3,4-Bis(3,5-Ditert-Butyl-4-Oxo-2,5-Cyclohexadien-1-Ylidene)Cyclobutane-1,2-Dione
[CAS# 61377-19-3]

Identification

• Name: 3,4-Bis(3,5-Ditert-Butyl-4-Oxo-2,5-Cyclohexadien-1-Ylidene)Cyclobutane-1,2-Dione
• Synonyms: 3,4-Bis(3,5-Ditert-Butyl-4-Keto-1-Cyclohexa-2,5-Dienylidene)Cyclobutane-1,2-Quinone; 1,2-Cyclobutanedione, 3,4-Bis(3,5-Bis(1,1-Dimethylethyl)-4-Oxo-2,5-Cyclohexadien-1-Ylidene)-; 3,4-Bis(3,5-Bis(1,1-Dimethylethyl)-4-Oxo-2,5-Cyclohexadien-1-Ylidene)-1,2-Cyclobutanedione
• Molecular Formula: C₃₂H₄₀O₄
• Molecular Weight: 488.67
• CAS Registry Number: 61377-19-3
• SMILES: CC(C3=CC(=C2C(=C1C=C(C(=O)C(=C1)C(C)(C)C)C(C)(C)C)C(=O)C2=O)C=C(C3=O)C(C)(C)C)(C)C
• InChI: 1S/C32H40O4/c1-29(2,3)19-13-17(14-20(25(19)33)30(4,5)6)23-24(28(36)27(23)35)18-15-21(31(7,8)9)26(34)22(16-18)32(10,11)12/h13-16H,1-12H3
• InChIKey: AZGREPHORDYXEK-UHFFFAOYSA-N

Properties

• Density: 1.147g/cm³ (Cal.)
• Boiling point: 529.121°C at 760 mmHg (Cal.)
• Flash point: 217.751°C (Cal.)