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

3-oxodecanoic acid glyceride
palm oil glycerides mono- and di- hydrogenated 3-oxodecanoates

Supplier Sponsors

CAS Number: 91052-69-6Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:293-231-3
FDA UNII:F948QSY21J
CoE Number:10650
Molecular Weight:260.33028000
Formula:C13 H24 O5
NMR Predictor:Predict (works with chrome or firefox)
CAS Number: 128331-45-3Picture of molecule3D/inchi
Formula:C13 H25 O6 -
NMR Predictor:Predict (works with chrome or firefox)
EFSA/JECFA Comments:
Racemate (EFFA, 2010a). According to JECFA: Min. Assay value is "95 by ester determination".
Category:emulsifiers, flavoring 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
 FDA/DG SANTE Petitions, Reviews, Notices:
1975 Glycerin and Glycerides View-review
JECFA Food Flavoring:914 3-oxodecanoic acid glyceride
FLAVIS Number:09.552 (Old)
DG SANTE Food Flavourings:09.552 3-oxodecanoic acid glyceride
FEMA Number:3767 3-oxodecanoic acid glyceride
FDA:No longer provide for the use of these seven synthetic flavoring substances
FDA Mainterm (SATF):128331-45-3 ; 3-OXODECANOIC ACID GLYCERIDE
 
Physical Properties:
Appearance:white to pale yellow solid flakes (est)
Assay: 95.00 to 100.00
Food Chemicals Codex Listed: No
Melting Point: 57.00 to 60.00 °C. @ 760.00 mm Hg
Boiling Point: 399.00 to 402.00 °C. @ 760.00 mm Hg
Acid Value: 2.00 max. KOH/g
Flash Point: 293.00 °F. TCC ( 145.00 °C. )
logP (o/w): 1.920 (est)
Soluble in:
 alcohol
 oils
 water, slightly
 water, 5912 mg/L @ 25 °C (est)
Insoluble in:
 water
 
Organoleptic Properties:
Odor Strength:low
Odor Description:at 100.00 %. mild fatty
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
None found
 
Suppliers:
BOC Sciences
For experimental / research use only.
Glycerides, palm-oilmono- and di-, hydrogenated, 3-oxodecanoates
Parchem
3-oxodecanoic acid glyceride
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: emulsifiers, flavoring agents
Recommendation for 3-oxodecanoic acid glyceride usage levels up to:
 not for fragrance use.
 
Maximised Survey-derived Daily Intakes (MSDI-EU): 52.00 (μg/capita/day)
Maximised Survey-derived Daily Intakes (MSDI-USA): 270.00 (μg/capita/day)
Structure Class: III
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: 15
 average usual ppmaverage maximum ppm
baked goods: -10.00000
beverages(nonalcoholic): --
beverages(alcoholic): --
breakfast cereal: --
cheese: --
chewing gum: --
condiments / relishes: --
confectionery froastings: --
egg products: --
fats / oils: --
fish products: --
frozen dairy: --
fruit ices: --
gelatins / puddings: --
granulated sugar: --
gravies: --
hard candy: --
imitation dairy: -50.00000
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 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 64 (FGE.64): Consideration of aliphatic acyclic diols, triols, and related substances evaluated by JECFA (57th meeting) structurally related to aliphatic primary and secondary saturated and unsaturated alcohols, aldehydes, acetals, carboxylic acids and esters containing an additional oxygenated functional group and lactones from chemical groups 9, 13 and 30 evaluated by EFSA in FGE.10Rev1 (EFSA, 2008ab)
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 ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
National Institute of Allergy and Infectious Diseases:Data
2,3-dihydroxypropyl 3-oxodecanoate
Chemidplus:0091052696
3-oxodecanoate; propane-1,2,3-triol
Chemidplus:0128331453
 
References:
 2,3-dihydroxypropyl 3-oxodecanoate
NIST Chemistry WebBook:Search Inchi
Pubchem (sid):135356863
 3-oxodecanoate; propane-1,2,3-triol
NIST Chemistry WebBook:Search Inchi
Pubchem (cid):25080119
Pubchem (sid):135310333
 
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):HMDB39846
FooDB:FDB019501
FDA Listing of Food Additive Status:View
VCF-Online:VCF Volatile Compounds in Food
ChemSpider:View
 
