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W221811

Sigma-Aldrich

Butyl isovalerate

natural, FG

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Linear Formula:
(CH3)2CHCH2COO(CH2)3CH3
CAS Number:
Molecular Weight:
158.24
FEMA Number:
2218
Beilstein:
1752803
EC Number:
Council of Europe no.:
444
MDL number:
UNSPSC Code:
12164502
PubChem Substance ID:
Flavis number:
9.449
NACRES:
NA.21

grade

FG
Fragrance grade
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
FDA 21 CFR 117

Assay

98%

refractive index

n20/D 1.409 (lit.)

bp

175 °C (lit.)

density

0.858 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; green; fruity; peach; pineapple; sweet

SMILES string

CCCCOC(=O)CC(C)C

InChI

1S/C9H18O2/c1-4-5-6-11-9(10)7-8(2)3/h8H,4-7H2,1-3H3

InChI key

AYWJSCLAAPJZEF-UHFFFAOYSA-N

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Pictograms

Exclamation mark

Signal Word

Warning

Hazard Statements

Precautionary Statements

Hazard Classifications

Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

WGK

WGK 2

Flash Point(F)

closed cup

Flash Point(C)

closed cup


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