5-(4-Methoxybenzyl)-4,6-Pyrimidinediol
[CAS# 16015-98-8]

Identification

• Name: 5-(4-Methoxybenzyl)-4,6-Pyrimidinediol
• Synonyms: 6-Hydroxy-5-(4-Methoxybenzyl)-3H-Pyrimidin-4-One; 5-(4-Methoxy-Benzyl)-Pyrimidine-4,6-Diol; Mls000550844
• Molecular Formula: C₁₂H₁₂N₂O₃
• Molecular Weight: 232.24
• CAS Registry Number: 16015-98-8
• SMILES: C2=C(CC1=C(O)N=CNC1=O)C=CC(=C2)OC
• InChI: 1S/C12H12N2O3/c1-17-9-4-2-8(3-5-9)6-10-11(15)13-7-14-12(10)16/h2-5,7H,6H2,1H3,(H2,13,14,15,16)
• InChIKey: BZOYUGBBHFLYKE-UHFFFAOYSA-N

Properties

• Density: 1.302g/cm³ (Cal.)
• Boiling point: 447.9°C at 760 mmHg (Cal.)
• Flash point: 224.7°C (Cal.)