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W246328

Sigma-Aldrich

Ethyl isovalerate

natural, ≥98%, FCC, FG

Synonym(s):
Ethyl 3-methyl butanoate
Linear Formula:
(CH3)2CHCH2COOC2H5
CAS Number:
Molecular Weight:
130.18
FEMA Number:
2463
Beilstein:
1744677
EC Number:
Council of Europe no.:
442
MDL number:
PubChem Substance ID:
Flavis number:
9.447
NACRES:
NA.21

grade

FG
Fragrance grade
Halal
Kosher
natural

Quality Level

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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Ethyl isovalerate natural, ≥98%, FCC, FG

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Ethyl isobutyrate natural, ≥98%, FCC, FG

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W242810

Ethyl isobutyrate

Ethyl isovalerate ≥98%, FCC, FG

Sigma-Aldrich

W246301

Ethyl isovalerate

agency

follows IFRA guidelines, meets purity specifications of JECFA

agency

follows IFRA guidelines, meets purity specifications of JECFA

agency

follows IFRA guidelines, meets purity specifications of JECFA

agency

meets purity specifications of JECFA

assay

≥98%

assay

≥98%

assay

≥98%

assay

≥98%

refractive index

n20/D 1.396 (lit.)

refractive index

n20/D 1.387 (lit.)

refractive index

n20/D 1.426 (lit.)

refractive index

n20/D 1.396 (lit.)

bp

131-133 °C (lit.)

bp

112-113 °C (lit.)

bp

63-64 °C/12 mmHg (lit.)

bp

131-133 °C (lit.)

mp

−99 °C (lit.)

mp

-

mp

-

mp

−99 °C (lit.)

Pictograms

Flame

Signal Word

Warning

Hazard Statements

Hazard Classifications

Flam. Liq. 3

Storage Class Code

3 - Flammable liquids

WGK

WGK 2

Flash Point(F)

80.6 °F - closed cup

Flash Point(C)

27 °C - closed cup

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

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