3-Hexyl-6-methyl-1,4-dioxane-2,5-dione
[CAS# 779355-47-4]

Identification

• Name: 3-Hexyl-6-methyl-1,4-dioxane-2,5-dione
• Synonyms: 3-hexyl-6-methyl-1,4-dioxane-2,5-dione; 3-methyl-6-n-hexyl-1,4-dioxane-2,5-dione
• Molecular Formula: C₁₁H₁₈O₄
• Molecular Weight: 214.26
• CAS Registry Number: 779355-47-4
• SMILES: CCCCCCC1C(=O)OC(C(=O)O1)C
• InChI: 1S/C11H18O4/c1-3-4-5-6-7-9-11(13)14-8(2)10(12)15-9/h8-9H,3-7H2,1-2H3
• InChIKey: BSDLHDSKWLPXIW-UHFFFAOYSA-N

Properties

• Density: 1.045g/cm³ (Cal.)
• Boiling point: 345.462°C at 760 mmHg (Cal.)
• Flash point: 172.498°C (Cal.)
• Refractive index: 1.444 (Cal.)

References

• (1): Ryan J. Pounder, Helen Willcock, Nga Sze Ieong, Rachel K. O'Reilly and Andrew P. Dove. Stereocomplexation in novel degradable amphiphilic block copolymer micelles of poly(ethylene oxide) and poly(benzyl a-malate), Soft Matter, 2011, 7, 10987.