Butanedioic Acid, Mono(2-((1-Oxohexadecyl)Oxy)-1-(((1-Oxohexadecyl)Oxy )Methyl)Ethyl) Ester
[CAS# 83554-62-5]

Identification

• Name: Butanedioic Acid, Mono(2-((1-Oxohexadecyl)Oxy)-1-(((1-Oxohexadecyl)Oxy )Methyl)Ethyl) Ester
• Synonyms: 4-[2-Hexadecanoyloxy-1-(Hexadecanoyloxymethyl)Ethoxy]-4-Oxo-Butanoic Acid; 4-Oxo-4-[2-(1-Oxohexadecoxy)-1-(1-Oxohexadecoxymethyl)Ethoxy]Butanoic Acid; 4-[2-Hexadecanoyloxy-1-(Hexadecanoyloxymethyl)Ethoxy]-4-Keto-Butyric Acid
• Molecular Formula: C₃₉H₇₂O₈
• Molecular Weight: 668.99
• CAS Registry Number: 83554-62-5
• SMILES: C(OC(=O)CCCCCCCCCCCCCCC)C(OC(=O)CCC(=O)O)COC(=O)CCCCCCCCCCCCCCC
• InChI: 1S/C39H72O8/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-37(42)45-33-35(47-39(44)32-31-36(40)41)34-46-38(43)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h35H,3-34H2,1-2H3,(H,40,41)
• InChIKey: XIIQDZOQBSLDBF-UHFFFAOYSA-N

Properties

• Density: 0.987g/cm³ (Cal.)
• Boiling point: 690.951°C at 760 mmHg (Cal.)
• Flash point: 191.257°C (Cal.)