|
Category: flavor and fragrance agents
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
Physical Properties:
| Appearance: | white to amber crystals (est) |
| Assay: | 98.00 to 100.00 %
|
| Food Chemicals Codex Listed: | No |
| Melting Point: | 68.00 to 72.00 °C. @ 760.00 mm Hg
|
| Boiling Point: | 187.37 °C. @ 760.00 mm Hg (est)
|
| Vapor Pressure: | 0.633000 mmHg @ 25.00 °C. (est) |
| Flash Point: | > 212.00 °F. TCC ( > 100.00 °C. )
|
| logP (o/w): | 0.796 (est) |
| Soluble in: |
| | alcohol | | | water, 1.211e+005 mg/L @ 25 °C (est) |
| Insoluble in: |
| | water |
| Stability: |
| | stable in most media |
Organoleptic Properties:
| |
| Odor Type: caramellic |
| |
| Odor Strength: | high , recommend smelling in a 1.00 % solution or less |
| |
| Substantivity: | 236 hour(s) at 10.00 % in dipropylene glycol |
| |
| | sweet maple caramellic sugar fenugreek licorice |
Odor Description: at 1.00 % in dipropylene glycol. | sweet maple caramel sugar fenugreek licorice Luebke, William tgsc, (1988) |
| |
| |
| Flavor Type: caramellic |
| |
| | sweet maple fenugreek burnt caramellic sugar burnt sugar resinous phenolic |
Taste Description:
| sweet maple fenugreek burnt caramellic burnt sugar resinous phenolic Luebke, William tgsc, (1988) |
| |
| Odor and/or flavor descriptions from others (if found). |
| |
| |
Cosmetic Information:
Suppliers:
| Anhui Haibei |
| 3,4-Dimethyl-2-hydroxy-2-cyclopenten-1-one
|
| Aromiens International |
| Caramel Pentadione
|
| Beijing Lys Chemicals |
| 3,4-Dimethyl-1,2-cyclopentadione
|
| BOC Sciences |
| For experimental / research use only. |
| 3,4-Dimethyl-1,2-Cyclopentanedione
|
| Carbosynth |
| For experimental / research use only. |
| 3,4-Dimethyl-1,2-cyclopentanedione
|
| Ernesto Ventós |
| 3,4-DIMETHYL-1,2-CYCLOPENTADIONE
Odor: MAPLE,WALNUT,SWEET,CARAMEL,LICORICE |
| Indukern F&F |
| METHYL CORYLONE
Odor: SWEET, MAPLE, CARAMEL |
| Lluch Essence |
| 3,4-DIMETHYL 1,2-CICLOPENTADIONE
|
| M&U International |
| 3,4-DIMETHYL-2-HYDROXY-2-CYCLOPENTENYL-1-ONE, Kosher
|
| Moellhausen |
| CARAMEL PENTADIONE
|
| Penta International |
| 3,4-DIMETHYL-1,2-CYCLOPENTADIONE NATURAL 1% IN ETHYL ALCOHOL
|
| Penta International |
| 3,4-DIMETHYL-1,2-CYCLOPENTADIONE NATURAL 1% IN P.G.
|
| Penta International |
| 3,4-DIMETHYL-1,2-CYCLOPENTADIONE NATURAL 1% IN TRIACETIN
|
| Penta International |
| 3,4-DIMETHYL-1,2-CYCLOPENTADIONE NATURAL 5% IN ETHYL ALCOHOL
|
| Penta International |
| 3,4-DIMETHYL-1,2-CYCLOPENTADIONE NATURAL 5% IN TRIACETIN
|
| Penta International |
| 3,4-DIMETHYL-1,2-CYCLOPENTADIONE
|
| R C Treatt & Co Ltd |
| 3,4-Dimethyl-1,2-cyclopentadione
Halal, Kosher |
| Santa Cruz Biotechnology |
| For experimental / research use only. |
| 3,4-Dimethyl-1,2-cyclopentanedione
|
| Sigma-Aldrich |
| 3,4-Dimethyl-1,2-cyclopentadione, ≥97%, FG
Odor: anise; herbaceous |
| Certified Food Grade Products |
| Sunaux International |
| 3,4-Dimethyl-2-hydroxy-2-cyclopentenyl-1-one
|
| Synerzine |
| 3,4-Dimethyl-1,2-cyclopentadione
|
| TCI AMERICA |
| For experimental / research use only. |
| 3,4-Dimethyl-1,2-cyclopentanedione >98.0%(T)
|
| Tianjin Danjun International |
| 3,4-Dimethyl-1,2-cyclopentadione
|
| United International |
| 3,4-Dimethyl-2-Hydroxy-2-Cyclopentenyl-1-One
|
| Vigon International |
| Dimethyl-3,4 1,2-Cyclopentadione (Methyl Corylone)
Odor: Sweet,Brown,Maple |
| WholeChem |
| 3,4-Dimethyl-1,2-cyclopentadione
|
Safety Information:
| Preferred SDS: View |
| European information : |
| Most important hazard(s): | | Xn - Harmful. |
R 22 - Harmful if swallowed. 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 caramel pentadione usage levels up to: | | | 1.0000 % in the fragrance concentrate.
