9,12,13-Trihydroxy-10-Octadecenoic Acid
[CAS# 29907-56-0]

Identification

• Name: 9,12,13-Trihydroxy-10-Octadecenoic Acid
• Synonyms: Lmfa01050134; 10-Octadecenoic Acid, 9,12,13-Trihydroxy-; 9,12,13-Todea
• Molecular Formula: C₁₈H₃₄O₅
• Molecular Weight: 330.46
• CAS Registry Number: 29907-56-0
• SMILES: C(C(O)C(O)\C=C\C(O)CCCCCCCC(=O)O)CCCC
• InChI: 1S/C18H34O5/c1-2-3-7-11-16(20)17(21)14-13-15(19)10-8-5-4-6-9-12-18(22)23/h13-17,19-21H,2-12H2,1H3,(H,22,23)/b14-13+
• InChIKey: MDIUMSLCYIJBQC-BUHFOSPRSA-N

Properties

• Density: 1.075g/cm³ (Cal.)
• Boiling point: 531.526°C at 760 mmHg (Cal.)
• Flash point: 289.331°C (Cal.)