W218901

Isobutyl isobutyrate

≥97%

• Synonym(s): 2-Methylpropyl 2-methylpropanoate
• Linear Formula: (CH₃)₂CHCO₂CH₂CH(CH₃)₂
• CAS Number: 97-85-8
• Molecular Weight: 144.21
• FEMA Number: 2189
• Beilstein: 1701355
• EC Number: 202-612-5
• Council of Europe no.: 292
• MDL number: MFCD00008916
• UNSPSC Code: 12164502
• PubChem Substance ID: 24900904
• Flavis number: 9.417
• NACRES: NA.21

Properties

• biological source: synthetic
• Quality Level: 400
• grade: Kosher
• reg. compliance: FDA 21 CFR 172.515
• vapor pressure: 1 mmHg ( 39.9 °C)
• Assay: ≥97%
• autoignition temp.: 810 °F
• refractive index: n20/D 1.398 (lit.)
• bp: 145-152 °C (lit.)
• mp: −81 °C (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: ethereal; fruity
• SMILES string: CC(C)COC(=O)C(C)C
• InChI: 1S/C8H16O2/c1-6(2)5-10-8(9)7(3)4/h6-7H,5H2,1-4H3
• InChI key: RXGUIWHIADMCFC-UHFFFAOYSA-N

Description

Disclaimer

For R&D or non-EU Food use. Not for retail sale.

Safety Information

• Pictograms: GHS02
• Signal Word: Warning
• Hazard Statements: H226
• Precautionary Statements: P210 - P233 - P240 - P241 - P242 - P243
• Hazard Classifications: Flam. Liq. 3
• Storage Class Code: 3 - Flammable liquids
• WGK: WGK 2
• Flash Point(F): 104.0 °F - closed cup
• Flash Point(C): 40 °C - closed cup
• Personal Protective Equipment: dust mask type N95 (US), Eyeshields, Gloves