W335908

2-Methylbutyl 2-methylbutyrate

≥95%, FG

• Synonym(s): DL-2-Methylbutyric acid 2-methylbutyl ester
• Linear Formula: C₂H₅CH(CH₃)CO₂CH₂CH(CH₃)C₂H₅
• CAS Number: 2445-78-5
• Molecular Weight: 172.26
• FEMA Number: 3359
• EC Number: 219-497-2
• Council of Europe no.: 10773
• MDL number: MFCD00059395
• UNSPSC Code: 12164502
• PubChem Substance ID: 24901664
• Flavis number: 9.516
• NACRES: NA.21

Properties

• biological source: synthetic
• Quality Level: 400
• grade: FG; Halal; Kosher
• agency: meets purity specifications of JECFA
• reg. compliance: EU Regulation 1334/2008 & 178/2002
• assay: ≥95%
• refractive index: n20/D 1.411-1.417 (lit.)
• bp: 70-72 °C/11 mmHg (lit.)
• density: 0.855 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; waxy; fruity; sweet
• SMILES string: CCC(C)COC(=O)C(C)CC
• InChI: 1S/C10H20O2/c1-5-8(3)7-12-10(11)9(4)6-2/h8-9H,5-7H2,1-4H3
• InChI key: PVYFCGRBIREQLL-UHFFFAOYSA-N

Safety Information

• Storage Class: 10 - Combustible liquids
• wgk_germany: WGK 3
• flash_point_f: 152.6 °F
• flash_point_c: 67 °C
• ppe: Eyeshields, Gloves, multi-purpose combination respirator cartridge (US)