W289205

2-Phenylpropyl isobutyrate

≥97%, FG

• Synonym(s): Hydratropyl isobutyrate
• Linear Formula: (CH₃)₂CHCO₂CH₂CH(C₆H₅)CH₃
• CAS Number: 65813-53-8
• Molecular Weight: 206.28
• FEMA Number: 2892
• EC Number: 265-931-9
• Council of Europe no.: 2087
• MDL number: MFCD00008915
• UNSPSC Code: 12164502
• PubChem Substance ID: 24901379
• Flavis number: 9.485
• NACRES: NA.21

Properties

• biological source: synthetic
• Quality Level: 400
• grade: FG; Kosher
• Agency: meets purity specifications of JECFA
• reg. compliance: EU Regulation 1334/2008 & 872/2012
• Assay: ≥97%
• refractive index: n20/D 1.485 (lit.)
• density: 0.973 g/mL at 25 °C (lit.)
• application(s): flavors and fragrances
• Documentation: see Safety & Documentation for available documents
• food allergen: no known allergens
• Organoleptic: fruity; floral
• SMILES string: CC(C)C(=O)OCC(C)c1ccccc1
• InChI: 1S/C13H18O2/c1-10(2)13(14)15-9-11(3)12-7-5-4-6-8-12/h4-8,10-11H,9H2,1-3H3
• InChI key: LZTCJUAHYXNKRE-UHFFFAOYSA-N

Safety Information

• Storage Class Code: 10 - 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