EU/US Properties Organoleptics Cosmetics Suppliers Safety Safety in use Safety references References Other Blenders Uses Occurrence Synonyms Articles Notes
 

ethyl 2,4,7-decatrienoate
2,4,7-decatrienoic acid, ethyl ester

Supplier Sponsors

CAS Number: 78417-28-4Picture of molecule3D/inchi
FDA UNII:H59MQA278Y
Nikkaji Web:J1.540.014E
CoE Number:10576
XlogP3-AA:3.30 (est)
Molecular Weight:194.27386000
Formula:C12 H18 O2
NMR Predictor:Predict (works with chrome or firefox)
EFSA/JECFA Comments:
Mixture of (Z)- and (E)- isomer for all three C=C double bonds (EFFA, 2010a). CASrn in Register does not specify stereoisomeric composition. Composition of stereoisomeric mixture to be specified.
Category:flavor and fragrance agents
 
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
Google Scholar:Search
Google Books:Search
Google Scholar: with word "volatile"Search
Google Scholar: with word "flavor"Search
Google Scholar: with word "odor"Search
Perfumer and Flavorist:Search
Google Patents:Search
US Patents:Search
EU Patents:Search
Pubchem Patents:Search
JECFA Food Flavoring:1193 ethyl 2,4,7-decatrienoate
FLAVIS Number:09.371 (Old)
DG SANTE Food Flavourings:09.371 ethyl deca-2,4,7-trienoate
FEMA Number:3832 ethyl 2,4,7-decatrienoate
FDA:No longer provide for the use of these seven synthetic flavoring substances
FDA Mainterm (SATF):78417-28-4 ; ETHYL 2,4,7-DECATRIENOATE
 
Physical Properties:
Appearance:colorless to pale yellow clear liquid (est)
Assay: 95.00 to 100.00
Food Chemicals Codex Listed: No
Specific Gravity:0.93300 to 0.93900 @ 25.00 °C.
Pounds per Gallon - (est).: 7.763 to 7.813
Refractive Index:1.54700 to 1.55400 @ 20.00 °C.
Boiling Point: 134.00 °C. @ 14.00 mm Hg
Boiling Point: 281.00 to 282.00 °C. @ 760.00 mm Hg
Acid Value: 1.00 max. KOH/g
Vapor Pressure:0.004000 mmHg @ 25.00 °C. (est)
Flash Point: 283.00 °F. TCC ( 139.44 °C. )
logP (o/w): 3.999 (est)
Soluble in:
 alcohol
 water
 water, 13.42 mg/L @ 25 °C (est)
 
Organoleptic Properties:
Odor Strength:medium ,
recommend smelling in a 10.00 % solution or less
Odor Description:at 10.00 % in dipropylene glycol. mild fatty
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
None found
 
Suppliers:
Axsyn
For experimental / research use only.
2,4,7-Decatrienoicacid, ethyl ester
BOC Sciences
For experimental / research use only.
Ethyl 2,4,7-decatrienoate
Parchem
ethyl 2,4,7-decatrienoate
Chemical Sources Association
Need This Item for Flavor/Food?: You can contact the Chemical Sources Association
 
Safety Information:
 
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
Recommendation for ethyl 2,4,7-decatrienoate usage levels up to:
  3.0000 % in the fragrance concentrate.
 
Maximised Survey-derived Daily Intakes (MSDI-EU): 0.024 (μg/capita/day)
Maximised Survey-derived Daily Intakes (MSDI-USA): 0.40 (μg/capita/day)
Structure Class: I
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: 18
 average usual ppmaverage maximum ppm
baked goods: --
beverages(nonalcoholic): --
beverages(alcoholic): --
breakfast cereal: 0.010000.02000
cheese: --
chewing gum: 0.050000.10000
condiments / relishes: --
confectionery froastings: --
egg products: --
fats / oils: 0.010000.03000
fish products: --
frozen dairy: --
fruit ices: 0.020000.05000
gelatins / puddings: --
granulated sugar: --
gravies: --
hard candy: 0.020000.05000
imitation dairy: --
instant coffee / tea: --
jams / jellies: --
meat products: --
milk products: 0.010000.03000
nut products: --
other grains: --
poultry: --
processed fruits: --
processed vegetables: --
reconstituted vegetables: --
seasonings / flavors: 0.005000.01000
snack foods: --
soft candy: 0.010000.02000
soups: --
sugar substitutes: --
sweet sauces: --
 
