2-isobutyl-4,5-dimethyl oxazole
4,5-dimethyl-2-(2-methylpropyl)-1,3-oxazole
 
Notes:
Constit. of French fried potato volatiles
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CAS Number: 26131-91-9Picture of molecule3D/inchi
FDA UNII: 31DA09P920
Nikkaji Web: J45.626H
XlogP3-AA: 2.80 (est)
Molecular Weight: 153.22475000
Formula: C9 H15 N O
NMR Predictor: Predict (works with chrome or firefox)
Category: flavoring agents
 
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JECFA Food Flavoring: 1556  2-isobutyl-4,5-dimethyloxazole
DG SANTE Food Flavourings: 13.195  2-isobutyl-4,5-dimethyl oxazole
FEMA Number: 4397 2-isobutyl-4,5-dimethyloxazole
FDA:No longer provide for the use of these seven synthetic flavoring substances
FDA Mainterm (SATF):26131-91-9 ; 2-ISOBUTYL-4,5-DIMETHYLOXAZOLE
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Physical Properties:
Appearance: pale yellow to yellow clear liquid (est)
Assay: 95.00 to 100.00 % 
Food Chemicals Codex Listed: No
Specific Gravity: 0.91000 to 0.91600 @  25.00 °C.
Pounds per Gallon - (est).: 7.572 to  7.622
Refractive Index: 1.43900 to 1.44700 @  20.00 °C.
Boiling Point: 227.00 °C. @ 760.00 mm Hg
Vapor Pressure: 0.408000 mmHg @ 25.00 °C. (est)
Flash Point: 166.00 °F. TCC ( 74.44 °C. )
logP (o/w): 2.501 (est)
Soluble in:
 alcohol
 water, 121.6 mg/L @ 25 °C (est)
Insoluble in:
 water
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Organoleptic Properties:
 
Odor Type: burnt
 
 burnt  roasted  
Odor Description:
at 0.10 % in propylene glycol. 
burnt roasted
 
Odor and/or flavor descriptions from others (if found).
 
 
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Cosmetic Information:
None found
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Suppliers:
Axsyn
For experimental / research use only.
Oxazole,4,5-dimethyl-2-(2-methylpropyl)-
Parchem
2-isobutyl-4,5-dimethyl oxazole
Chemical Sources Association
Need This Item for Flavor/Food?: You can contact the CSA
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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
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Safety in Use Information:
Category: flavoring agents
Recommendation for 2-isobutyl-4,5-dimethyl oxazole usage levels up to:
 not for fragrance use.
 
Maximised Survey-derived Daily Intakes (MSDI-EU): 0.17 (μg/capita/day)
Maximised Survey-derived Daily Intakes (MSDI-USA): 0.20 (μg/capita/day)
Threshold of Concern:540 (μg/person/day)
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: 23
Click here to view publication 23
 average usual ppmaverage maximum ppm
baked goods: 2.0000010.00000
beverages(nonalcoholic): 0.200001.00000
beverages(alcoholic): --
breakfast cereal: 0.200001.00000
cheese: 0.400002.00000
chewing gum: --
condiments / relishes: 0.200001.00000
confectionery froastings: 1.000005.00000
egg products: --
fats / oils: 0.200001.00000
fish products: 0.200001.00000
frozen dairy: 0.400002.00000
fruit ices: 0.400002.00000
gelatins / puddings: 1.000005.00000
granulated sugar: --
gravies: 1.000005.00000
hard candy: --
imitation dairy: 0.400002.00000
instant coffee / tea: --
jams / jellies: 1.000005.00000
meat products: 0.200001.00000
milk products: 0.400002.00000
nut products: --
other grains: 0.200001.00000
poultry: 0.200001.00000
processed fruits: 0.400002.00000
processed vegetables: --
reconstituted vegetables: --
seasonings / flavors: 0.200001.00000
snack foods: 0.200001.00000
soft candy: --
soups: 0.200001.00000
sugar substitutes: --
sweet sauces: 0.200001.00000
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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 85: Consideration of miscellaneous nitrogen-containing substances evaluated by JECFA (65th meeting)[1] - Scientific Opinion of the Scientific Panel on Food Additives, Flavourings, Processing Aids and Materials in Contact with Food
View page or View pdf
EPI System: View
AIDS Citations: Search
Cancer Citations: Search
Toxicology Citations: Search
EPA ACToR: Toxicology Data
EPA Substance Registry Services (SRS): Registry
Laboratory Chemical Safety Summary : 574068
National Institute of Allergy and Infectious Diseases: Data
 4,5-dimethyl-2-(2-methylpropyl)-1,3-oxazole
Chemidplus: 0026131919
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References:
 4,5-dimethyl-2-(2-methylpropyl)-1,3-oxazole
NIST Chemistry WebBook: Search Inchi
Pubchem (cid): 574068
Pubchem (sid): 135268008
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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): HMDB37880
FooDB: FDB017033
VCF-Online: VCF Volatile Compounds in Food
ChemSpider: View
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Potential Blenders and core components note
 
