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Key Documents

W247707

Sigma-Aldrich

Isoeugenyl phenylacetate, mixture of cis and trans

≥97%

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About This Item

Linear Formula:
C6H5CH2CO2C6H3-2-(OCH3)-4-(CH=CHCH3)
CAS Number:
Molecular Weight:
282.33
FEMA Number:
2477
EC Number:
Council of Europe no.:
237
MDL number:
UNSPSC Code:
12164502
PubChem Substance ID:
Flavis number:
9.710

biological source

synthetic

reg. compliance

FDA 21 CFR 172.515

Assay

≥97%

refractive index

n20/D 1.577 (lit.)

density

1.119 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; cinnamon; honey; spicy; sweet

SMILES string

COc1cc(\C=C\C)ccc1OC(=O)Cc2ccccc2

InChI

1S/C18H18O3/c1-3-7-14-10-11-16(17(12-14)20-2)21-18(19)13-15-8-5-4-6-9-15/h3-12H,13H2,1-2H3/b7-3+

InChI key

YYLCMLYMJHKLEJ-XVNBXDOJSA-N

Storage Class Code

10 - Combustible liquids

WGK

WGK 3

Flash Point(F)

235.4 °F - closed cup

Flash Point(C)

113 °C - closed cup


Certificates of Analysis (COA)

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