Safety References:
European Food Safety Athority(efsa):Flavor usage levels; Subacute, Subchronic, Chronic and Carcinogenicity Studies; Developmental / Reproductive Toxicity Studies; Genotoxicity Studies...

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

Flavouring Group Evaluation 70 (FGE.70): Consideration of aliphatic, alicyclic, linear, alpha,beta-unsaturated, di- and trienals and related alcohols, acids and esters evaluated by JECFA (61st meeting)
View page or View pdf

Scientific Opinion on Flavouring Group Evaluation 96 (FGE.96): Consideration of 88 flavouring substances considered by EFSA for which EU production volumes / anticipated production volumes have been submitted on request by DG SANCO. Addendum to FGE. 51, 52, 53, 54, 56, 58, 61, 62, 63, 64, 68, 69, 70, 71, 73, 76, 77, 79, 80, 83, 84, 85 and 87.
View page or View pdf

EPI System: View
EPA Substance Registry Services (TSCA):78417-28-4
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :6365780
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:2
ethyl deca-2,4,7-trienoate
Chemidplus:0078417284
 
References:
 ethyl deca-2,4,7-trienoate
NIST Chemistry WebBook:Search Inchi
Pubchem (cid):6365780
Pubchem (sid):135248410
 
Other Information:
(IUPAC):Atomic Weights of the Elements 2009
(IUPAC):Atomic Weights of the Elements 2009 (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):HMDB35235
FooDB:FDB013892
VCF-Online:VCF Volatile Compounds in Food
ChemSpider:View
 
Potential Blenders and core components note
For Odor
No odor group found for these
iso
valeraldehyde diethyl acetal
FL/FR
buttery
buttery
acetyl butyryl
FL/FR
ethereal
decyl propionate
FL/FR
fatty
allyl cyclohexyl hexanoate
FL/FR
iso
butyl undecylenate
FL/FR
coconut absolute
FL/FR
fruity
(E)-2-
hepten-1-yl acetate
FL/FR
(Z)-3-
octen-1-ol
FL/FR
octyl heptanoate
FL/FR
gamma-
undecalactone (aldehyde C-14 (so-called))
FL/FR
green
3-
heptanone
FL/FR
herbal
benzyl octanoate
FL/FR
oily
petal pyranone
FL/FR
waxy
9-
decenoic acid
FL/FR
For Flavor
No flavor group found for these
allyl cyclohexyl hexanoate
FL/FR
benzyl octanoate
FL/FR
iso
butyl undecylenate
FL/FR
decyl propionate
FL/FR
(E)-2-
hepten-1-yl acetate
FL/FR
3-
methyl-2-cyclopenten-1-one
FL
octyl heptanoate
FL/FR
valeraldehyde diethyl acetal
FL
iso
valeraldehyde diethyl acetal
FL/FR
creamy
creamy
acetyl butyryl
FL/FR
gamma-
undecalactone (aldehyde C-14 (so-called))
FL/FR
fatty
coconut absolute
FL/FR
(Z)-3-
octen-1-ol
FL/FR
green
3-(5-
methyl-2-furyl) butanal
FL
ketonic
3-
heptanone
FL/FR
oily
petal pyranone
FL/FR
waxy
9-
decenoic acid
FL/FR
 
Potential Uses:
None Found
 
Occurrence (nature, food, other):note
 durian fruit
Search Trop Picture
 pear fruit
Search Trop Picture
 
Synonyms:
2,4,7-decatrienoic acid, ethyl ester
 ethyl deca-2,4,7-trienoate
 

Articles:

 None found yet.
 
Notes:
Used as a food additive [EAFUS]
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