Ethyl (2E,4Z,6Z,8E)-4-Fluoro-3,7-Dimethyl-9-(2,6,6-Trimethyl-1-Cyclohexenyl)Nona-2,4,6,8-Tetraenoate
[CAS# 3887-00-1]

Identification

• Name: Ethyl (2E,4Z,6Z,8E)-4-Fluoro-3,7-Dimethyl-9-(2,6,6-Trimethyl-1-Cyclohexenyl)Nona-2,4,6,8-Tetraenoate
• Synonyms: (2E,4Z,6Z,8E)-4-Fluoro-3,7-Dimethyl-9-(2,6,6-Trimethyl-1-Cyclohexenyl)Nona-2,4,6,8-Tetraenoic Acid Ethyl Ester; Ethyl 12-Fluororetinoate; Retinoic Acid, 12-Fluoro-, Ethyl Ester
• Molecular Formula: C₂₂H₃₁FO₂
• Molecular Weight: 346.48
• CAS Registry Number: 3887-00-1
• SMILES: C(OC(=O)\C=C(\C(F)=C\C=C(/C=C/C1=C(CCCC1(C)C)C)C)C)C
• InChI: 1S/C22H31FO2/c1-7-25-21(24)15-18(4)20(23)13-11-16(2)10-12-19-17(3)9-8-14-22(19,5)6/h10-13,15H,7-9,14H2,1-6H3/b12-10+,16-11-,18-15+,20-13-
• InChIKey: XPMUOSSKBRSJAP-XZSVXRJRSA-N

Properties

• Density: 1.006g/cm³ (Cal.)
• Boiling point: 446.35°C at 760 mmHg (Cal.)
• Flash point: 215.794°C (Cal.)