(7E,9E,11E,14E)-5-Hydroxy-6-Sulfanylicosa-7,9,11,14-Tetraenoic Acid
[CAS# 125467-37-0]

Identification

• Name: (7E,9E,11E,14E)-5-Hydroxy-6-Sulfanylicosa-7,9,11,14-Tetraenoic Acid
• Synonyms: (7E,9E,11E,14E)-5-Hydroxy-6-Sulfanyl-Icosa-7,9,11,14-Tetraenoic Acid; (7E,9E,11E,14E)-5-Hydroxy-6-Mercaptoicosa-7,9,11,14-Tetraenoic Acid; (7E,9E,11E,14E)-5-Hydroxy-6-Mercapto-Icosa-7,9,11,14-Tetraenoic Acid
• Molecular Formula: C₂₀H₃₂O₃S
• Molecular Weight: 352.53
• CAS Registry Number: 125467-37-0
• SMILES: C(C(O)C(S)\C=C\C=C\C=C\C\C=C\CCCCC)CCC(=O)O
• InChI: 1S/C20H32O3S/c1-2-3-4-5-6-7-8-9-10-11-12-13-16-19(24)18(21)15-14-17-20(22)23/h6-7,9-13,16,18-19,21,24H,2-5,8,14-15,17H2,1H3,(H,22,23)/b7-6+,10-9+,12-11+,16-13+
• InChIKey: IWFOTPBOSHKMBA-KVUXNHQJSA-N

Properties

• Density: 1.037g/cm³ (Cal.)
• Boiling point: 539.203°C at 760 mmHg (Cal.)
• Flash point: 279.9°C (Cal.)