2-[(2E,6E,10E,14E,18E)-Icosa-2,6,10,14,18-Pentaenyl]-3-Methylnaphthalene-1,4-Dione
[CAS# 1182-68-9]

Identification

• Name: 2-[(2E,6E,10E,14E,18E)-Icosa-2,6,10,14,18-Pentaenyl]-3-Methylnaphthalene-1,4-Dione
• Synonyms: 2-[(2E,6E,10E,14E,18E)-Icosa-2,6,10,14,18-Pentaenyl]-3-Methyl-Naphthalene-1,4-Dione; 2-[(2E,6E,10E,14E,18E)-Icosa-2,6,10,14,18-Pentaenyl]-3-Methyl-1,4-Naphthoquinone; 1,4-Naphthalenedione, 2-Methly-3-(3,7,11,15,19-Pentamethyl-2,6,10,14,18-Eicosapentaenyl)-, (All-E)-
• Molecular Formula: C₃₁H₃₈O₂
• Molecular Weight: 442.64
• CAS Registry Number: 1182-68-9
• SMILES: C1=CC=CC2=C1C(=O)C(=C(C2=O)C)C\C=C\CC\C=C\CC\C=C\CC\C=C\CC\C=C\C
• InChI: 1S/C31H38O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-23-27-26(2)30(32)28-24-21-22-25-29(28)31(27)33/h3-4,7-8,11-12,15-16,19-22,24-25H,5-6,9-10,13-14,17-18,23H2,1-2H3/b4-3+,8-7+,12-11+,16-15+,20-19+
• InChIKey: BUOSOONYKBSWHT-OKFLBLQPSA-N

Properties

• Density: 1.003g/cm³ (Cal.)
• Boiling point: 574.28°C at 760 mmHg (Cal.)
• Flash point: 209.533°C (Cal.)