Flavor Demo Formulas |
CAS Number: | 54300-08-2 | 3D/inchi
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ECHA EINECS - REACH Pre-Reg: | 259-076-0 |
FDA UNII: | RES1FSY5Z7 |
Nikkaji Web: | J266.851C |
MDL: | MFCD00055023 |
CoE Number: | 11294 |
XlogP3-AA: | 0.60 (est) |
Molecular Weight: | 150.18090000 |
Formula: | C8 H10 N2 O |
NMR Predictor: | Predict (works with chrome or firefox) |
EFSA/JECFA Comments: | Mixture of positional isomers (2-Acetyl-3,5/6-dimethyl), 3,5-dimethyl (65-70 %) and 3,6-dimethyl (25-30 %) isomers (sum 95 %) (EFFA, 2010a).
The JECFA evaluated 2-acetyl-3,(5 or 6)-dimethylpyrazine (mixture of two substancs with individual CASrn for each substance). Register CASrn to be changed/deleted. |
Category: flavor and fragrance agents
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
Physical Properties:
Appearance: | yellow semi-solid (est) |
Assay: | 97.00 to 100.00 %
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Food Chemicals Codex Listed: | No |
Specific Gravity: | 1.07000 to 1.07500 @ 25.00 °C.
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Pounds per Gallon - (est).: | 8.903 to 8.945
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Refractive Index: | 1.51000 to 1.52000 @ 20.00 °C.
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Boiling Point: | 70.00 °C. @ 7.00 mm Hg
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Vapor Pressure: | 3.000000 mmHg @ 20.00 °C. |
Flash Point: | 195.00 °F. TCC ( 90.56 °C. )
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logP (o/w): | -0.139 (est) |
Soluble in: |
| alcohol | | water, 1.855e+004 mg/L @ 25 °C (est) |
Insoluble in: |
| water |
Similar Items: note |
1-(3,6-dimethylpyrazin-2-yl)ethanone |
Organoleptic Properties:
Cosmetic Information:
Suppliers:
Beijing Lys Chemicals |
2-Acetyl-3,5(or 6)-dimethylpyrazine
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Carbosynth |
For experimental / research use only. |
2-Acetyl-3,5-dimethylpyrazine
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Endeavour Specialty Chemicals |
2-Acetyl-3,5-dimethylpyrazine 99% F&F
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Speciality Chemical Product Groups |
Jinan Enlighten Chemical Technology(Wutong Aroma ) |
2-Acetyl-3,5(or6)-dimethyl pyrazine, Kosherk
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M&U International |
2-ACETYL-3(5/6)-DIMETHYL PYRAZINE, Kosher
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Penta International |
2-ACETYL-3,5,6-DIMETHYL PYRAZINE
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R C Treatt & Co Ltd |
2-Acetyl-3,5 (6)-Dimethyl-Pyrazine
Halal, Kosher |
Reincke & Fichtner |
2-Acetyl-3,5(and 6)-dimethylpyrazine
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Robinson Brothers |
2-Acetyl-3,5-dimethylpyrazine F&F
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https://www.robinsonbrothers.uk/chemistry-competences |
Sigma-Aldrich |
2-Acetyl-3,5(6)-dimethylpyrazine, mixture of isomers, ≥98%, FG
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Certified Food Grade Products |
Sunaux International |
2-Acetyl-3(5/6)-dimethyl Pyrazine
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Tengzhou Jitian Aroma Chemiclal |
2-Acetyl-3(5/6)-dimethyl pyrazine
|
Tianjin Danjun International |
2-Acetyl-3,5(or 6)-dimethylpyrazine
|
WholeChem |
2-Acetyl-3(5/6)-dimethyl pyrazine
|
Safety Information:
Preferred SDS: View |
European information : |
Most important hazard(s): | Xi - Irritant |
R 36/37/38 - Irritating to eyes, respiratory system, and skin. S 02 - Keep out of the reach of children. S 26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. S 36/37/39 - Wear suitable clothing, gloves and eye/face protection.
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Hazards identification |
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Classification of the substance or mixture |
GHS Classification in accordance with 29 CFR 1910 (OSHA HCS) |
None found. |
GHS Label elements, including precautionary statements |
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Pictogram | |
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Hazard statement(s) |
None found. |
Precautionary statement(s) |
None found. |
Oral/Parenteral Toxicity: |
Not determined
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Dermal Toxicity: |
Not determined
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Inhalation Toxicity: |
Not determined
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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 2-acetyl-3,5-dimethyl pyrazine usage levels up to: | | 0.1000 % in the fragrance concentrate.
