(2E,4E,6E,8E)-3,7-Dimethyl-9-(2,2,6-Trimethyl-7-Oxabicyclo[4.1.0]Hept-1-Yl)-2,4,6,8-Nonatetraenoic Acid
[CAS# 13100-69-1]

Identification

• Name: (2E,4E,6E,8E)-3,7-Dimethyl-9-(2,2,6-Trimethyl-7-Oxabicyclo[4.1.0]Hept-1-Yl)-2,4,6,8-Nonatetraenoic Acid
• Synonyms: (2E,4E,6E,8E)-3,7-Dimethyl-9-(2,2,6-trimethyl-7-oxabicyclo[4.1.0]hept-1-yl)-2,4,6,8-nonatetraenoic acid; (2E,4E,6E,8E)-3,7-Dimethyl-9-(2,2,6-trimethyl-7-oxabicyclo[4.1.0]hept-1-yl)-2,4,6,8-nonatetraenoic acid #; 5,6-EPOXY-13-CIS RETINOIC ACID
• Molecular Formula: C₂₀H₂₈O₃
• Molecular Weight: 316.43
• CAS Registry Number: 13100-69-1
• SMILES: C/C(=C\C=C\C(=C\C(=O)O)\C)/C=C/C12C(CCCC1(O2)C)(C)C
• InChI: 1S/C20H28O3/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/h6,8-10,13-14H,7,11-12H2,1-5H3,(H,21,22)/b9-6+,13-10+,15-8+,16-14+
• InChIKey: KEEHJLBAOLGBJZ-WEDZBJJJSA-N

Properties

• Density: 1.1±0.1g/cm³ (Cal.)
• Boiling point: 455.3±18.0°C at 760 mmHg (Cal.)
• Flash point: 155.1±14.7°C (Cal.)
• Refractive index: 1.579 (Cal.)