2-Hydroxy-5-Methoxy-3-[[(1R,2S,4aS,8aS)-1,2,3,4,4a,7,8,8a-Octahydro-1,2,4a,5-Tetramethyl-1-Naphthalenyl]Methyl]-2,5-Cyclohexadiene-1,4-Dione
[CAS# 69672-66-8]

Identification

• Name: 2-Hydroxy-5-Methoxy-3-[[(1R,2S,4aS,8aS)-1,2,3,4,4a,7,8,8a-Octahydro-1,2,4a,5-Tetramethyl-1-Naphthalenyl]Methyl]-2,5-Cyclohexadiene-1,4-Dione
• Synonyms: 3-[(1,2,4A,5-Tetramethyl-2,3,4,7,8,8A-Hexahydronaphthalen-1-Yl)Methyl]-2-Hydroxy-5-Methoxy-1,4-Benzoquinone; 3-[(1,2,4A,5-Tetramethyl-2,3,4,7,8,8A-Hexahydronaphthalen-1-Yl)Methyl]-2-Hydroxy-5-Methoxy-P-Benzoquinone; 3-[(1,2,4A,5-Tetramethyl-2,3,4,7,8,8A-Hexahydronaphthalen-1-Yl)Methyl]-2-Hydroxy-5-Methoxy-Cyclohexa-2,5-Diene-1,4-Dione
• Molecular Formula: C₂₂H₃₀O₄
• Molecular Weight: 358.48
• CAS Registry Number: 69672-66-8
• SMILES: C(C2(C1C(C(=CCC1)C)(C)CCC2C)C)C3=C(C(C=C(C3=O)OC)=O)O
• InChI: 1S/C22H30O4/c1-13-7-6-8-18-21(13,3)10-9-14(2)22(18,4)12-15-19(24)16(23)11-17(26-5)20(15)25/h7,11,14,18,24H,6,8-10,12H2,1-5H3
• InChIKey: LKNAVZKSKJJHQH-UHFFFAOYSA-N

Properties

• Density: 1.148g/cm³ (Cal.)
• Boiling point: 477.898°C at 760 mmHg (Cal.)
• Flash point: 159.717°C (Cal.)