W281107

Octyl octanoate

≥98%, FG

• Synonym(s): Octyl caprylate
• Empirical Formula (Hill Notation): C₁₆H₃₂O₂
• CAS Number: 2306-88-9
• Molecular Weight: 256.42
• FEMA Number: 2811
• EC Number: 218-980-5
• Council of Europe no.: 395
• MDL number: MFCD00129710
• UNSPSC Code: 12164502
• PubChem Substance ID: 24901190
• Flavis number: 9.114
• 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: ≥98%
• refractive index: n20/D 1.435 (lit.)
• bp: 307 °C (lit.)
• mp: −18 °C (lit.)
• density: 0.859 g/mL at 25 °C (lit.)
• application(s): flavors and fragrances
• Documentation: see Safety & Documentation for available documents
• food allergen: no known allergens
• Organoleptic: coconut; oily; fruity; sweet
• SMILES string: CCCCCCCCOC(=O)CCCCCCC
• InChI: 1S/C16H32O2/c1-3-5-7-9-11-13-15-18-16(17)14-12-10-8-6-4-2/h3-15H2,1-2H3
• InChI key: DJNTZVRUYMHBTD-UHFFFAOYSA-N

Safety Information

• Storage Class Code: 10 - Combustible liquids
• WGK: nwg
• Flash Point(F): Not applicable
• Flash Point(C): Not applicable
• Personal Protective Equipment: dust mask type N95 (US), Eyeshields, Gloves