling point: 422.217°C at 760 mmHg (Cal.)
• Flash point: 209.15°C (Cal.)
• Refractive index: 1.582 (Cal.)