4-Butyl-1-Phenyl-2-[4-(Phenylmethoxy)Phenyl]Pyrazolidine-3,5-Dione
[CAS# 31603-00-6]

Identification

• Name: 4-Butyl-1-Phenyl-2-[4-(Phenylmethoxy)Phenyl]Pyrazolidine-3,5-Dione
• Synonyms: 1-[4-(Benzyloxy)Phenyl]-4-Butyl-2-Phenyl-Pyrazolidine-3,5-Quinone; 4-Butyl-2-Phenyl-1-(4-(Phenylmethoxy)Phenyl)Pyrazolidine-3,5-Dione
• Molecular Formula: C₂₆H₂₆N₂O₃
• Molecular Weight: 414.50
• CAS Registry Number: 31603-00-6
• EINECS: 250-725-3
• SMILES: C1=CC(=CC=C1OCC2=CC=CC=C2)N3N(C(=O)C(C3=O)CCCC)C4=CC=CC=C4
• InChI: 1S/C26H26N2O3/c1-2-3-14-24-25(29)27(21-12-8-5-9-13-21)28(26(24)30)22-15-17-23(18-16-22)31-19-20-10-6-4-7-11-20/h4-13,15-18,24H,2-3,14,19H2,1H3
• InChIKey: VQAREFIHUMMGEN-UHFFFAOYSA-N

Properties

• Density: 1.193g/cm³ (Cal.)
• Boiling point: 559.796°C at 760 mmHg (Cal.)
• Flash point: 292.354°C (Cal.)