Tribuzone
[CAS# 13221-27-7]

Identification

• Name: Tribuzone
• Synonyms: 4-(4,4-Dimethyl-3-Oxo-Pentyl)-1,2-Di(Phenyl)Pyrazolidine-3,5-Dione; 4-(3-Keto-4,4-Dimethyl-Pentyl)-1,2-Di(Phenyl)Pyrazolidine-3,5-Quinone; 3,5-Pyrazolidinedione, 4-(4,4-Dimethyl-3-Oxopentyl)-1,2-Diphenyl-
• Molecular Formula: C₂₂H₂₄N₂O₃
• Molecular Weight: 364.44
• CAS Registry Number: 13221-27-7
• EINECS: 236-191-4
• SMILES: C1=CC=CC=C1N3N(C2=CC=CC=C2)C(=O)C(C3=O)CCC(C(C)(C)C)=O
• InChI: 1S/C22H24N2O3/c1-22(2,3)19(25)15-14-18-20(26)23(16-10-6-4-7-11-16)24(21(18)27)17-12-8-5-9-13-17/h4-13,18H,14-15H2,1-3H3
• InChIKey: OFVFGKQCUDMLLP-UHFFFAOYSA-N

Properties

• Density: 1.178g/cm³ (Cal.)
• Boiling point: 486.94°C at 760 mmHg (Cal.)
• Flash point: 198.612°C (Cal.)