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Maximised Survey-derived Daily Intakes (MSDI-EU): | 0.97 (μg/capita/day) |
Maximised Survey-derived Daily Intakes (MSDI-USA): | 1.00 (μg/capita/day) |
Structure Class: | II |
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: 6 |
Click here to view publication 6 |
| average usual ppm | average maximum ppm |
baked goods: | - | 5.00000 |
beverages(nonalcoholic): | - | - |
beverages(alcoholic): | - | - |
breakfast cereal: | - | 5.00000 |
cheese: | - | - |
chewing gum: | - | - |
condiments / relishes: | - | - |
confectionery froastings: | - | - |
egg products: | - | - |
fats / oils: | - | - |
fish products: | - | - |
frozen dairy: | - | 1.00000 |
fruit ices: | - | 1.00000 |
gelatins / puddings: | - | 1.00000 |
granulated sugar: | - | - |
gravies: | - | 5.00000 |
hard candy: | - | 5.00000 |
imitation dairy: | - | - |
instant coffee / tea: | - | - |
jams / jellies: | - | 1.00000 |
meat products: | - | 5.00000 |
milk products: | - | - |
nut products: | - | - |
other grains: | - | - |
poultry: | - | - |
processed fruits: | - | - |
processed vegetables: | - | - |
reconstituted vegetables: | - | - |
seasonings / flavors: | - | - |
snack foods: | - | - |
soft candy: | - | - |
soups: | - | 5.00000 |
sugar substitutes: | - | - |
sweet sauces: | - | - |
Safety References:
Flavor & Extract Manufacturers Association (FEMA) reference(s): |
The FEMA GRAS assessment of pyrazine derivatives used as flavor ingredients. View pdf |
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): |
Opinion of the Scientific Panel on food additives, flavourings, processing aids and materials in contact with food (AFC) on a request from the Commission related to Flavouring Group Evaluation 17 (FGE.17): Pyrazine derivatives from chemical group 24 (Commission Regulation (EC) No 1565/2000 of 18 July 2000) View page or View pdf |
Flavouring Group Evaluation 50 (FGE.50): Consideration of pyrazine derivatives evaluated by JECFA (57th meeting) structurally related to pyrazine derivatives evaluated by EFSA in FGE.17 (2005) (Commission Regulation (EC) No 1565/2000 of 18 July 2000) - Opinion of the Scientific Panel on Food Additives, Flavourings, Processing Aids and Materials in contact with Food (AFC) View page or View pdf |
Flavouring Group Evaluation 17, Revision 1 (FGE.17Rev1): Pyrazine derivatives from chemical group 24 - Opinion of the Scientific Panel on Food Additives, Flavourings, Processing Aids and Materials in contact with Food (AFC) [1] View page or View pdf |
Scientific Opinion on Flavouring Group Evaluation 17, Revision 2 (FGE.17Rev2): Pyrazine derivatives from chemical group 24 View page or View pdf |
Scientific Opinion on Flavouring Group Evaluation 50, Revision 1 (FGE.50Rev1): Consideration of pyrazine derivatives evaluated by JECFA (57th meeting) structurally related to pyrazine derivatives evaluated by EFSA in FGE.17Rev2 (2010) View page or View pdf |
EPI System: | View |
AIDS Citations: | Search |
Cancer Citations: | Search |
Toxicology Citations: | Search |
EPA Substance Registry Services (TSCA): | 54300-08-2 |
EPA ACToR: | Toxicology Data |
EPA Substance Registry Services (SRS): | Registry |
Laboratory Chemical Safety Summary : | 104721 |
National Institute of Allergy and Infectious Diseases: | Data |
WGK Germany: | 3 |
| 1-(3,5-dimethylpyrazin-2-yl)ethanone |
Chemidplus: | 0054300082 |
References:
Other Information:
Potential Blenders and core components note
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For Odor |
No odor group found for these |
2- | acetonyl pyrazine | |
2,6- | diethyl pyrazine | |
2- | ethyl-3-vinyl pyrazine | |
