Methyl 3-Oxododecanoate
[CAS# 76835-64-8]

Identification

• Name: Methyl 3-Oxododecanoate
• Synonyms: 3-Oxododecanoic Acid Methyl Ester; 3-Ketolauric Acid Methyl Ester
• Molecular Formula: C₁₃H₂₄O₃
• Molecular Weight: 228.33
• CAS Registry Number: 76835-64-8
• EINECS: 278-561-8
• SMILES: C(C(CC(OC)=O)=O)CCCCCCCC
• InChI: 1S/C13H24O3/c1-3-4-5-6-7-8-9-10-12(14)11-13(15)16-2/h3-11H2,1-2H3
• InChIKey: FHTQHJAYSZFNSI-UHFFFAOYSA-N

Properties

• Density: 0.937g/cm³ (Cal.)
• Boiling point: 271.733°C at 760 mmHg (Cal.)
• Flash point: 110.396°C (Cal.)

References

• (1): Gemma L. Thomas, Christine M. Böhner, Hannah E. Williams, Catherine M. Walsh, Mark Ladlow, Martin Welch, Clare E. Bryant and David R. Spring. Immunomodulatory effects of Pseudomonas aeruginosa quorum sensing small molecule probes on mammalian macrophages, Mol. Biosyst., 2006, 2, 132.