(-)-6-[(S)-1-Acetoxy-4-Methyl-3-Pentenyl]-8-Hydroxy-5-Methoxy-1,4-Naphthalenedione
[CAS# 80348-65-8]

Identification

• Name: (-)-6-[(S)-1-Acetoxy-4-Methyl-3-Pentenyl]-8-Hydroxy-5-Methoxy-1,4-Naphthalenedione
• Synonyms: [(1S)-1-(4-Hydroxy-1-Methoxy-5,8-Dioxo-2-Naphthyl)-4-Methyl-Pent-3-Enyl] Acetate; Acetic Acid [(1S)-1-(4-Hydroxy-1-Methoxy-5,8-Dioxo-2-Naphthyl)-4-Methylpent-3-Enyl] Ester; Acetic Acid [(1S)-1-(4-Hydroxy-5,8-Diketo-1-Methoxy-2-Naphthyl)-4-Methyl-Pent-3-Enyl] Ester
• Molecular Formula: C₁₉H₂₀O₆
• Molecular Weight: 344.36
• CAS Registry Number: 80348-65-8
• SMILES: [C@@H](C2=C(C1=C(C(C=CC1=O)=O)C(=C2)O)OC)(CC=C(C)C)OC(=O)C
• InChI: 1S/C19H20O6/c1-10(2)5-8-16(25-11(3)20)12-9-15(23)17-13(21)6-7-14(22)18(17)19(12)24-4/h5-7,9,16,23H,8H2,1-4H3/t16-/m0/s1
• InChIKey: SCIUCADXFKAPEB-INIZCTEOSA-N

Properties

• Density: 1.255g/cm³ (Cal.)
• Boiling point: 531.55°C at 760 mmHg (Cal.)
• Flash point: 189.271°C (Cal.)