7-[2-Hydroxy-3-[4-(2-Hydroxyethyl)Piperazin-1-Yl]Propyl]-1,3-Dimethyl-Purine-2,6-Dione
[CAS# 19971-97-2]

Identification

• Name: 7-[2-Hydroxy-3-[4-(2-Hydroxyethyl)Piperazin-1-Yl]Propyl]-1,3-Dimethyl-Purine-2,6-Dione
• Synonyms: 7-[2-Hydroxy-3-[4-(2-Hydroxyethyl)Piperazin-1-Yl]Propyl]-1,3-Dimethyl-Purine-2,6-Dione; 7-[2-Hydroxy-3-[4-(2-Hydroxyethyl)-1-Piperazinyl]Propyl]-1,3-Dimethylpurine-2,6-Dione; 7-[2-Hydroxy-3-[4-(2-Hydroxyethyl)Piperazin-1-Yl]Propyl]-1,3-Dimethyl-Xanthine
• Molecular Formula: C₁₆H₂₆N₆O₄
• Molecular Weight: 366.42
• CAS Registry Number: 19971-97-2
• SMILES: C1=NC3=C([N]1CC(CN2CCN(CCO)CC2)O)C(N(C)C(N3C)=O)=O
• InChI: 1S/C16H26N6O4/c1-18-14-13(15(25)19(2)16(18)26)22(11-17-14)10-12(24)9-21-5-3-20(4-6-21)7-8-23/h11-12,23-24H,3-10H2,1-2H3
• InChIKey: CGKZFYZCYGGHLU-UHFFFAOYSA-N

Properties

• Density: 1.462g/cm³ (Cal.)
• Boiling point: 637.525°C at 760 mmHg (Cal.)
• Flash point: 339.363°C (Cal.)