Methyl 2-Isopentyl-3-Oxocyclopentaneacetate
[CAS# 29711-19-1]

Identification

• Name: Methyl 2-Isopentyl-3-Oxocyclopentaneacetate
• Synonyms: Methyl 2-(2-Isopentyl-3-Oxo-Cyclopentyl)Acetate; 2-(2-Isopentyl-3-Oxocyclopentyl)Acetic Acid Methyl Ester; 2-(2-Isoamyl-3-Keto-Cyclopentyl)Acetic Acid Methyl Ester
• Molecular Formula: C₁₃H₂₂O₃
• Molecular Weight: 226.32
• CAS Registry Number: 29711-19-1
• EINECS: 249-798-4
• SMILES: C(C1C(CC(=O)OC)CCC1=O)CC(C)C
• InChI: 1S/C13H22O3/c1-9(2)4-6-11-10(5-7-12(11)14)8-13(15)16-3/h9-11H,4-8H2,1-3H3
• InChIKey: DGSQNDBKBFKKOZ-UHFFFAOYSA-N

Properties

• Density: 0.983g/cm³ (Cal.)
• Boiling point: 302.349°C at 760 mmHg (Cal.)
• Flash point: 127.938°C (Cal.)