(5Z,8R,9R,10E,12S)-8-Acetyl-9-Formyl-12-Hydroxyheptadeca-5,10-Dienoic Acid
[CAS# 91712-41-3]

Identification

• Name: (5Z,8R,9R,10E,12S)-8-Acetyl-9-Formyl-12-Hydroxyheptadeca-5,10-Dienoic Acid
• Synonyms: (5Z,8R,9R,10E,12S)-8-Acetyl-9-Formyl-12-Hydroxy-Heptadeca-5,10-Dienoic Acid; (5Z,8R,9R,10E,12S)-8-Ethanoyl-12-Hydroxy-9-Methanoyl-Heptadeca-5,10-Dienoic Acid; 5,10-Heptadecadienoic Acid, 8-Acetyl-9-Formyl-12-Hydroxy-, (8R-(5Z,8R*,9R*,10E,12S*))-
• Molecular Formula: C₂₀H₃₂O₅
• Molecular Weight: 352.47
• CAS Registry Number: 91712-41-3
• SMILES: [C@@H]([C@@H](\C=C\[C@@H](O)CCCCC)C=O)(C(=O)C)C\C=C/CCCC(=O)O
• InChI: 1S/C20H32O5/c1-3-4-7-10-18(23)14-13-17(15-21)19(16(2)22)11-8-5-6-9-12-20(24)25/h5,8,13-15,17-19,23H,3-4,6-7,9-12H2,1-2H3,(H,24,25)/b8-5-,14-13+/t17-,18-,19-/m0/s1
• InChIKey: WJWAORNTZNRHBP-QNUMDXCLSA-N

Properties

• Density: 1.057g/cm³ (Cal.)
• Boiling point: 541.919°C at 760 mmHg (Cal.)
• Flash point: 295.609°C (Cal.)