(5E,8E,11E,14E,17E)-(5,6,8,9,11,12,14,15,17,18-³H₁₀)-5,8,11,14,17-Icosapentaenoic Acid
[CAS# 117396-78-8]

Identification

• Name: (5E,8E,11E,14E,17E)-(5,6,8,9,11,12,14,15,17,18-³H₁₀)-5,8,11,14,17-Icosapentaenoic Acid
• Synonyms: (5E,8E,11E,14E,17E)-(5,6,8,9,11,12,14,15,17,18-³H₁₀)-5,8,11,14,17-Icosapentaenoic acid; (5E,8E,11E,14E,17E)-(5,6,8,9,11,12,14,15,17,18-³H₁₀)-5,8,11,14,17-Icosapentaensäure
• Molecular Formula: C₂₀H₂₀T₁₀O₂
• Molecular Weight: 322.53
• CAS Registry Number: 117396-78-8
• SMILES: [3H]/C(=C(/[3H])\C/C(=C(\[3H])/C/C(=C(\[3H])/C/C(=C(\[3H])/C/C(=C(\[3H])/CCCC(=O)O)/[3H])/[3H])/[3H])/[3H])/CC
• InChI: 1S/C20H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h3-4,6-7,9-10,12-13,15-16H,2,5,8,11,14,17-19H2,1H3,(H,21,22)/b4-3+,7-6?,10-9?,13-12?,16-15?/i3T,4T,6T,7T,9T,10T,12T,13T,15T,16T
• InChIKey: JAZBEHYOTPTENJ-XAQBNKEHSA-N

Properties

• Boiling point: 439.3±24.0°C at 760 mmHg (Cal.)
• Flash point: 336.0±18.0°C (Cal.)
• Refractive index: (Cal.)