6-[2-{[(5-Carboxypentanoyl)oxy]methyl}-2-(hydroxymethyl)butoxy]-6-oxohexanoate
[CAS# 94110-05-1]

Identification

• Name: 6-[2-{[(5-Carboxypentanoyl)oxy]methyl}-2-(hydroxymethyl)butoxy]-6-oxohexanoate
• Synonyms: 2-ethyl-2-(hydroxymethyl)propane-1,3-diyl adipate
• Molecular Formula: C₁₈H₂₉O₉
• Molecular Weight: 389.42
• CAS Registry Number: 94110-05-1
• EINECS: 302-544-7
• SMILES: O=C(OCC(COC(=O)CCCCC([O-])=O)(CO)CC)CCCCC(O)=O
• InChI: 1S/C18H30O9/c1-2-18(11-19,12-26-16(24)9-5-3-7-14(20)21)13-27-17(25)10-6-4-8-15(22)23/h19H,2-13H2,1H3,(H,20,21)(H,22,23)/p-1
• InChIKey: GXOABUFMYVQIGL-UHFFFAOYSA-M

Properties

• Boiling point: 564.026°C at 760 mmHg (Cal.)
• Flash point: 193.127°C (Cal.)