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HomeProduct name listEthyl 6-Hydroxyhexanoate

Ethyl 6-Hydroxyhexanoate

Ethyl 6-Hydroxyhexanoate Structural

What is Ethyl 6-Hydroxyhexanoate?

The Uses of Ethyl 6-Hydroxyhexanoate

Ethyl 6-Hydroxyhexanoate is used as a reagent in the synthesis of cross-reactive carbohydrate determinants (CCDs) as tools for in vitro allergy diagnosis. Ethyl 6-Hydroxyhexanoate is also used in the preparation of N-5-Carboxypentyl-1-deoxymannojirimycin (C181150); a ligand used for the preparation of an affinity resin specific for Man9 mannosidase.

The Uses of Ethyl 6-Hydroxyhexanoate

Ethyl 6-hydroxyhexanoate is suitable for use in the synthesis of series of model phenol carbonate ester prodrugs having fatty acid-like structures. It may be used in the preparation of alkyl triflates. It may be used in the synthesis of ethyl 6-(trifluoromethylsulfonyloxy)hexanoate.

Synthesis Reference(s)

The Journal of Organic Chemistry, 38, p. 2786, 1973 DOI: 10.1021/jo00956a011
Synthetic Communications, 11, p. 599, 1981 DOI: 10.1080/00397918108063631

General Description

Ethyl 6-hydroxyhexanoate is an ethyl ester. Its concentration in bordeaux red wines has been evaluated. Two-step preparation of ethyl 6-hydroxyhexanoate via hydrolysis of e-caprolactone has been reported.

Properties of Ethyl 6-Hydroxyhexanoate

Boiling point: 127-128 °C/12 mmHg (lit.)
Density  0.985 g/mL at 25 °C (lit.)
refractive index  n20/D 1.437(lit.)
Flash point: >230 °F
storage temp.  Sealed in dry,Room Temperature
pka 15.15±0.10(Predicted)
form  clear liquid
color  Colorless to Almost colorless
InChI InChI=1S/C8H16O3/c1-2-11-8(10)6-4-3-5-7-9/h9H,2-7H2,1H3

Safety information for Ethyl 6-Hydroxyhexanoate

Signal word Warning
Pictogram(s)
ghs
Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H302:Acute toxicity,oral
H315:Skin corrosion/irritation
H319:Serious eye damage/eye irritation
H332:Acute toxicity,inhalation
H335:Specific target organ toxicity, single exposure;Respiratory tract irritation
Precautionary Statement Codes P261:Avoid breathing dust/fume/gas/mist/vapours/spray.
P280:Wear protective gloves/protective clothing/eye protection/face protection.
P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.

Computed Descriptors for Ethyl 6-Hydroxyhexanoate

InChIKey HYXRUZUPCFVWAH-UHFFFAOYSA-N
SMILES C(OCC)(=O)CCCCCO

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