5-Sec-Butyl-5-Phenethyl-2-Sodiooxy-4,6(1H,5H)-Pyrimidinedione
[CAS# 67050-56-0]

Identification

• Name: 5-Sec-Butyl-5-Phenethyl-2-Sodiooxy-4,6(1H,5H)-Pyrimidinedione
• Synonyms: Sodium 4,6-Dioxo-5-Phenethyl-5-Sec-Butyl-1H-Pyrimidin-2-Olate; Sodium 4,6-Diketo-5-Phenethyl-5-Sec-Butyl-1H-Pyrimidin-2-Olate; 5-Sec-Butyl-5-Phenethylbarbituric Acid Sodium Salt
• Molecular Formula: C₁₆H₁₉N₂NaO₃
• Molecular Weight: 310.33
• CAS Registry Number: 67050-56-0
• SMILES: [N-]1C(=O)C(C(=O)NC1=O)(C(CC)C)CCC2=CC=CC=C2.[Na+]
• InChI: 1S/C16H20N2O3.Na/c1-3-11(2)16(10-9-12-7-5-4-6-8-12)13(19)17-15(21)18-14(16)20;/h4-8,11H,3,9-10H2,1-2H3,(H2,17,18,19,20,21);/q;+1/p-1
• InChIKey: ATGDDUNMQRERJP-UHFFFAOYSA-M