|
| |
| Maximised Survey-derived Daily Intakes (MSDI-EU): | 30.00 (μg/capita/day) |
| Maximised Survey-derived Daily Intakes (MSDI-USA): | 2.00 (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: 5 |
| Click here to view publication 5 |
| | average usual ppm | average maximum ppm |
| baked goods: | - | - |
| beverages(nonalcoholic): | - | - |
| beverages(alcoholic): | - | - |
| breakfast cereal: | - | - |
| cheese: | - | - |
| chewing gum: | - | 1.90000 |
| condiments / relishes: | - | - |
| confectionery froastings: | - | - |
| egg products: | - | - |
| fats / oils: | - | - |
| fish products: | - | 3.50000 |
| frozen dairy: | - | 0.30000 |
| fruit ices: | - | 0.30000 |
| gelatins / puddings: | - | - |
| granulated sugar: | - | - |
| gravies: | - | - |
| hard candy: | - | 4.00000 |
| imitation dairy: | - | - |
| 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 213: alpha,beta-Unsaturated alicyclic ketones and precursors from chemical subgroup 2.7 of FGE.19 View page or View pdf |
Scientific Opinion on Flavouring Group Evaluation 213, Revision 2 (FGE.213Rev2): Consideration of genotoxic potential for a,ß-unsaturated alicyclic ketones and precursors from chemical subgroup 2.7 of FGE.19 View page or View pdf |
Safety and efficacy of secondary aliphatic saturated or unsaturated alcohols, ketones, ketals and esters with a second secondary or tertiary oxygenated functional group belonging to chemical group 10 when used as flavourings for all animal species View page or View pdf |
| EPI System: | View |
| AIDS Citations: | Search |
| Cancer Citations: | Search |
| Toxicology Citations: | Search |
| EPA Substance Registry Services (TSCA): | 13494-06-9 |
| EPA ACToR: | Toxicology Data |
| EPA Substance Registry Services (SRS): | Registry |
| Laboratory Chemical Safety Summary : | 61633 |
| National Institute of Allergy and Infectious Diseases: | Data |
| WGK Germany: | 3 |
| | 3,4-dimethylcyclopentane-1,2-dione |
| Chemidplus: | 0013494069 |
| | (3R,4R)-3,4-dimethylcyclopentane-1,2-dione |
| | (3R,4S)-3,4-dimethylcyclopentane-1,2-dione |
| | (3S,4R)-3,4-dimethylcyclopentane-1,2-dione |
| | (3S,4S)-3,4-dimethylcyclopentane-1,2-dione |
References:
| | 3,4-dimethylcyclopentane-1,2-dione |
| NIST Chemistry WebBook: | Search Inchi |
| Canada Domestic Sub. List: | 13494-06-9 |
| Pubchem (cid): | 61633 |
| Pubchem (sid): | 135017184 |
| | (3R,4R)-3,4-dimethylcyclopentane-1,2-dione |
| NIST Chemistry WebBook: | Search Inchi |
| Canada Domestic Sub. List: | 13494-06-9 |
| Pubchem (cid): | 6997363 |
| Pubchem (sid): | 43599222 |
| | (3R,4S)-3,4-dimethylcyclopentane-1,2-dione |
| NIST Chemistry WebBook: | Search Inchi |
| Canada Domestic Sub. List: | 13494-06-9 |
| Pubchem (cid): | 6997362 |
| Pubchem (sid): | 43599221 |
| | (3S,4R)-3,4-dimethylcyclopentane-1,2-dione |
| NIST Chemistry WebBook: | Search Inchi |
| Canada Domestic Sub. List: | 13494-06-9 |
| Pubchem (cid): | 6997365 |
| Pubchem (sid): | 43599224 |
| | (3S,4S)-3,4-dimethylcyclopentane-1,2-dione |
| NIST Chemistry WebBook: | Search Inchi |
