Methyl (2E,3Z,5E)-6-[(3S)-2,2-Dimethyl-3-(3-Methylbut-2-Enoxy)-3,4-Dihydro-1,5-Benzodioxepin-8-Yl]-2-(Methoxymethylidene)-3-Methylhexa-3,5-Dienoate
[CAS# 129145-64-8]

Identification

• Name: Methyl (2E,3Z,5E)-6-[(3S)-2,2-Dimethyl-3-(3-Methylbut-2-Enoxy)-3,4-Dihydro-1,5-Benzodioxepin-8-Yl]-2-(Methoxymethylidene)-3-Methylhexa-3,5-Dienoate
• Synonyms: Methyl (2E,3Z,5E)-6-[(3S)-2,2-Dimethyl-3-(3-Methylbut-2-Enoxy)-3,4-Dihydro-1,5-Benzodioxepin-8-Yl]-2-(Methoxymethylene)-3-Methyl-Hexa-3,5-Dienoate; (2E,3Z,5E)-6-[(3S)-2,2-Dimethyl-3-(3-Methylbut-2-Enoxy)-3,4-Dihydro-1,5-Benzodioxepin-8-Yl]-2-(Methoxymethylene)-3-Methylhexa-3,5-Dienoic Acid Methyl Ester; (2E,3Z,5E)-6-[(3S)-2,2-Dimethyl-3-(3-Methylbut-2-Enoxy)-3,4-Dihydro-1,5-Benzodioxepin-8-Yl]-2-(Methoxymethylene)-3-Methyl-Hexa-3,5-Dienoic Acid Methyl Ester
• Molecular Formula: C₂₆H₃₄O₆
• Molecular Weight: 442.55
• CAS Registry Number: 129145-64-8
• SMILES: [C@@H]2(OCC=C(C)C)C(OC1=CC(=CC=C1OC2)\C=C\C=C(/C(C(OC)=O)=C\OC)C)(C)C
• InChI: 1S/C26H34O6/c1-18(2)13-14-30-24-17-31-22-12-11-20(15-23(22)32-26(24,4)5)10-8-9-19(3)21(16-28-6)25(27)29-7/h8-13,15-16,24H,14,17H2,1-7H3/b10-8+,19-9-,21-16+/t24-/m0/s1
• InChIKey: CGBAOGDKJZIWTF-BDONDIIXSA-N

Properties

• Density: 1.113g/cm³ (Cal.)
• Boiling point: 573.608°C at 760 mmHg (Cal.)
• Flash point: 243.932°C (Cal.)