2-(1,4-Diazepan-1-Yl)-6-Ethyl-4(1H)-Pyrimidinone
[CAS# 502133-51-9]

Identification

• Name: 2-(1,4-Diazepan-1-Yl)-6-Ethyl-4(1H)-Pyrimidinone
• Synonyms: 2-(1,4-diazepan-1-yl)-6-ethylpyrimidin-4(1H)-one; 2-[1,4]Diazepan-1-yl-6-ethyl-pyrimidin-4-ol
• Molecular Formula: C₁₁H₁₈N₄O
• Molecular Weight: 222.29
• CAS Registry Number: 502133-51-9
• SMILES: O=C/2/N=C(/N1CCCNCC1)N\C(=C\2)CC
• InChI: 1S/C11H18N4O/c1-2-9-8-10(16)14-11(13-9)15-6-3-4-12-5-7-15/h8,12H,2-7H2,1H3,(H,13,14,16)
• InChIKey: JSRZOQXAKYVFPV-UHFFFAOYSA-N

Properties

• Density: 1.277g/cm³ (Cal.)
• Boiling point: 355.919°C at 760 mmHg (Cal.)
• Flash point: 169.054°C (Cal.)
• Refractive index: 1.63 (Cal.)