Geranyl isovalerate

• CAS: 109-20-6
• Catalog Number: ACM109206
• Category: Other Products
• Molecular Weight: 238.37
• Molecular Formula: C15H26O2
• Description: Geranyl Isovalerate is a synthetic flavoring agent that is a moderately stable, Light yellow liquid of fruity odor. it should be stored in glass or tin containers. it is used in fruit flavors such as apple or pear with applications in beverages, ice cream, candy, and baked goods at 4-11 ppm.
• Synonyms: Geranyl 3-methylbutanoate
• IUPAC Name: [(2E)-3,7-Dimethylocta-2,6-dienyl] 3-methylbutanoate
• Canonical SMILES: CC(C)CC(=O)OCC=C(C)CCC=C(C)C
• InChI: InChI=1S/C15H26O2/c1-12(2)7-6-8-14(5)9-10-17-15(16)11-13(3)4/h7,9,13H,6,8,10-11H2,1-5H3/b14-9+
• InChI Key: SOUKTGNMIRUIQN-NTEUORMPSA-N
• Boiling Point: 279 °C
• Flash Point: 113 °C
• Density: 0.89 g/mL at 25 °C(lit.)
• Solubility: Soluble in alcohol, most fixed oils; insoluble in water
• Appearance: Colorless liquid
• Assay: 0.99
• EC Number: 203-655-2
• Exact Mass: 238.193280068
• Isomeric SMILES: CC(C)CC(=O)OC/C=C(\C)/CCC=C(C)C
• MDL Number: MFCD00036514
• Monoisotopic Mass: 238.193280068
• Packaging: 25 kg/DRUMS
• Physical State: Oily liquid
• Refractive Index: n20/D 1.458(lit.)
• Topological Polar Surface Area: 26.3 Ų