08375
Ethyl hexanoate
analytical standard
Synonym(s):
Caproic acid ethyl ester, Ethyl caproate
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About This Item
Linear Formula:
CH3(CH2)4COOC2H5
CAS Number:
Molecular Weight:
144.21
UNSPSC Code:
85151701
NACRES:
NA.24
PubChem Substance ID:
EC Number:
204-640-3
Beilstein/REAXYS Number:
1701293
MDL number:
grade
analytical standard
Quality Level
vapor density
5 (vs air)
assay
≥99.0% (GC)
shelf life
limited shelf life, expiry date on the label
impurities
≤0.2% water
refractive index
n20/D 1.406-1.408, n20/D 1.407 (lit.)
bp
168 °C (lit.)
density
0.869 g/mL at 25 °C (lit.)
application(s)
cleaning products
cosmetics
flavors and fragrances
food and beverages
personal care
format
neat
SMILES string
CCCCCC(=O)OCC
InChI
1S/C8H16O2/c1-3-5-6-7-8(9)10-4-2/h3-7H2,1-2H3
InChI key
SHZIWNPUGXLXDT-UHFFFAOYSA-N
General description
Ethyl hexanoate, an ester, is a volatile aroma and fragrance compound which impacts the quality and flavor of wine, beer and Japanese sake.
Application
Ethyl hexanoate may be used as an analytical reference standard for the determination of the analyte in wine and beer samples by chromatography based techniques.
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signalword
Warning
hcodes
pcodes
Hazard Classifications
Flam. Liq. 3
Storage Class
3 - Flammable liquids
wgk
WGK 1
flash_point_f
127.4 °F - closed cup
flash_point_c
53 °C - closed cup
Regulatory Information
危险化学品
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J J Rodríguez-Bencomo et al.
Journal of chromatography. A, 963(1-2), 213-223 (2002-08-22)
Headspace solid-phase microextraction (HS-SPME) was studied for the high-resolution gas chromatographic (HRGC) analysis of esters in wines. Five different SPME fibers were tested and the influence of different factors such as temperature and time of desorption, extraction time, extraction technique
Determination of volatile compounds in wine by automated solid-phase microextraction and gas chromatography
Cabredo-Pinillos S, et al.
Chromatographia, 59(11-12), 733-738 (2004)
Highly efficient synthesis of ethyl hexanoate catalyzed by CALB-displaying Saccharomyces cerevisiae whole-cells in non-aqueous phase
Han SY, et al.
Journal of Molecular Catalysis. B, Enzymatic, 59(1-3), 168-172 (2009)
Global Trade Item Number
| SKU | GTIN |
|---|---|
| 08375-1ML | 04061838652287 |