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ethyl undecanoate

Chemical Structure

General Material Information

Preferred name ethyl undecanoate
Trivial Name Ethyl undecanoate
Short Description undecanoic acid, ethyl ester
Formula C13 H26 O2
CAS Number 627-90-7
FEMA Number 3492
Flavis Number 9.274
ECHA Number 211-018-5
FDA UNII Q5223I1993
Nikkaji Number J115.160F
MDL MFCD00008958
COE Number 10633
xLogP3-AA 5.10 (est)
Bio Activity Summary External link
NMR Predictor External link
JECFA Food Flavoring 36 ethyl undecanoate
FDA Patent No longer provide for the use of these seven synthetic flavoring substances
FDA Mainterm 627-90-7 ; ETHYL UNDECANOATE
Synonyms
  • ethyl hendecanoate
  • ethyl undecylate
  • ethyl-undecanoate
  • ethylundecanoat
  • undecanoic acid ethyl ester
  • N- undecanoic acid ethyl ester
  • undecanoic acid, ethyl ester
  • Hendecanoic acid, ethyl ester
  • NSC 97265

US / EU / FDA / JECFA / FEMA / Scholar / Patents

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Other Information

(IUPAC):Atomic Weights of the Elements 2011 (pdf)
Videos:The Periodic Table of Videos
tgsc:Atomic Weights use for this web site
(IUPAC):Periodic Table of the Elements
FDA Substances Added to Food (formerly EAFUS):View
HMDB (The Human Metabolome Database):HMDB29552
FooDB:FDB000701
YMDB (Yeast Metabolome Database):YMDB16012
Export Tariff Code:2915.90.5050
Typical G.C.
VCF-Online:VCF Volatile Compounds in Food
ChemSpider:View

PhysChem Properties

Material listed in food chemical codex No
Molecular weight 214.34861755371
Specific gravity @ 20 °C
Pounds per Gallon 7.198 to 7.214
Refractive Index 1.428 to 1.43 @ 20 °C
Vapor Pressure 0.014 mmHg @ 25 °C
Flash Point TCC Value 110 °C TCC
logP (o/w) 5.371 est
Solubility
alcohol Yes
water, 1.132 mg/L @ 25 °C (est) Yes
water No

Organoleptic Properties

Odor Type: Soapy
soapy, waxy, fatty, cognac, coconut, buttery
Luebke, William tgsc, (1986) At 100.00 %. soapy waxy fatty cognac coconut
Mosciano, Gerard P&F 15, No. 5, 47, (1990) Soapy, waxy, fatty with a slight buttery nuance
Flavor Type: Waxy
waxy, creamy, fruity, coconut, cheesy
Mosciano, Gerard P&F 15, No. 5, 47, (1990) At 25.00 ppm. Waxy, creamy, slight fruity with a coconut and cheesy nuance

Occurrences

Potential Uses

Applications
Odor purposes Butter, Coconut, Cognac, Cream, Soapy sandalwood moss
Flavoring purposes Cheese, Fat, Nut
Other purposes Waxy

Safety Information

Safety information

Preferred SDS: View
European information :
Most important hazard(s):
None - None found.
S 02 - Keep out of the reach of children.
S 24/25 - Avoid contact with skin and eyes.
S 36 - Wear suitable protective clothing.
Hazards identification
Classification of the substance or mixture
GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)
None found.
GHS Label elements, including precautionary statements
Pictogram
Hazard statement(s)
None found.
Precautionary statement(s)
None found.
Oral/Parenteral Toxicity:
Not determined
Dermal Toxicity:
Not determined
Inhalation Toxicity:
Not determined

Safety in use information

Category:
flavor and fragrance agents
RIFM Fragrance Material Safety Assessment: Search
IFRA Code of Practice Notification of the 49th Amendment to the IFRA Code of Practice
Recommendation for ethyl undecanoate usage levels up to:
6.0000 % in the fragrance concentrate.
Use levels for FEMA GRAS flavoring substances on which the FEMA Expert Panel based its judgments that the substances are generally recognized as safe (GRAS).
The Expert Panel also publishes separate extensive reviews of scientific information on all FEMA GRAS flavoring substances and can be found at FEMA Flavor Ingredient Library
publication number: 10
Click here to view publication 10
average usual ppmaverage maximum ppm
baked goods: --
beverages(nonalcoholic): -2.00000
beverages(alcoholic): -8.00000
breakfast cereal: --
cheese: --
chewing gum: --
condiments / relishes: --
confectionery froastings: -16.00000
egg products: --
fats / oils: --
fish products: --
frozen dairy: -8.00000
fruit ices: -8.00000
gelatins / puddings: --
granulated sugar: --
gravies: --
hard candy: --
imitation dairy: --
instant coffee / tea: --
jams / jellies: --
meat products: --
milk products: --
nut products: --
other grains: --
poultry: --
processed fruits: --
processed vegetables: --
reconstituted vegetables: --
seasonings / flavors: --
snack foods: --
soft candy: --
soups: --
sugar substitutes: --
sweet sauces: --

Safety references

European Food Safety Authority (EFSA) reference(s):

Scientific Opinion on the safety and efficacy of straight-chain primary aliphatic alcohols/aldehydes/acids, acetals and esters with esters containing saturated alcohols and acetals containing saturated aldehydes (chemical group 1) when used as flavourings for all animal species
View page or View pdf

EPI System: View
AIDS Citations:Search
Cancer Citations:Search
Toxicology Citations:Search
EPA Substance Registry Services (TSCA):627-90-7
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :12327
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:3
ethyl undecanoate
Chemidplus:0000627907