(2E,4E,6E,8E)-3,7-Dimethyl-9-(2,2,6-Trimethyl-7-Oxabicyclo[4.1.0]Hept-4-En-1-Yl)Nona-2,4,6,8-Tetraenoic Acid
[CAS# 31979-12-1]

Identification

• Name: (2E,4E,6E,8E)-3,7-Dimethyl-9-(2,2,6-Trimethyl-7-Oxabicyclo[4.1.0]Hept-4-En-1-Yl)Nona-2,4,6,8-Tetraenoic Acid
• Synonyms: 5,6-Dihydro-3,4-Didehydro-5,6-Epoxyretinoic Acid All-Trans-; 5,6-Epoxy-Vitamin A-Saeure [German]; Retinoic Acid, 5,6-Dihydro-3,4-Didehydro-5,6-Epoxy-, All-Trans-
• Molecular Formula: C₂₀H₂₆O₃
• Molecular Weight: 314.42
• CAS Registry Number: 31979-12-1
• SMILES: CC12OC1(C(CC=C2)(C)C)\C=C\C(=C\C=C\C(=C\C(=O)O)C)C
• InChI: 1S/C20H26O3/c1-15(8-6-9-16(2)14-17(21)22)10-13-20-18(3,4)11-7-12-19(20,5)23-20/h6-10,12-14H,11H2,1-5H3,(H,21,22)/b9-6+,13-10+,15-8+,16-14+
• InChIKey: DDGZNINTWKHRFC-WEDZBJJJSA-N

Properties

• Density: 1.121g/cm³ (Cal.)
• Boiling point: 458.875°C at 760 mmHg (Cal.)
• Flash point: 157.656°C (Cal.)