1-(2-Hydroxyethyl)-3,7-Dimethylxanthine
[CAS# 1507-14-8]

Identification

• Name: 1-(2-Hydroxyethyl)-3,7-Dimethylxanthine
• Synonyms: 1-(2-Hydroxyethyl)-3,7-Dimethyl-Purine-2,6-Dione; 1-(2-Hydroxyethyl)-3,7-Dimethyl-Xanthine; 1-(2-Hydroxyethyl)-3,7-Dimethylxanthine
• Molecular Formula: C₉H₁₂N₄O₃
• Molecular Weight: 224.22
• CAS Registry Number: 1507-14-8
• SMILES: C1=NC2=C([N]1C)C(N(C(N2C)=O)CCO)=O
• InChI: 1S/C9H12N4O3/c1-11-5-10-7-6(11)8(15)13(3-4-14)9(16)12(7)2/h5,14H,3-4H2,1-2H3
• InChIKey: RXONRYRTUQKSNI-UHFFFAOYSA-N

Properties

• Density: 1.518g/cm³ (Cal.)
• Boiling point: 502.109°C at 760 mmHg (Cal.)
• Flash point: 257.467°C (Cal.)