4-Hydroxy-3,5-Bis(2-Methyl-2-Propanyl)-2,4-Cyclohexadien-1-One
[CAS# 54965-43-4]

Identification

• Name: 4-Hydroxy-3,5-Bis(2-Methyl-2-Propanyl)-2,4-Cyclohexadien-1-One
• Synonyms: 3,5-Ditert-butyl-4-hydroxy-2,4-cyclohexadien-1-one #
• Molecular Formula: C₁₄H₂₂O₂
• Molecular Weight: 222.32
• CAS Registry Number: 54965-43-4
• SMILES: O=C1/C=C(\C(\O)=C(/C1)C(C)(C)C)C(C)(C)C
• InChI: 1S/C14H22O2/c1-13(2,3)10-7-9(15)8-11(12(10)16)14(4,5)6/h7,16H,8H2,1-6H3
• InChIKey: VMIBWUBKVGANRX-UHFFFAOYSA-N

Properties

• Density: 1.044g/cm³ (Cal.)
• Boiling point: 315.361°C at 760 mmHg (Cal.)
• Flash point: 133.592°C (Cal.)