W289906

3-Phenylpropyl isovalerate

≥99%

• Synonym(s): 3-Phenylpropyl-β-methylbutyrate, Hydrocinnamyl isovalerate
• Linear Formula: (CH₃)₂CHCH₂CO₂(CH₂)₃C₆H₅
• CAS Number: 5452-07-3
• Molecular Weight: 220.31
• FEMA Number: 2899
• EC Number: 226-692-6
• Council of Europe no.: 462
• MDL number: MFCD00067041
• UNSPSC Code: 12164502
• PubChem Substance ID: 24901382

Properties

• biological source: synthetic
• Assay: ≥99%
• refractive index: n20/D 1.484 (lit.)
• bp: 285 °C (lit.)
• density: 0.98 g/mL at 25 °C (lit.)
• application(s): flavors and fragrances
• SMILES string: CC(C)CC(OCCCC1=CC=CC=C1)=O
• InChI: 1S/C14H20O2/c1-12(2)11-14(15)16-10-6-9-13-7-4-3-5-8-13/h3-5,7-8,12H,6,9-11H2,1-2H3
• InChI key: LBNFCOMOXOWXCD-UHFFFAOYSA-N

Safety Information

• Storage Class Code: 12 - Non Combustible Liquids
• WGK: WGK 3
• Flash Point(F): Not applicable
• Flash Point(C): Not applicable
• Personal Protective Equipment: dust mask type N95 (US), Eyeshields, Gloves