| Canada Domestic Sub. List: | 13494-06-9 |
| Pubchem (cid): | 6997364 |
| Pubchem (sid): | 43599223 |
Other Information:
Potential Blenders and core components note
| |
| For Odor |
| acidic |
| acidic |
| | cyclohexyl acetic acid | FL/FR |
| amber |
| | ambroxan | FL/FR |
| balsamic |
| 2- | acetyl furan | FL/FR |
| | benzyl salicylate | FL/FR |
| | fir balsam absolute | FR |
| | myrrh oil | FL/FR |
| 3- | phenyl propyl alcohol | FL/FR |
| berry |
| | raspberry ketone | FL/FR |
| bready |
| | coffee furanone | FL/FR |
| buttery |
| | acetoin | FL/FR |
| | acetyl propionyl | FL/FR |
| 3,4- | hexane dione | FL/FR |
| 2-oxo | butyric acid | FL/FR |
| | caramel furanone solution | FL/FR |
| | cyclotene | FL/FR |
| | cyclotene hydrate | FL/FR |
| alpha,alpha- | dimethyl anisyl acetone | FL/FR |
| | ethyl 2-hydroxy-2-methyl butyrate | FL/FR |
| | ethyl cyclopentenolone | FL/FR |
| | ethyl furaneol | FL/FR |
| | ethyl maltol | FL/FR |
| 5- | ethyl-2,3,4,5-tetramethyl-2-cyclohexen-1-one | FL/FR |
| | fenugreek absolute | FL/FR |
| | fenugreek oleoresin | FL/FR |
| | geranyl crotonate | FR |
| cis-2- | hydroxy-3,4,5-trimethyl-2-cyclopenten-1-one | |
| | immortelle absolute | FL/FR |
| | levulinic acid | FL/FR |
| | maltol | FL/FR |
| | maltyl isobutyrate | FL/FR |
| | maltyl propionate | FL/FR |
| | maple furanone | FL/FR |
| | menthone lactone | FL/FR |
| | mesitene lactone | FR |
| 2- | methoxy-3,5-dimethyl-2-cyclopenten-1-one | |
| 5- | methyl furfural | FL/FR |
| | rosefuran | FL/FR |
| | shoyu furanone | FL/FR |
| | strawberry furanone | FL/FR |
| | toffee furanone | FL/FR |
| chocolate |
| 2,4,5- | trimethyl thiazole | FL/FR |
| citrus |
| blood | orange oil italy | FL/FR |
| coconut |
| gamma- | heptalactone | FL/FR |
| gamma- | octalactone | FL/FR |
| coumarinic |
| | tonka bean resinoid | FR |
| creamy |
| gamma- | butyrolactone | FL/FR |
| ethereal |
| | ethyl 4-pentenoate | FL/FR |
| | ethyl pyruvate | FL/FR |
| iso | valeraldehyde propylene glycol acetal | FL/FR |
| fermented |
| | ethyl (E)-2-crotonate | FL/FR |
| floral |
| | ethyl phenyl acetate | FL/FR |
| | floral pyranol | FR |
| | heliotropin | FL/FR |
| | heliotropyl acetone | FL/FR |
| alpha- | hexyl cinnamaldehyde | FL/FR |
| | methyl dihydrojasmonate | FL/FR |
| | mimosa absolute france | FL/FR |
| | nerolidol | FL/FR |
| | ocean propanal | FL/FR |
| fruity |
| beta- | damascone | FL/FR |
| | date fragrance | FR |
| gamma- | decalactone | FL/FR |
| (E)- | ethyl tiglate | FL/FR |
| | osmanthus flower absolute | FL/FR |
| | tetrahydrofurfuryl acetate | FL/FR |
| gamma- | undecalactone (aldehyde C-14 (so-called)) | FL/FR |
| green |
| iso | amyl 3-(2-furan) propionate | FL/FR |
| | methyl octine carbonate | FL/FR |
| (E,Z)-2,6- | nonadien-1-ol | FL/FR |
| | violet leaf absolute | FL/FR |
| hay |
| | beeswax absolute | FL/FR |
| herbal |
| | butyl levulinate | FL/FR |
| 3- | propylidene phthalide | FL/FR |
| honey |
| | methyl phenyl acetate | FL/FR |
| melon |
| | melon heptenal | FL/FR |
| (Z)-6- | nonenal | FL/FR |
