W221007

Isobutyl phenylacetate

≥98%, FCC, FG

• Linear Formula: C₆H₅CH₂CO₂CH₂CH(CH₃)₂
• CAS Number: 102-13-6
• Molecular Weight: 192.25
• FEMA Number: 2210
• EC Number: 203-007-9
• Council of Europe no.: 2160
• MDL number: MFCD00026482
• UNSPSC Code: 12164502
• PubChem Substance ID: 24900921
• Flavis number: 9.788
• NACRES: NA.21
• grade: FG; Halal; Kosher
• biological source: synthetic
• food allergen: no known allergens

Properties

• biological source: synthetic
• Quality Level: 300; 400
• grade: FG; Halal; Kosher
• Agency: meets purity specifications of JECFA
• reg. compliance: EU Regulation 1334/2008 & 178/2002; FCC; FDA 21 CFR 117; FDA 21 CFR 172.515
• Assay: ≥98%
• refractive index: n20/D 1.487 (lit.)
• bp: 253 °C (lit.)
• density: 0.986 g/mL at 25 °C (lit.)
• application(s): flavors and fragrances
• Documentation: see Safety & Documentation for available documents
• food allergen: no known allergens
• Organoleptic: cocoa; honey; floral; sweet
• SMILES string: CC(C)COC(=O)Cc1ccccc1
• InChI: 1S/C12H16O2/c1-10(2)9-14-12(13)8-11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3
• InChI key: RJASFPFZACBKBE-UHFFFAOYSA-N

Description

Biochem/physiol Actions

Taste at 5 ppm

Other Notes

Natural occurrence: Cocoa.

Safety Information

• Storage Class Code: 10 - Combustible liquids
• WGK: WGK 2
• Flash Point(F): 235.4 °F - closed cup
• Flash Point(C): 113 °C - closed cup
• Personal Protective Equipment: dust mask type N95 (US), Eyeshields, Gloves