[1-(Hydroxymethyl)-2-[(1-Oxohexadecyl)Oxy]Ethyl] Hydrogen 2,3-Diacetoxysuccinate
[CAS# 99769-58-1]

Identification

• Name: [1-(Hydroxymethyl)-2-[(1-Oxohexadecyl)Oxy]Ethyl] Hydrogen 2,3-Diacetoxysuccinate
• Synonyms: 2,3-Diacetoxy-4-[1-(Hexadecanoyloxymethyl)-2-Hydroxy-Ethoxy]-4-Oxo-Butanoic Acid; 2,3-Diacetoxy-4-[1-(Hydroxymethyl)-2-(1-Oxohexadecoxy)Ethoxy]-4-Oxobutanoic Acid; 2,3-Diacetoxy-4-[1-(Hexadecanoyloxymethyl)-2-Hydroxy-Ethoxy]-4-Keto-Butyric Acid
• Molecular Formula: C₂₇H₄₆O₁₁
• Molecular Weight: 546.65
• CAS Registry Number: 99769-58-1
• EINECS: 309-035-9
• SMILES: C(OC(=O)CCCCCCCCCCCCCCC)C(OC(C(C(C(=O)O)OC(=O)C)OC(=O)C)=O)CO
• InChI: 1S/C27H46O11/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-23(31)35-19-22(18-28)38-27(34)25(37-21(3)30)24(26(32)33)36-20(2)29/h22,24-25,28H,4-19H2,1-3H3,(H,32,33)
• InChIKey: QVORAESNJZSAMB-UHFFFAOYSA-N

Properties

• Density: 1.136g/cm³ (Cal.)
• Boiling point: 644.828°C at 760 mmHg (Cal.)
• Flash point: 199.062°C (Cal.)