Cinnamyl isobutyrate

• CAS: 103-59-3
• Catalog Number: ACM103593
• Category: Other Products
• Molecular Weight: 204.26
• Molecular Formula: C13H16O2
• Description: Cinnamyl isobutyrate has a sweet, balsamic, fruity odor and sweet taste reminiscent of apple and banana. Cinnamyl Isobutyrate is a synthetic flavoring agent that is a moderately stable, colorless to Light yellow liquid of dry fruity color. it is stored in glass or tin containers. it is used to give a lift to jasmine with applications in baked goods and candy at 8 ppm.
• Synonyms: 2-Methyl-propanoic acid, 3-phenyl-2-propenyl ester
• IUPAC Name: [(E)-3-Phenylprop-2-enyl] 2-methylpropanoate
• Canonical SMILES: CC(C)C(=O)OCC=CC1=CC=CC=C1
• InChI: InChI=1S/C13H16O2/c1-11(2)13(14)15-10-6-9-12-7-4-3-5-8-12/h3-9,11H,10H2,1-2H3/b9-6+
• InChI Key: KLKQSZIWHVEARN-RMKNXTFCSA-N
• Boiling Point: 254 °C
• Flash Point: >230 °F
• Density: 1.008 g/mL at 25 °C(lit.)
• Solubility: Insoluble in water; soluble in oils
• Appearance: Colourless to yellowish liquid, sweet, balsamic fruity odour
• Assay: 0.99
• EC Number: 203-126-6
• Exact Mass: 204.115029749
• Isomeric SMILES: CC(C)C(=O)OC/C=C/C1=CC=CC=C1
• MDL Number: MFCD00048316
• Monoisotopic Mass: 204.115029749
• Packaging: 25 kg/DRUMS
• Physical State: Liquid
• Refractive Index: n20/D 1.524(lit.)
• Topological Polar Surface Area: 26.3 Ų