Butyl Levulinate

• Catalog Number: ACM2052155
• Product Name: Butyl Levulinate
• CAS: 2052-15-5
• Category: Heterocyclic Organic Compound
• Synonyms: 4-Oxo-pentanoic acid butyl ester
• IUPAC Name: Butyl 4-oxopentanoate
• Molecular Weight: 172.22
• Molecular Formula: C9H16O3
• Canonical SMILES: CCCCOC(=O)CCC(=O)C
• InChI: InChI=1S/C9H16O3/c1-3-4-7-12-9(11)6-5-8(2)10/h3-7H2,1-2H3
• InChI Key: ISBWNEKJSSLXOD-UHFFFAOYSA-N
• Boiling Point: 106-108 °C
• Flash Point: 197 °F
• Density: 0.974 g/mL at 25 °C(lit.)
• Solubility: Slightly soluble in water
• Exact Mass: 172.109944368
• Monoisotopic Mass: 172.109944368
• Physical State: Liquid
• Refractive Index: n20/D 1.427(lit.)
• Storage Conditions: 2-8 °C
• Topological Polar Surface Area: 43.4 Ų