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259942

Sigma-Aldrich

Methyl hexanoate

99%

Synonym(s):

Caproic acid methyl ester, Methyl caproate

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About This Item

Linear Formula:
CH3(CH2)4COOCH3
CAS Number:
106-70-7
Molecular Weight:
130.18
Beilstein:
1744683
EC Number:
203-425-1
MDL number:
MFCD00009510
UNSPSC Code:
12352100
PubChem Substance ID:
24855443
NACRES:
NA.22

Assay

99%

form

liquid

refractive index

n20/D 1.405 (lit.)

bp

151 °C (lit.)

mp

−71 °C (lit.)

solubility

chloroform: soluble 100 mg/mL, clear

density

0.885 g/mL at 25 °C (lit.)

functional group

ester

SMILES string

CCCCCC(=O)OC

InChI

1S/C7H14O2/c1-3-4-5-6-7(8)9-2/h3-6H2,1-2H3

InChI key

NUKZAGXMHTUAFE-UHFFFAOYSA-N

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General description

Hydrodeoxygenation of methyl hexanoate on commercial NiMo/γ-Al2O3 and CoMo/γ-Al2O3 hydro treatment catalysts in either oxide or sulphided form has been investigated. The oxidation of methyl hexanoate in a jet-stirred reactor has been studied.

Application

  • Effect of fat nature and aroma compound hydrophobicity on flavor release from complex food emulsions.: This study examines how the type of fat and the hydrophobic nature of aroma compounds, including methyl hexanoate, affect flavor release in food emulsions. The findings highlight the importance of molecular interactions in designing food products with optimized flavor profiles. (Relkin et al., 2004).

Pictograms

Flame
GHS02

Signal Word

Warning

Hazard Statements

H226

Hazard Classifications

Flam. Liq. 3

Storage Class Code

3 - Flammable liquids

WGK

WGK 3

Flash Point(F)

99.5 °F - closed cup

Flash Point(C)

37.5 °C - closed cup

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Certificates of Analysis (COA)

Search for Certificates of Analysis (COA) by entering the products Lot/Batch Number. Lot and Batch Numbers can be found on a product’s label following the words ‘Lot’ or ‘Batch’.

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Hydrodeoxygenation of methyl esters on sulphided NiMo/?-Al2O3 and CoMo/?-Al2O3 catalysts.
Senol OI, et al.
Catalysis Today, 100(3), 331-335 (2005)
Rebecca M Turner et al.
The Journal of biological chemistry, 289(46), 31837-31845 (2014-10-02)
Insect odorant receptors are heteromeric odorant-gated cation channels comprising a conventional odorant-sensitive tuning receptor (ORx) and a highly conserved co-receptor known as Orco. Orco is found only in insects, and very little is known about its structure and the mechanism
Suhyoung Bahk et al.
BMC biology, 14(1), 83-83 (2016-10-01)
Like most animals, insects rely on their olfactory systems for finding food and mates and in avoiding noxious chemicals and predators. Most insect olfactory neurons express an odorant-specific odorant receptor (OR) along with Orco, the olfactory co-receptor. Orco binds ORs
Experimental and kinetic modeling study of the oxidation of methyl hexanoate.
Dayma G al.
Energy and Fuels, 22(3), 1469-1479 (2008)
Supriyadi et al.
Bioscience, biotechnology, and biochemistry, 67(6), 1267-1271 (2003-07-05)
The methyl esters of carboxylic acids are characteristic olfactory volatile compounds for the sweet aroma of snake fruit, (Salacca edulis, Reinw) cv. Pondoh. Although methanol was not detected as a volatile constituent, the crude enzymes showed activity to synthesize the
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