Pimefylline
[CAS# 10001-43-1]

Identification

• Name: Pimefylline
• Synonyms: 1,3-Dimethyl-7-[2-(3-Pyridylmethylamino)Ethyl]Purine-2,6-Dione; 1,3-Dimethyl-7-[2-(3-Pyridylmethylamino)Ethyl]Xanthine; 3,7-Dihydro-1,3-Dimethyl-7-(2-((3-Pyridinylmethyl)Amino)Ethyl)-1H-Purine-2,6-Dione
• Molecular Formula: C₁₅H₁₈N₆O₂
• Molecular Weight: 314.35
• CAS Registry Number: 10001-43-1
• SMILES: C1=NC3=C([N]1CCNCC2=CN=CC=C2)C(N(C)C(N3C)=O)=O
• InChI: 1S/C15H18N6O2/c1-19-13-12(14(22)20(2)15(19)23)21(10-18-13)7-6-17-9-11-4-3-5-16-8-11/h3-5,8,10,17H,6-7,9H2,1-2H3
• InChIKey: CDHVRXOLGDSJGX-UHFFFAOYSA-N

Properties

• Density: 1.4±0.1g/cm³ (Cal.)
• Boiling point: 575.6±60.0°C at 760 mmHg (Cal.)
• Flash point: 301.9±32.9°C (Cal.)