(2Z,4E,6E,8E)-9-[6-(Hydroxymethyl)-2,6-Dimethyl-1-Cyclohexenyl]-3,7-Dimethylnona-2,4,6,8-Tetraenoic Acid
[CAS# 126532-33-0]

Identification

• Name: (2Z,4E,6E,8E)-9-[6-(Hydroxymethyl)-2,6-Dimethyl-1-Cyclohexenyl]-3,7-Dimethylnona-2,4,6,8-Tetraenoic Acid
• Synonyms: (2Z,4E,6E,8E)-9-[6-(Hydroxymethyl)-2,6-Dimethyl-1-Cyclohexenyl]-3,7-Dimethyl-Nona-2,4,6,8-Tetraenoic Acid; (2Z,4E,6E,8E)-9-(2,6-Dimethyl-6-Methylol-1-Cyclohexenyl)-3,7-Dimethyl-Nona-2,4,6,8-Tetraenoic Acid; 13-Cis-(+-)-16-Hydroxyretinoic Acid
• Molecular Formula: C₂₀H₂₈O₃
• Molecular Weight: 316.44
• CAS Registry Number: 126532-33-0
• SMILES: C(O)C1(C(=C(CCC1)C)\C=C\C(=C\C=C\C(=C/C(=O)O)C)C)C
• InChI: 1S/C20H28O3/c1-15(7-5-8-16(2)13-19(22)23)10-11-18-17(3)9-6-12-20(18,4)14-21/h5,7-8,10-11,13,21H,6,9,12,14H2,1-4H3,(H,22,23)/b8-5+,11-10+,15-7+,16-13-
• InChIKey: GIEPJVBJRPHMTO-LZSJLJNCSA-N

Properties

• Density: 1.07g/cm³ (Cal.)
• Boiling point: 512.23°C at 760 mmHg (Cal.)
• Flash point: 277.674°C (Cal.)