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Key Documents

W286214

Sigma-Aldrich

Phenethyl isobutyrate

natural, ≥98%, FCC

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About This Item

Linear Formula:
(CH3)2CHCO2CH2CH2C6H5
CAS Number:
Molecular Weight:
192.25
FEMA Number:
2862
EC Number:
Council of Europe no.:
0302
MDL number:
UNSPSC Code:
12164502
PubChem Substance ID:
Flavis number:
9.427

grade

natural

reg. compliance

FCC

assay

≥98%

refractive index

n20/D 1.4873 (lit.)

bp

250 °C (lit.)

density

0.988 g/mL at 25 °C (lit.)

SMILES string

CC(C)C(=O)OCCc1ccccc1

InChI

1S/C12H16O2/c1-10(2)12(13)14-9-8-11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3

InChI key

JDQVBGQWADMTAM-UHFFFAOYSA-N

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General description

Natural Occurrence: Peppermint oil, Scotch spearmint oil, blue and other cheeses, beer cognac, rum, cider, olive oil, and glanga.

Biochem/physiol Actions

Taste at 1-10 ppm

Storage Class

13 - Non Combustible Solids

wgk_germany

WGK 2

flash_point_f

226.4 °F - closed cup

flash_point_c

108.00 °C - closed cup

ppe

Eyeshields, Gloves, type N95 (US)


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