W368318
Ethyl 3-oxohexanoate
≥98%
Synonym(s):
Ethyl butyrylacetate
Sign In to View Organizational & Contract Pricing.
Select a Size
About This Item
Linear Formula:
CH3CH2CH2COCH2COOC2H5
CAS Number:
Molecular Weight:
158.19
Flavis number:
9.542
PubChem Substance ID:
UNSPSC Code:
12164502
FEMA Number:
3683
NACRES:
NA.21
EC Number:
221-835-9
MDL number:
Beilstein/REAXYS Number:
507689
Organoleptic:
berry; green; sweet
Biological source:
synthetic
Food allergen:
no known allergens
SMILES string
CCCC(=O)CC(=O)OCC
InChI key
KQWWVLVLVYYYDT-UHFFFAOYSA-N
InChI
1S/C8H14O3/c1-3-5-7(9)6-8(10)11-4-2/h3-6H2,1-2H3
biological source
synthetic
assay
≥98%
bp
104 °C/22 mmHg (lit.)
density
0.989 g/mL at 25 °C (lit.)
application(s)
flavors and fragrances
documentation
see Safety & Documentation for available documents
food allergen
no known allergens
organoleptic
berry; green; sweet
General description
Ethyl 3-oxohexanoate is a volatile flavor ester that is reported to occur in banana fruit. It can undergo bioreduction to form ethyl (R)-3-hydroxyhexanoate, another key food flavoring agent.
Storage Class
10 - Combustible liquids
wgk
WGK 3
flash_point_f
194.0 °F - closed cup
flash_point_c
90 °C - closed cup
ppe
Eyeshields, Gloves, multi-purpose combination respirator cartridge (US)
Regulatory Information
新产品
This item has
Choose from one of the most recent versions:
Already Own This Product?
Find documentation for the products that you have recently purchased in the Document Library.
Volatile components of banana fruit (Musa sapientum L.)?Indio? from Cuba.
Pino JA, et al.
J. Essent. Oil Res., 15(2), 79-80 (2003)
Highly enantioselective bioreduction of ethyl 3-oxohexanoate.
de Souza Ramos A, et al.
Tetrahedron Letters, 52(46), 6127-6129 (2011)
Our team of scientists has experience in all areas of research including Life Science, Material Science, Chemical Synthesis, Chromatography, Analytical and many others.
Contact Technical Service