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W246328

Sigma-Aldrich

Ethyl isovalerate

natural, ≥98%, FCC, FG

Synonym(s):

Ethyl 3-methyl butanoate

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About This Item

Linear Formula:
(CH3)2CHCH2COOC2H5
CAS Number:
108-64-5
Molecular Weight:
130.18
FEMA Number:
2463
Beilstein/REAXYS Number:
1744677
EC Number:
203-602-3
Council of Europe no.:
442
MDL number:
MFCD00009203
UNSPSC Code:
12164502
PubChem Substance ID:
24901111
Flavis number:
9.447
NACRES:
NA.21

grade

FG
Fragrance grade
Halal
Kosher
natural

Quality Level

400

agency

follows IFRA guidelines
meets purity specifications of JECFA

reg. compliance

EU Regulation 1223/2009
EU Regulation 1334/2008 & 178/2002
FCC
FDA 21 CFR 117

vapor pressure

7.5 mmHg ( 20 °C)

assay

≥98%

refractive index

n20/D 1.396 (lit.)

bp

131-133 °C (lit.)

mp

−99 °C (lit.)

density

0.864 g/mL at 25 °C (lit.)

application(s)

flavors and fragrances

documentation

see Safety & Documentation for available documents

food allergen

no known allergens

fragrance allergen

no known allergens

organoleptic

apple; fruity; pineapple; sweet

SMILES string

CCOC(=O)CC(C)C

InChI

1S/C7H14O2/c1-4-9-7(8)5-6(2)3/h6H,4-5H2,1-3H3

InChI key

PPXUHEORWJQRHJ-UHFFFAOYSA-N

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Related Categories

pictograms

Flame
GHS02

signalword

Warning

hcodes

H226

Hazard Classifications

Flam. Liq. 3

Storage Class

3 - Flammable liquids

wgk_germany

WGK 2

flash_point_f

80.6 °F - closed cup

flash_point_c

27 °C - closed cup

ppe

Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter

Certificates of Analysis (COA)

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