N-Benzyl-1H-Pyrazolo[3,4-d]Pyrimidin-4-Amine
[CAS# 58360-86-4]

Identification

• Name: N-Benzyl-1H-Pyrazolo[3,4-d]Pyrimidin-4-Amine
• Synonyms: Benzyl-(1H-Pyrazolo[4,3-E]Pyrimidin-4-Yl)Amine; 1H-Pyrazolo[3,4-D]Pyrimidin-4-Amine, N-(Phenylmethyl)-; 1H-Pyrazolo[3,4-D]Pyrimidine, 4-Benzylamino-
• Molecular Formula: C₁₂H₁₁N₅
• Molecular Weight: 225.25
• CAS Registry Number: 58360-86-4
• SMILES: C2=NC(=C1C=N[NH]C1=N2)NCC3=CC=CC=C3
• InChI: 1S/C12H11N5/c1-2-4-9(5-3-1)6-13-11-10-7-16-17-12(10)15-8-14-11/h1-5,7-8H,6H2,(H2,13,14,15,16,17)
• InChIKey: NNSLOBNGHHXORI-UHFFFAOYSA-N

Properties

• Density: 1.393g/cm³ (Cal.)
• Boiling point: 465.774°C at 760 mmHg (Cal.)
• Flash point: 235.492°C (Cal.)