| Flavor Demo Formulas |
| CAS Number: | 54300-08-2 | 3D/inchi
|
| 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 %
|
| Food Chemicals Codex Listed: | No |
| Specific Gravity: | 1.07000 to 1.07500 @ 25.00 °C.
|
| Pounds per Gallon - (est).: | 8.903 to 8.945
|
| Refractive Index: | 1.51000 to 1.52000 @ 20.00 °C.
|
| Boiling Point: | 70.00 °C. @ 7.00 mm Hg
|
| Vapor Pressure: | 3.000000 mmHg @ 20.00 °C. |
| Flash Point: | 195.00 °F. TCC ( 90.56 °C. )
|
| 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
|
| Carbosynth |
| For experimental / research use only. |
| 2-Acetyl-3,5-dimethylpyrazine
|
| Endeavour Specialty Chemicals |
| 2-Acetyl-3,5-dimethylpyrazine 99% F&F
|
| Speciality Chemical Product Groups |
| Jinan Enlighten Chemical Technology(Wutong Aroma ) |
| 2-Acetyl-3,5(or6)-dimethyl pyrazine, Kosherk
|
| M&U International |
| 2-ACETYL-3(5/6)-DIMETHYL PYRAZINE, Kosher
|
| Penta International |
| 2-ACETYL-3,5,6-DIMETHYL PYRAZINE
|
| R C Treatt & Co Ltd |
| 2-Acetyl-3,5 (6)-Dimethyl-Pyrazine
Halal, Kosher |
| Reincke & Fichtner |
| 2-Acetyl-3,5(and 6)-dimethylpyrazine
|
| Robinson Brothers |
| 2-Acetyl-3,5-dimethylpyrazine F&F
|
| https://www.robinsonbrothers.uk/chemistry-competences |
| Sigma-Aldrich |
| 2-Acetyl-3,5(6)-dimethylpyrazine, mixture of isomers, ≥98%, FG
|
| Certified Food Grade Products |
| Sunaux International |
| 2-Acetyl-3(5/6)-dimethyl Pyrazine
|
| 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.
|
| |
| 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 2-acetyl-3,5-dimethyl pyrazine usage levels up to: | | | 0.1000 % in the fragrance concentrate.
|
| |
| 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
| |
| 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 |
|
| | 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 |
| |
| For Flavor |
| |
| 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 |
|
| 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 |
| |
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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