1,3,7-Trimethyl-8-(3-Methylcyclohexyl)Oxypurine-2,6-Dione
[CAS# 73747-36-1]

Identification

• Name: 1,3,7-Trimethyl-8-(3-Methylcyclohexyl)Oxypurine-2,6-Dione
• Synonyms: 1,3,7-Trimethyl-8-(3-Methylcyclohexoxy)Purine-2,6-Dione; 1,3,7-Trimethyl-8-(3-Methylcyclohexoxy)Xanthine; 1,3,7-Trimethyl-8-(3-Methylcyclohexyl)Oxy-Purine-2,6-Dione
• Molecular Formula: C₁₅H₂₂N₄O₃
• Molecular Weight: 306.36
• CAS Registry Number: 73747-36-1
• SMILES: CN3C1=C([N](C(=N1)OC2CC(CCC2)C)C)C(N(C3=O)C)=O
• InChI: 1S/C15H22N4O3/c1-9-6-5-7-10(8-9)22-14-16-12-11(17(14)2)13(20)19(4)15(21)18(12)3/h9-10H,5-8H2,1-4H3
• InChIKey: IIVPOHXPTVEOOE-UHFFFAOYSA-N

Properties

• Density: 1.372g/cm³ (Cal.)
• Boiling point: 474.021°C at 760 mmHg (Cal.)
• Flash point: 240.479°C (Cal.)