For Odor
chocolate
chocolate
 cocoa hexenalFL/FR
earthy
2-ethyl-3-methoxypyrazineFL/FR
 nutty pyrazineFL/FR
nutty
2-acetyl-3-ethyl pyrazineFL/FR
3,6-cocoa pyrazineFL/FR
sulfurous
 furfuryl thioacetateFL/FR
vegetable
 methionalFL/FR
 
For Flavor
 
No flavor group found for these
 benzyl methyl sulfideFL
2-butenoic acidFL
2-ethyl-3-methoxypyrazineFL/FR
 green pea pyrazineFL
2-methoxy-3-propyl pyrazineFL
 methyl 2-(methyl thio) acetateFL
4-(methyl thio) butanolFL
alliaceous
3-mercapto-2-pentanoneFL
2-methyl thioacetaldehydeFL
cocoa
 cocoa hexenalFL/FR
fatty
4,5-dimethyl-2-propyl oxazoleFL
green
2,5-dimethyl-4-ethyl oxazoleFL
 propylene glycol acetone ketalFL
meaty
4-allyl-2,6-dimethoxyphenolFL
milky
dextro,laevo-3-(methyl thio) butanoneFL
nutty
3-acetyl-2,5-dimethyl thiopheneFL
2-acetyl-3-ethyl pyrazineFL/FR
3,6-cocoa pyrazineFL/FR
2-ethyl-6-methyl pyrazineFL
 nutty pyrazineFL/FR
roasted
 furfuryl thioacetateFL/FR
 hexyl mercaptanFL
sulfurous
 potato butanoneFL
tomato
 methionalFL/FR
vegetable
 potato butyraldehydeFL
winey
5-ethyl-2-methyl pyridineFL
 
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Potential Uses:
 baconFL
 beefFL
 beef roasted beefFL
 chickenFL
 chicory rootFL
 chocolate cacaoFL
 fungusFR
 hawthornFR
 lambFL
 liverFL
 meatFL
 meat grilled meatFL
 meat roasted meatFL
 meat smoked meatFL
 mushroomFL
 nut roasted nutFL
 parsnip 
 porkFL
 potatoFL
 potato baked potatoFL
 potato baked potatoFL
 potato chipFL
 potato fried potatoFL
 roastedFL
 salamiFL
 truffle 
 turkeyFL
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Occurrence (nature, food, other): note
 potato fried potato
Search Trop  Picture
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Synonyms:
2-isobutyl-4,5-dimethyloxazole
4,5-dimethyl-2-(2-methylpropyl)-1,3-oxazole
4,5-dimethyl-2-isobutyl oxazole
4,5-dimethyl-2-isobutyloxazole
2-(2-methyl propyl)-4,5-dimethyl oxazole
2-(2-methylpropyl)-4,5-dimethyloxazole
 oxazole, 4,5-dimethyl-2-(2-methylpropyl)-
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