4- | hydroxymethyl-pyridine | |
2-( | methoxymethyl)-6-methyl pyridine | |
7- | methyl benzofuran | |
2- | methyl-3-ethyl quinoxaline | |
2- | methyl-3-pentyl pyrazine | |
2- | methyl-3-vinyl pyrazine | |
2- | methyl-6-propyl pyrazine | |
2- | methyl-6-vinyl pyrazine | |
| sulfuryl octanoate | FL/FR |
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| sulfuryl butyrate | FL/FR |
| sulfuryl decanoate | FL/FR |
| sulfuryl hexanoate | FL/FR |
| sulfuryl isobutyrate | FL/FR |
| sulfuryl propionate | FL/FR |
balsamic |
2- | acetyl furan | FL/FR |
camphoreous |
| butyrophenone | FL/FR |
caramellic |
iso | propenyl pyrazine | FL/FR |
chocolate |
| chocolate pyrazine A | FL/FR |
2,5- | dimethyl pyrazine | FL/FR |
2- | methoxy-3-methyl pyrazine | FL/FR |
2,4,5- | trimethyl thiazole | FL/FR |
cocoa |
2-iso | butyl-3,5-(and 3,6)-dimethyl pyrazine | FL/FR |
coffee |
| coffea arabica seed extract | FL/FR |
earthy |
| nutty pyrazine | FL/FR |
fruity |
| nonyl isovalerate | FL/FR |
green |
2- | heptyl furan | FL/FR |
| hazelnut pyrazine | FL/FR |
nutty |
3- | acetyl pyridine | FL/FR |
2- | acetyl-3-methyl pyrazine | FL/FR |
2- | acetyl-3,5(or 6)-dimethyl pyrazine | FL/FR |
5- | acetyl-4-methyl thiazole | |
roasted | chestnut fragrance | FR |
3,5- | cocoa pyrazine | FL/FR |
3,6- | cocoa pyrazine | FL/FR |
2,4- | dimethyl-5-ethyl thiazole | |
| filbert heptenone | FL/FR |
| filbert heptenone B | FL/FR |
(-)-(E,R)- | filbertone | FL/FR |
(+)-(E,S)- | filbertone | FL/FR |
(E)- | filbertone | FL/FR |
european | hazelnut absolute | FL/FR |
| hazelnut fragrance | FR |
roasted | hazelnut infusions | FL/FR |
european | hazelnut oil CO2 extract | FL/FR |
| methoxymethyl pyrazine | FL/FR |
5- | methyl quinoxaline | FL/FR |
2- | methyl thio-3,5 or 6-methyl pyrazine | FL/FR |
2- | methyl-3-ethoxypyrazine | FL/FR |
2- | methyl-3-pentenoic acid | FL/FR |
| nutty quinoxaline | FL/FR |
2- | propyl-3,6-dimethyl pyrazine | |
| sesame absolute | FL/FR |
2,4,5- | trimethyl oxazole | FL/FR |
popcorn |
2- | acetyl pyrazine | FL/FR |
2- | acetyl thiazole | FL/FR |
2- | acetyl-3,6-dimethyl pyrazine | FL/FR |
roasted |
2- | acetyl-2-pyrroline | |
| trigonella foenum-graecum seed oil CO2 extract | FL/FR |
sulfurous |
2- | acetyl thiophene | FL/FR |
| furfuryl thioacetate | FL/FR |
tobacco |
3- | ethyl pyridine | FL/FR |
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For Flavor |
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No flavor group found for these |
2- | acetyl-2-pyrroline | |
2- | acetyl-3,6-dimethyl pyrazine | FL/FR |
5- | acetyl-4-methyl thiazole | |
2-iso | butyl-3,5-(and 3,6)-dimethyl pyrazine | FL/FR |
| butyrophenone | FL/FR |
| chocolate pyrazine A | FL/FR |
| chocolate pyrazine B | FL |
6,7- | dihydro-2,3-dimethyl-5H-cyclopentapyrazine | FL |
| dimethyl dihydrocyclopentapyrazine | FL |
6,7- | dimethyl dihydrocyclopentapyrazine | FL |
2,5- | dimethyl pyrazine and 2,6-dimethyl pyrazine mixture | FL |
2,5- | dimethyl thiazole | FL |
4,5- | dimethyl-2-ethyl thiazole | FL |
2,4- | dimethyl-5-ethyl thiazole | |
(E)- | filbertone | FL/FR |
2- | methoxy-6-methyl pyrazine | FL |
| methyl 2-(methyl thio) acetate | FL |
2- | methyl-3-ethoxypyrazine | FL/FR |
2- | methyl-3-pentenoic acid | FL/FR |
| nonyl isovalerate | FL/FR |
2- | propyl-3,5-dimethyl pyrazine | FL |
| pyrazine | FL |
| pyrazines mixture | FL |
| sulfuryl butyrate | FL/FR |
| sulfuryl decanoate | FL/FR |
| sulfuryl hexanoate | FL/FR |
| sulfuryl isobutyrate | FL/FR |
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5- | acetyl-2,3-dihydro-1,4-thiazine | FL |
| sulfuryl formate | FL |
| sulfuryl octanoate | FL/FR |
