(E,2R)-N-[(2S,3R)-1,3-Dihydroxyoctadecan-2-Yl]-2-Hydroxyoctadec-3-Enamide
[CAS# 118106-53-9]

Identification

• Name: (E,2R)-N-[(2S,3R)-1,3-Dihydroxyoctadecan-2-Yl]-2-Hydroxyoctadec-3-Enamide
• Synonyms: (E,2R)-2-Hydroxy-N-[(1S,2R)-2-Hydroxy-1-(Hydroxymethyl)Heptadecyl]Octadec-3-Enamide; (E,2R)-2-Hydroxy-N-[(1S,2R)-2-Hydroxy-1-Methylol-Heptadecyl]Octadec-3-Enamide; (E,2R)-N-[(2S,3R)-1,3-Dihydroxyoctadecan-2-Yl]-2-Hydroxy-Octadec-3-Enamide
• Molecular Formula: C₃₆H₇₁NO₄
• Molecular Weight: 581.96
• CAS Registry Number: 118106-53-9
• SMILES: [C@H](C(=O)N[C@H]([C@@H](CCCCCCCCCCCCCCC)O)CO)(\C=C\CCCCCCCCCCCCCC)O
• InChI: 1S/C36H71NO4/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-35(40)36(41)37-33(32-38)34(39)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h29,31,33-35,38-40H,3-28,30,32H2,1-2H3,(H,37,41)/b31-29+/t33-,34+,35+/m0/s1
• InChIKey: LJKCPJOLKILGIR-FNQQTZKRSA-N

Properties

• Density: 0.945g/cm³ (Cal.)
• Boiling point: 721.309°C at 760 mmHg (Cal.)
• Flash point: 390.034°C (Cal.)