2-(Hexahydro-1H-Azepin-1-Yl)-5-Phenylpyrimidine-4,6(1H,5H)-Dione
[CAS# 61280-40-8]

Identification

• Name: 2-(Hexahydro-1H-Azepin-1-Yl)-5-Phenylpyrimidine-4,6(1H,5H)-Dione
• Synonyms: 2-(1-Azepanyl)-5-Phenyl-1H-Pyrimidine-4,6-Dione; 2-(Azepan-1-Yl)-5-Phenyl-1H-Pyrimidine-4,6-Quinone; Brn 0921907
• Molecular Formula: C₁₆H₁₉N₃O₂
• Molecular Weight: 285.35
• CAS Registry Number: 61280-40-8
• SMILES: C3=C(C1C(=O)N=C(NC1=O)N2CCCCCC2)C=CC=C3
• InChI: 1S/C16H19N3O2/c20-14-13(12-8-4-3-5-9-12)15(21)18-16(17-14)19-10-6-1-2-7-11-19/h3-5,8-9,13H,1-2,6-7,10-11H2,(H,17,18,20,21)
• InChIKey: DRFYZIONMBMHMN-UHFFFAOYSA-N

Properties

• Density: 1.3g/cm³ (Cal.)