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Ethyl dodecanoate

Ethyl dodecanoate structure

CAS No:
106-33-2
Formula:
C14H28O2
Chemical Name:
Ethyl dodecanoate
Synonyms:
Dodecanoic acid,ethyl ester;Lauric acid,ethyl ester;Ethyl dodecanoate;Ethyl dodecylate;Ethyl laurate;Ethyl laurinate;Ethyl n-dodecanoate;NSC 83467;NSC 8912;Dodecanoic acid monoethyl ester
Categories:
Cosmetic Ingredient > Perfuming

Description

clear colorless to slightly yellowish liquid Ethyl laurate has a floral, fruity odor.ChEBI: A fatty acid ethyl ester of lauric acid.Ethyl laurate (also known as ethyl dodecanoate) is a kind of laurate ester formed by the esterification between ethanol and laurate. It can be used as a fruity flavoring agent. It can be found in alcoholic beverages such as wine during fermentation process. It is presented in many kinds of fruits such as apple, apricot, guava, melon, etc as well as in wheatbread, c

Liquid|Colourless, oily liquid with a fruity, floral odour

Ethyl laurate is a fatty acid ethyl ester of lauric acid. It has a role as a metabolite.

Ethyl dodecanoate Basic Attributes

Molecular Weight：

228.37

Exact Mass：

228.37

BRN：

1769671

EC Number：

203-386-0

UNII：

F389D4MD5K

NSC Number：

83467|8912

DSSTox ID：

DTXSID4047044

HScode：

29341000

Characteristics

PSA：

26.3

XLogP3：

5.71

Appearance：

Liquid

Density：

0.8660 g/cm³ @ Temp: 15 °C

Melting Point：

-10 °C

Boiling Point：

271 °C

Flash Point：

>230 °F

Refractive Index：

n 20/D 1.432

Water Solubility：

insoluble

Storage Conditions：

−20°C

Vapor Pressure：

0.1 hPa (60 °C)

Toxicity：

LD50 orally in Rabbit: > 5000 mg/kg LD50 dermal Rabbit > 5000 mg/kg

Safety Information

wgk germany：

safety instructions：

23-24/25

Stability/Shelf Life：

Stable under normal temperatures and pressures.

GHS Classification：

Not Classified

Drug Information

MeSH Entry Terms：

ethyl laurate

Ethyl dodecanoate Use and Manufacturing

Methods of Manufacturing

It is formed by esterification of dodecanoyl chloride and ethanol with magnesium as a catalyst in ether solution.

Uses

Solvent. It is also used as an intermediate for flavors, fragrances, spandex additives and pharmaceutical raw materials.

Manufacturing Info：

Dodecanoic acid, ethyl ester: ACTIVE

Use Classification：

Food additives -> Flavoring Agents|Flavoring Agents -> JECFA Flavorings Index|Fatty Acyls [FA] -> Fatty esters [FA07] -> Wax monoesters [FA0701]|Cosmetics -> Emollient

Food Additive Classes：

Flavoring Agents

Computed Properties

Molecular Weight:228.37
XLogP3:5.6
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:12
Exact Mass:228.208930132
Monoisotopic Mass:228.208930132
Topological Polar Surface Area:26.3
Heavy Atom Count:16
Complexity:155
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Material

Lauric acid

Ethanol

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Guide of Ethyl dodecanoate

Description
Basic Attributes
Characteristics
Safety Information
Drug Information
Use and Manufacturing
Computed Properties
Material
Recommended Suppliers
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Ethyl dodecanoate

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