(5E,8E,11E)-13-Hydroxy-13-(3-Pentyloxiran-2-Yl)Trideca-5,8,11-Trienoic Acid
[CAS# 79595-80-5]

Identification

• Name: (5E,8E,11E)-13-Hydroxy-13-(3-Pentyloxiran-2-Yl)Trideca-5,8,11-Trienoic Acid
• Synonyms: (5E,8E,11E)-13-Hydroxy-13-(3-Pentyl-2-Oxiranyl)Trideca-5,8,11-Trienoic Acid; (5E,8E,11E)-13-(3-Amyloxiran-2-Yl)-13-Hydroxy-Trideca-5,8,11-Trienoic Acid; 5,8,11-Tridecatrienoic Acid, 13-Hydroxy-13-(3-Pentyloxiranyl)-
• Molecular Formula: C₂₀H₃₂O₄
• Molecular Weight: 336.47
• CAS Registry Number: 79595-80-5
• SMILES: C(C1OC1C(O)\C=C\C\C=C\C\C=C\CCCC(=O)O)CCCC
• InChI: 1S/C20H32O4/c1-2-3-11-15-18-20(24-18)17(21)14-12-9-7-5-4-6-8-10-13-16-19(22)23/h5-8,12,14,17-18,20-21H,2-4,9-11,13,15-16H2,1H3,(H,22,23)/b7-5+,8-6+,14-12+
• InChIKey: FMRVHRPEVIVXKX-MWQVBOBVSA-N

Properties

• Density: 1.046g/cm³ (Cal.)
• Boiling point: 503.001°C at 760 mmHg (Cal.)
• Flash point: 170.734°C (Cal.)