4-(4,6-Dimethoxy-2-Pyrimidinyl)Benzoic Acid
[CAS# 386715-40-8]

Identification

• Classification: Pharmaceutical intermediate >> Heterocyclic compound intermediate >> Pyrimidine compound >> Methoxypyrimidine
• Name: 4-(4,6-Dimethoxy-2-Pyrimidinyl)Benzoic Acid
• Synonyms: MFCD01568125; Peakdale1_001727
• Molecular Formula: C₁₃H₁₂N₂O₄
• Molecular Weight: 260.25
• CAS Registry Number: 386715-40-8
• SMILES: O=C(O)c2ccc(c1nc(OC)cc(OC)n1)cc2
• InChI: 1S/C13H12N2O4/c1-18-10-7-11(19-2)15-12(14-10)8-3-5-9(6-4-8)13(16)17/h3-7H,1-2H3,(H,16,17)
• InChIKey: ARKCVXXCSBFGDT-UHFFFAOYSA-N

Properties

• Density: 1.29g/cm³ (Cal.)
• Melting point: 284-286°C (Expl.)
• Boiling point: 358.388°C at 760 mmHg (Cal.)
• Flash point: 170.547°C (Cal.)
• Refractive index: 1.582 (Cal.)