| moldy |
| | strawberry furanone methyl ether | FL/FR |
| mossy |
| | veramoss (IFF) | FR |
| musty |
| 3- | acetyl-2,5-dimethyl furan | FL/FR |
| nutty |
| 2- | acetyl-3,5(or 6)-dimethyl pyrazine | FL/FR |
| 1,2- | cyclohexane dione | FL/FR |
| 2,3- | dimethyl pyrazine | FL/FR |
| | nutty cyclohexenone | FL/FR |
| phenolic |
| 4- | methyl-2,6-dimethoxyphenol | FL/FR |
| popcorn |
| 2- | acetyl pyrazine | FL/FR |
| 2- | acetyl pyridine | FL/FR |
| powdery |
| para- | anisyl acetate | FL/FR |
| | fenugreek resinoid | FL/FR |
| spicy |
| | cassia bark oil china | FL/FR |
| black | currant bud absolute | FL/FR |
| iso | eugenyl acetate | FL/FR |
| (E)- | tiglic acid | FL/FR |
| sugar |
| | cotton candy fragrance | FR |
| sweet |
| 2- | hydroxy-3,4,5-trimethyl-2-cyclopenten-1-one | FL/FR |
| | vanilla oleoresin bali | FL/FR |
| tonka |
| | tonka bean absolute | FR |
| vanilla |
| | ethyl vanillin | FL/FR |
| | vanillin | FL/FR |
| | vanillyl isobutyrate | FL/FR |
| vegetable |
| | tetrahydrofurfuryl alcohol | FL/FR |
| woody |
| | santall | FR |
| |
| For Flavor |
| |
| No flavor group found for these |
| 2- | acetyl-3,4,5,6-tetrahydropyridine | FL |
| | allyl 2-furoate | FL |
| | benzyl disulfide | FL |
| 1,2- | cyclohexane dione | FL/FR |
| 2,5- | diethyl tetrahydrofuran | FL |
| alpha,alpha- | dimethyl anisyl acetone | FL/FR |
| | ethyl 2-hydroxy-2-methyl butyrate | FL/FR |
| | ethyl 4-pentenoate | FL/FR |
| 5- | ethyl-2,3,4,5-tetramethyl-2-cyclohexen-1-one | FL/FR |
| | furfuryl acetone | FL |
| 2- | hydroxy-3,4,5-trimethyl-2-cyclopenten-1-one | FL/FR |
| cis-2- | hydroxy-3,4,5-trimethyl-2-cyclopenten-1-one | |
| | menthone lactone | FL/FR |
| 2- | methoxy-3,5-dimethyl-2-cyclopenten-1-one | |
| | rosefuran | FL/FR |
|
| iso | amyl 3-(2-furan) propionate | FL/FR |
| beta- | damascone | FL/FR |
| acidic |
| | levulinic acid | FL/FR |
| apple |
| (E,Z)-2,6- | nonadien-1-ol | FL/FR |
| balsamic |
| | benzyl salicylate | FL/FR |
| | myrrh oil | FL/FR |
| berry |
| | heliotropyl acetone | FL/FR |
| | raspberry ketone | FL/FR |
| bready |
| | mango furanone | FL |
| brown |
| | beeswax absolute | FL/FR |
| 2-oxo | butyric acid | FL/FR |
| | fenugreek oleoresin | FL/FR |
| 5- | methyl furfural | FL/FR |
| | tetrahydrofurfuryl acetate | FL/FR |
| (E)- | tiglic acid | FL/FR |
| burnt |
| | furfuryl alcohol | FL |
| buttery |
| | butter maple flavor | FL |
| | diacetyl | FL |
| 3,4- | hexane dione | FL/FR |
| caramellic |
| | caramel dione | FL |
| | caramel furanone | FL |
| | caramel furanone solution | FL/FR |
| | cyclotene | FL/FR |
| | cyclotene hydrate | FL/FR |
| | ethyl furaneol | FL/FR |
| | ethyl maltol | FL/FR |
| 5- | ethyl-3,4,5,6-tetramethyl cyclohexen-2-one | FL |
| | fenugreek absolute | FL/FR |
| | fenugreek resinoid | FL/FR |
| | honey maple flavor | FL |
| | lucuma flavor | FL |
| | maltol | FL/FR |
| | maltyl propionate | FL/FR |
| | maple furanone | FL/FR |
| 3- | methyl butyl 2-furyl butyrate | FL |
| | shoyu furanone | FL/FR |
| | strawberry furanone | FL/FR |
