Methyl (3S)-3-[(1S)-2-Oxocyclopentyl]Heptanoate
[CAS# 72429-04-0]

Identification

• Name: Methyl (3S)-3-[(1S)-2-Oxocyclopentyl]Heptanoate
• Synonyms: (3S)-3-[(1S)-2-Oxocyclopentyl]Heptanoic Acid Methyl Ester; (3S)-3-[(1S)-2-Ketocyclopentyl]Enanthic Acid Methyl Ester; Cyclopentanepropanoic Acid, Beta-Butyl-2-Oxo-, Methyl Ester
• Molecular Formula: C₁₃H₂₂O₃
• Molecular Weight: 226.32
• CAS Registry Number: 72429-04-0
• SMILES: [C@H](CC(=O)OC)([C@H]1C(=O)CCC1)CCCC
• InChI: 1S/C13H22O3/c1-3-4-6-10(9-13(15)16-2)11-7-5-8-12(11)14/h10-11H,3-9H2,1-2H3/t10-,11-/m0/s1
• InChIKey: JZAXFOYWGKXZDF-QWRGUYRKSA-N

Properties

• Density: 1.013g/cm³ (Cal.)
• Boiling point: 308.474°C at 760 mmHg (Cal.)
• Flash point: 131.198°C (Cal.)