Benzyl isobutyrate

• CAS: 103-28-6
• Catalog Number: ACM103286
• Category: Other Products
• Molecular Weight: 178.23
• Molecular Formula: C11H14O2
• Synonyms: Phenylmethyl 2-methylpropanoate
• IUPAC Name: Benzyl 2-methylpropanoate
• Canonical SMILES: CC(C)C(=O)OCC1=CC=CC=C1
• InChI: InChI=1S/C11H14O2/c1-9(2)11(12)13-8-10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3
• InChI Key: UIKJRDSCEYGECG-UHFFFAOYSA-N
• Boiling Point: 238 °C
• Flash Point: 138 °F
• Density: 1.003 g/mL at 25 °C(lit.)
• Solubility: Insoluble in water and glycerin, soluble in organic solvents, oils
• Appearance: Colorless liquid with a fresh, fruity-floral odour
• Assay: 0.9999
• Exact Mass: 178.099379685
• Monoisotopic Mass: 178.099379685
• Packaging: 1 kg
• Physical State: Liquid
• Refractive Index: n20/D 1.49(lit.)
• Topological Polar Surface Area: 26.3 Ų