Nonyl isovalerate

• CAS: 7786-47-2
• Catalog Number: ACM7786472
• Category: Other Products
• Molecular Weight: 228.37
• Molecular Formula: C14H28O2
• Synonyms: Isovaleric acid nonyl ester
• IUPAC Name: Nonyl 3-methylbutanoate
• Canonical SMILES: CCCCCCCCCOC(=O)CC(C)C
• InChI: InChI=1S/C14H28O2/c1-4-5-6-7-8-9-10-11-16-14(15)12-13(2)3/h13H,4-12H2,1-3H3
• InChI Key: JHKZVDVMXZGMOX-UHFFFAOYSA-N
• Boiling Point: 270.19 °C
• Melting Point: -37.3 °C
• Density: 0.858 g/mL at 25 °C(lit.)
• Solubility: Soluble in alcohol; insoluble in water
• Exact Mass: 228.208930132
• Monoisotopic Mass: 228.208930132
• Physical State: Liquid
• Refractive Index: n20/D 1.4036(lit.)
• Topological Polar Surface Area: 26.3 Ų