2-(4,6-Dimethoxy-2-pyrimidinyl)cyclohexanecarboxylic acid
[CAS# 633320-99-7]

Identification

• Name: 2-(4,6-Dimethoxy-2-pyrimidinyl)cyclohexanecarboxylic acid
• Synonyms: 1-Carboxy-2-(4,6-dimethoxypyrimidin-2-yl)cyclohexane, 2-(2-Carboxycyclohex-1-yl)-4,6-dimethoxypyrimidine; 2-(4,6-dimethoxypyrimidin-2-yl)cyclohexane-1-carboxylic acid; 2-(4,6-Dimethoxypyrimidin-2-yl)cyclohexanecarboxyl
• Molecular Formula: C₁₃H₁₈N₂O₄
• Molecular Weight: 266.29
• CAS Registry Number: 633320-99-7
• SMILES: O=C(O)C2C(c1nc(OC)cc(OC)n1)CCCC2
• InChI: 1S/C13H18N2O4/c1-18-10-7-11(19-2)15-12(14-10)8-5-3-4-6-9(8)13(16)17/h7-9H,3-6H2,1-2H3,(H,16,17)
• InChIKey: ITLOSRQFUNFUGL-UHFFFAOYSA-N

Properties

• Density: 1.225g/cm³ (Cal.)
• Melting point: 159-160°C (Expl.)
• Boiling point: 450.279°C at 760 mmHg (Cal.)
• Flash point: 226.121°C (Cal.)
• Refractive index: 1.536 (Cal.)

Safety Data

• Safety Description: Irritant