(2R)-2-[(4S)-2,2-Dimethyl-5-Oxo-1,3-Dioxolan-4-Yl]-4-Methylpentanoic Acid
[CAS# 157518-70-2]

Identification

• Name: (2R)-2-[(4S)-2,2-Dimethyl-5-Oxo-1,3-Dioxolan-4-Yl]-4-Methylpentanoic Acid
• Synonyms: 2R-(2,2-dimethyl-4oxo-1,3,-dioxalan-5S-yl)-4-methylpentanoic acid; nchembio781-comp3
• Molecular Formula: C₁₁H₁₈O₅
• Molecular Weight: 230.26
• CAS Registry Number: 157518-70-2
• SMILES: O=C1OC(O[C@H]1[C@H](C(=O)O)CC(C)C)(C)C
• InChI: 1S/C11H18O5/c1-6(2)5-7(9(12)13)8-10(14)16-11(3,4)15-8/h6-8H,5H2,1-4H3,(H,12,13)/t7-,8+/m1/s1
• InChIKey: ZUOVLWXPFQJYLF-SFYZADRCSA-N

Properties

• Density: 1.138g/cm³ (Cal.)
• Boiling point: 366.693°C at 760 mmHg (Cal.)
• Flash point: 138.37°C (Cal.)
• Refractive index: 1.464 (Cal.)

References

• (1): Sieber et al.. Proteomic profiling of metalloprotease activities with cocktails of active-site directed probes, Nature Chemical Biology, 2006