Potential Blenders and core components note
For Odor
acidic
iso
butyric acid
FL/FR
balsamic
cinnamyl benzoate
FL/FR
bready
coffee furanone
FL/FR
buttery
acetoin
FL/FR
acetyl butyryl
FL/FR
acetyl isobutyryl
FL/FR
acetyl propionyl
FL/FR
butyl butyryl lactate
FL/FR
butyl octanoate
FL/FR
2,3-
heptane dione
FL/FR
3,4-
hexane dione
FL/FR
caramellic
alpha,alpha-
dimethyl anisyl acetone
FL/FR
cheesy
butyric acid
FL/FR
coconut
delta-
nonalactone
FL/FR
gamma-
nonalactone (aldehyde C-18 (so-called))
FL/FR
coffee
1-
hydroxy-2-butanone
FL/FR
creamy
para-
vanillic acid
FL/FR
waxy lactone
FL/FR
fatty
butyl undecylenate
FL/FR
4-
methyl octanoic acid
FL/FR
fermented
butyl laevo-lactate
FL/FR
floral
benzyl lactate
FL/FR
jasmin pyranone
FL/FR
linalyl butyrate
FL/FR
fruity
acetoin acetate
FL/FR
gamma-
decalactone
FL/FR
ethyl lactate
FL/FR
prenyl isobutyrate
FL/FR
vanilla carboxylate
FL/FR
green
(Z)-4-
heptenal
FL/FR
(Z)-3-
hexen-1-yl butyrate
FL/FR
ivy dioxolane
FR
milky
laevo-
glutamine
CS
mushroom
1-
octen-3-yl butyrate
FL/FR
nutty
2,3-
dimethyl pyrazine
FL/FR
2-
ethyl pyrazine
FL/FR
soapy
ethyl undecanoate
FL/FR
tropical
delta-
dodecalactone
FL/FR
vanilla
ethyl vanillin isobutyrate
FL/FR
waxy
ethyl palmitate
FL/FR
2-
methyl heptanoic acid
FL/FR
delta-
tetradecalactone
FL/FR
2-
tridecanone
FL/FR
For Flavor
No flavor group found for these
benzyl lactate
FL/FR
butyl octanoate
FL/FR
2-
butyl thiophene
FL
cinnamyl benzoate
FL/FR
6-
decenoic acid
FL
alpha,alpha-
dimethyl anisyl acetone
FL/FR
3-(
methyl thio) hexanal
FL
prenyl isobutyrate
FL/FR
sodium 4-methyl-2-oxovalerate
FL
acidic
acidic
iso
butyric acid
FL/FR
alliaceous
3-
tetrahydrothiophenone
FL
brown
1-
hydroxy-2-butanone
FL/FR
buttery
butyl laevo-lactate
FL/FR
butyroin
FL
diacetyl
FL
2,3-
heptane dione
FL/FR
3,4-
hexane dione
FL/FR
(E)-2-
pentenoic acid
FL
cabbage
methyl 2-thiofuroate
FL
caramellic
3-
methyl butyl 2-furyl butyrate
FL
coconut
(R)-
massoia lactone
FL
gamma-
nonalactone (aldehyde C-18 (so-called))
FL/FR
creamy
acetoin
FL/FR
acetyl butyryl
FL/FR
acetyl isobutyryl
FL/FR
butyl butyryl lactate
FL/FR
5,5-
dibutyl dihydrofuran-2(3H)-one
FL
delta-
dodecalactone
FL/FR
jasmin pyranone
FL/FR
delta-
nonalactone
FL/FR
para-
vanillic acid
FL/FR
waxy lactone
FL/FR
fatty
diacetyl trimer
FL
4-
methyl octanoic acid
FL/FR
2-
tridecanone
FL/FR
(E,E)-2,4-
undecadienal
FL
floral
linalyl butyrate
FL/FR
fruity
acetoin acetate
FL/FR
acetyl isovaleryl
FL
gamma-
decalactone
FL/FR
ethyl lactate
FL/FR
vanilla carboxylate
FL/FR
green
(Z)-4-
heptenal
FL/FR
(Z)-3-
hexen-1-yl butyrate
FL/FR
milky
dextro,laevo-3-(
methyl thio) butanone
FL
mushroom
1-
octen-3-yl butyrate
FL/FR
nutty
coffee furanone
FL/FR
2,3-
dimethyl pyrazine
FL/FR
2-
ethyl pyrazine
FL/FR
sour
butyric acid
FL/FR
toasted
acetyl propionyl
FL/FR
vanilla
ethyl vanillin isobutyrate
FL/FR
waxy
butyl undecylenate
FL/FR
ethyl palmitate
FL/FR
ethyl undecanoate
FL/FR
2-
methyl heptanoic acid
FL/FR
delta-
tetradecalactone
FL/FR
 
Potential Uses:
FLbutter
FLdairy
 
Occurrence (nature, food, other):note
 butter
Search PMC Picture
 butter fat
Search PMC Picture
 milk fat
Search PMC Picture
 
Synonyms:
3-oxodecanoate; propane-1,2,3-triol
2,3-dihydroxypropyl 3-oxodecanoate
 glycerides palm oil mono- and di- hydrogenated 3-oxodecanoates
 glycerol 3-oxodecanoate
 palm oil glycerides mono- and di- hydrogenated 3-oxodecanoates
 

Articles:

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