Pyrimido[5,4-e][1,2,4]Triazin-3(4H)-One
[CAS# 3861-27-6]

Identification

• Name: Pyrimido[5,4-e][1,2,4]Triazin-3(4H)-One
• Synonyms: pyrimido[5,4-e][1,2,4]triazin-3-ol
• Molecular Formula: C₅H₃N₅O
• Molecular Weight: 149.11
• CAS Registry Number: 3861-27-6
• SMILES: c1c2c(ncn1)nnc(n2)O
• InChI: 1S/C5H3N5O/c11-5-8-3-1-6-2-7-4(3)9-10-5/h1-2H,(H,8,10,11)
• InChIKey: WBLCYHQJQVVZMM-UHFFFAOYSA-N

Properties

• Density: 1.693g/cm³ (Cal.)
• Boiling point: 457.798°C at 760 mmHg (Cal.)
• Flash point: 230.668°C (Cal.)