8-Ethyl-7-(2-Hydroxyethoxy)Theophylline
[CAS# 19729-82-9]

Identification

• Name: 8-Ethyl-7-(2-Hydroxyethoxy)Theophylline
• Synonyms: 8-Ethyl-7-(2-Hydroxyethoxy)-1,3-Dimethyl-Purine-2,6-Dione; 8-Ethyl-7-(2-Hydroxyethoxy)-1,3-Dimethyl-Xanthine; 8-Ethyl-7-(2-Hydroxyethoxy)Theophylline
• Molecular Formula: C₁₁H₁₆N₄O₄
• Molecular Weight: 268.27
• CAS Registry Number: 19729-82-9
• SMILES: C(O[N]1C(=NC2=C1C(N(C(N2C)=O)C)=O)CC)CO
• InChI: 1S/C11H16N4O4/c1-4-7-12-9-8(15(7)19-6-5-16)10(17)14(3)11(18)13(9)2/h16H,4-6H2,1-3H3
• InChIKey: YVSBJGOLSVDHHT-UHFFFAOYSA-N

Properties

• Density: 1.446g/cm³ (Cal.)
• Boiling point: 476.729°C at 760 mmHg (Cal.)
• Flash point: 242.117°C (Cal.)