(3Z,6E,8E,12Z,15Z,18Z)-3,6,8,12,15,18-Docosahexaen-10-ol
[CAS# 90780-53-3]

Identification

• Name: (3Z,6E,8E,12Z,15Z,18Z)-3,6,8,12,15,18-Docosahexaen-10-ol
• Synonyms: "(±)13-hydroxy-4Z,7Z,10Z,14E,16Z,19Z-docosahexaenoic acid"; (±)13-HDoHE; (ñ)13-HDoHE
• Molecular Formula: C₂₂H₃₄O
• Molecular Weight: 314.51
• CAS Registry Number: 90780-53-3
• SMILES: CCCC=CCC=CCC=CCC(C=CC=CCC=CCC)O
• InChI: 1S/C22H34O/c1-3-5-7-9-11-12-13-15-17-19-21-22(23)20-18-16-14-10-8-6-4-2/h6-9,12-14,16-20,22-23H,3-5,10-11,15,21H2,1-2H3/b8-6-,9-7-,13-12-,16-14+,19-17-,20-18+
• InChIKey: WLJSEUMCVZZUTN-LZSWNSAASA-N

Properties

• Density: 0.895g/cm³ (Cal.)
• Boiling point: 433.739°C at 760 mmHg (Cal.)
• Flash point: 139.339°C (Cal.)