| sulfuryl propionate | FL/FR |
alliaceous |
3- | mercapto-2-pentanone | FL |
astringent |
2- | methyl pyridine | FL |
bitter |
| methyl ethoxypyrazine | FL |
burnt |
2- | methyl quinoxaline | FL |
2- | methyl-6-propyl pyrazine | |
iso | propenyl pyrazine | FL/FR |
2,4,5- | trimethyl oxazole | FL/FR |
caramellic |
3- | ethyl pyridine | FL/FR |
cocoa |
| chocolate enhancers | FL |
coffee |
| coffea arabica seed extract | FL/FR |
corn chip |
2- | acetyl thiazole | FL/FR |
earthy |
2- | ethyl-3-vinyl pyrazine | |
(±)-2- | mercapto-5-methylheptan-4-one | FL |
7- | methyl benzofuran | |
fatty |
2- | heptyl furan | FL/FR |
fishy |
4,5- | dimethyl thiazole | FL |
fruity |
2- | ethyl-2,5-dihydro-4-methyl thiazole | FL |
green |
2,5- | dimethyl-4-ethyl oxazole | FL |
3- | methyl pyridine | FL |
1-(5- | methyl-2-furyl) propan-1-one | FL |
hazelnut |
4- | hydroxymethyl-pyridine | |
musty |
2,5- | dimethyl pyrazine | FL/FR |
2- | ethoxythiazole | FL |
| hazelnut pyrazine | FL/FR |
nutty |
2- | acetonyl pyrazine | |
2- | acetyl furan | FL/FR |
3- | acetyl pyridine | FL/FR |
3- | acetyl-2,5-dimethyl thiophene | FL |
2- | acetyl-3-methyl pyrazine | FL/FR |
2- | acetyl-3,5(or 6)-dimethyl pyrazine | FL/FR |
| almond hazelnut flavor | FL |
| arachis hypogaea fruit extract | FL |
2- | butyl-2-butenal | FL |
roasted | chestnut flavor | FL |
3,5(6)- | cocoa pyrazine | FL |
3,6- | cocoa pyrazine | FL/FR |
3,5- | cocoa pyrazine | FL/FR |
2,5- | diethyl pyrazine | FL |
2,6- | diethyl pyrazine | |
2,5- | diethyl-3-methyl pyrazine | FL |
1- | ethyl-2-acetyl pyrrole | FL |
2- | ethyl-6-methyl pyrazine | FL |
| filbert heptenone | FL/FR |
| filbert heptenone B | FL/FR |
(+)-(E,S)- | filbertone | FL/FR |
(-)-(E,R)- | filbertone | FL/FR |
european | hazelnut absolute | FL/FR |
toasted | hazelnut cream flavor | FL |
european | hazelnut distillates | FL |
| hazelnut flavor | FL |
roasted | hazelnut infusions | FL/FR |
european | hazelnut oil CO2 extract | FL/FR |
european | hazelnut oleoresin | FL |
| hazelnut paste | FL |
2- | methoxy-3-methyl pyrazine | FL/FR |
| methoxymethyl pyrazine | FL/FR |
5- | methyl quinoxaline | FL/FR |
2- | methyl thio-3,5 or 6-methyl pyrazine | FL/FR |
2- | methyl-3-ethyl quinoxaline | |
2- | methyl-3-pentyl pyrazine | |
2- | methyl-3-vinyl pyrazine | |
2- | methyl-6-vinyl pyrazine | |
| nutty pyrazine | FL/FR |
| nutty quinoxaline | FL/FR |
| nutty thiazole | FL |
2- | propyl-3,6-dimethyl pyrazine | |
| sesame absolute | FL/FR |
| sesame distillates | FL |
2,4,5- | trimethyl thiazole | FL/FR |
onion |
2- | acetyl thiophene | FL/FR |
popcorn |
2- | propionyl-2-thiazoline | FL |
roasted |
2- | acetyl pyrazine | FL/FR |
3,5- | diisobutyl-1,2,4-trithiolane | FL |
| ethyl 3-(furfuryl thio) propionate | FL |
| furfuryl thioacetate | FL/FR |
2-( | methoxymethyl)-6-methyl pyridine | |
| trigonella foenum-graecum seed oil CO2 extract | FL/FR |
spicy |
| chocolate cinnamon hazelnut flavor | FL |
| cinnamon hazelnut cappuccino flavor | FL |
| cinnamon hazelnut cream flavor | FL |
vanilla |
| vanilla hazelnut flavor | FL |
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Potential Uses:
Occurrence (nature, food, other): note
Synonyms:
2- | acetyl-3,5-dimethylpyrazine | 2- | acetyl-3,5,6-dimethyl pyrazine | 1-(3,5- | dimethyl pyrazin-2-yl)ethanone | 1-(3,5- | dimethyl pyrazinyl)ethan-1-one | 1-(3,5- | dimethyl pyrazinyl)ethanone | 1-(3,5- | dimethylpyrazin-2-yl)ethanone | 1-(3,5- | dimethylpyrazinyl)ethan-1-one | | ethanone, 1-(3,5-dimethyl-2-pyrazinyl)- | | ethanone, 1-(3,5-dimethylpyrazinyl)- |
Articles:
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