W317215

Hexyl isobutyrate

natural (US), ≥97%, FG

• Synonym(s): Hexyl-2-methylpropionate
• Linear Formula: (CH₃)₂CHCO₂(CH₂)₅CH₃
• CAS Number: 2349-07-7
• Molecular Weight: 172.26
• FEMA Number: 3172
• EC Number: 219-075-8
• Council of Europe no.: 646
• MDL number: MFCD00027297
• UNSPSC Code: 12164502
• PubChem Substance ID: 329830573
• Flavis number: 9.478

Properties

• grade: FG; Halal; Kosher; natural (US)
• reg. compliance: EU Regulation 1334/2008 & 178/2002
• Assay: ≥97%
• refractive index: n20/D 1.413 (lit.)
• density: 0.86 g/mL at 25 °C (lit.)
• application(s): flavors and fragrances
• Documentation: see Safety & Documentation for available documents
• food allergen: no known allergens
• Organoleptic: apple; green; fruity; pear; sweet
• SMILES string: CCCCCCOC(=O)C(C)C
• InChI: 1S/C10H20O2/c1-4-5-6-7-8-12-10(11)9(2)3/h9H,4-8H2,1-3H3
• InChI key: CYHBDKTZDLSRMY-UHFFFAOYSA-N

Safety Information

• Storage Class Code: 10 - Combustible liquids
• WGK: WGK 2
• Flash Point(F): 163.4 °F - closed cup
• Flash Point(C): 73 °C - closed cup