1,5-Dihydro-6H-Pyrazolo[3,4-d]Pyrimidin-6-One
[CAS# 40925-39-1]

Identification

• Name: 1,5-Dihydro-6H-Pyrazolo[3,4-d]Pyrimidin-6-One
• Synonyms: 1H-pyrazolo[3,4-d]pyrimidin-6(5H)-one
• Molecular Formula: C₅H₄N₄O
• Molecular Weight: 136.11
• CAS Registry Number: 40925-39-1
• SMILES: O=C\1N\C=C2\C=N/N\C2=N/1
• InChI: 1S/C5H4N4O/c10-5-6-1-3-2-7-9-4(3)8-5/h1-2H,(H2,6,7,8,9,10)
• InChIKey: QRWPPQXHVMWCMB-UHFFFAOYSA-N

Properties

• Density: 1.892g/cm³ (Cal.)
• Boiling point: 341.5°C at 760 mmHg (Cal.)
• Flash point: 160.3°C (Cal.)