7-[(2S)-2-Hydroxypropyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
[CAS# 86540-95-6]

Identification

• Name: 7-[(2S)-2-Hydroxypropyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
• Synonyms: (S)-7-(2-hydroxypropyl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione; 7-(2-Hydroxy-propyl)-1,3-dimethyl-3,7-dihydro-purine-2,6-dione
• Molecular Formula: C₁₀H₁₄N₄O₃
• Molecular Weight: 238.24
• CAS Registry Number: 86540-95-6
• SMILES: C[C@@H](CN1C=NC2=C1C(=O)N(C(=O)N2C)C)O
• InChI: 1S/C10H14N4O3/c1-6(15)4-14-5-11-8-7(14)9(16)13(3)10(17)12(8)2/h5-6,15H,4H2,1-3H3/t6-/m0/s1
• InChIKey: KYHQZNGJUGFTGR-LURJTMIESA-N

Properties

• Density: 1.5±0.1g/cm³ (Cal.)
• Boiling point: 487.2±51.0°C at 760 mmHg (Cal.)
• Flash point: 248.5±30.4°C (Cal.)