2,6-Ditert-Butyl-4-[2,3,4-Tris(3,5-Ditert-Butyl-4-Oxo-Cyclohexa-2,5-Dien-1-Ylidene)Cyclobutylidene]Cyclohexa-2,5-Dien-1-One
[CAS# 34879-70-4]

Identification

• Name: 2,6-Ditert-Butyl-4-[2,3,4-Tris(3,5-Ditert-Butyl-4-Oxo-Cyclohexa-2,5-Dien-1-Ylidene)Cyclobutylidene]Cyclohexa-2,5-Dien-1-One
• Molecular Formula: C₆₀H₈₀O₄
• Molecular Weight: 865.27
• CAS Registry Number: 34879-70-4
• SMILES: CC(C)(C)C1=CC(=C2C(=C3C=C(C(=O)C(=C3)C(C)(C)C)C(C)(C)C)C(=C4C=C(C(=O)C(=C4)C(C)(C)C)C(C)(C)C)C2=C5C=C(C(=O)C(=C5)C(C)(C)C)C(C)(C)C)C=C(C1=O)C(C)(C)C
• InChI: 1S/C60H80O4/c1-53(2,3)37-25-33(26-38(49(37)61)54(4,5)6)45-46(34-27-39(55(7,8)9)50(62)40(28-34)56(10,11)12)48(36-31-43(59(19,20)21)52(64)44(32-36)60(22,23)24)47(45)35-29-41(57(13,14)15)51(63)42(30-35)58(16,17)18/h25-32H,1-24H3
• InChIKey: QNGILZGRCMQQCY-UHFFFAOYSA-N

Properties

• Density: 1.089g/cm³ (Cal.)
• Boiling point: 803.21°C at 760 mmHg (Cal.)
• Flash point: 368.128°C (Cal.)