| | toffee furanone | FL/FR |
| cherry |
| | heliotropin | FL/FR |
| citrus |
| blood | orange oil italy | FL/FR |
| coffee |
| roasted | coffee bean concentrate | FL |
| | coffee flavor | FL |
| 2- | thiophene thiol | FL |
| corn |
| 2- | acetyl pyridine | FL/FR |
| 2- | acetyl-2-thiazoline | FL |
| creamy |
| | acetoin | FL/FR |
| gamma- | undecalactone (aldehyde C-14 (so-called)) | FL/FR |
| fatty |
| (E,E)-2,4- | undecadienal | FL |
| 2,4- | undecadienal | FL |
| floral |
| | methyl dihydrojasmonate | FL/FR |
| | methyl phenyl acetate | FL/FR |
| | ocean propanal | FL/FR |
| fruity |
| para- | anisyl acetate | FL/FR |
| | date flavor | FL |
| gamma- | decalactone | FL/FR |
| (E)- | ethyl tiglate | FL/FR |
| | furfuryl valerate | FL |
| | osmanthus flower absolute | FL/FR |
| 2- | pentanoyl furan | FL |
| iso | valeraldehyde propylene glycol acetal | FL/FR |
| green |
| | immortelle absolute | FL/FR |
| | melon heptenal | FL/FR |
| | methyl octine carbonate | FL/FR |
| | nerolidol | FL/FR |
| (Z)-6- | nonenal | FL/FR |
| 3- | propylidene phthalide | FL/FR |
| | violet leaf absolute | FL/FR |
| herbal |
| | butyl levulinate | FL/FR |
| 5- | hydroxymethyl furfural | FL |
| honey |
| | ethyl phenyl acetate | FL/FR |
| jammy |
| | ethyl cyclopentenolone | FL/FR |
| | maltyl isobutyrate | FL/FR |
| lactonic |
| gamma- | heptalactone | FL/FR |
| gamma- | octalactone | FL/FR |
| meaty |
| 2- | mercaptomethyl pyrazine | FL |
| milky |
| gamma- | butyrolactone | FL/FR |
| moldy |
| | strawberry furanone methyl ether | FL/FR |
| musty |
| | ethyl (E)-2-crotonate | FL/FR |
| nutty |
| 2- | acetyl furan | FL/FR |
| 3- | acetyl-2,5-dimethyl furan | FL/FR |
| 2- | acetyl-3,5(or 6)-dimethyl pyrazine | FL/FR |
| | coffee furanone | FL/FR |
| 2,3- | dimethyl pyrazine | FL/FR |
| | nutty cyclohexenone | FL/FR |
| | peanut oxazole | FL |
| | tetrahydrofurfuryl alcohol | FL/FR |
| 2,4,5- | trimethyl thiazole | FL/FR |
| phenolic |
| 4- | methyl-2,6-dimethoxyphenol | FL/FR |
| praline |
| | praline flavor | FL |
| roasted |
| 2- | acetyl pyrazine | FL/FR |
| rummy |
| | ethyl pyruvate | FL/FR |
| spicy |
| | cassia bark oil china | FL/FR |
| black | currant bud absolute | FL/FR |
| iso | eugenyl acetate | FL/FR |
| 3- | phenyl propyl alcohol | FL/FR |
| sugar |
| | cotton candy flavor | FL |
| sweet |
| | cyclohexyl acetic acid | FL/FR |
| dextro- | sorbitol | FL |
| | vanilla oleoresin bali | FL/FR |
| toasted |
| | acetyl propionyl | FL/FR |
| vanilla |
| | ethyl vanillin | FL/FR |
| | vanillin | FL/FR |
| | vanillyl isobutyrate | FL/FR |
| waxy |
| | furfuryl octanoate | FL |
| alpha- | hexyl cinnamaldehyde | FL/FR |
| | mimosa absolute france | FL/FR |
| woody |
| | ambroxan | FL/FR |
| |
Potential Uses:
Occurrence (nature, food, other): note
Synonyms:
| | caramel pentadione | | 1,2- | cyclopentanedione, 3,4-dimethyl- | | 3,4- | dimethyl cyclopentane-1,2-dione | | 3,4- | dimethyl-1,2-cyclo-pentanedione | | 3,4- | dimethyl-1,2-cyclopentadione | | 3,4- | dimethyl-1,2-cyclopentadione natural 1% in ethyl alcohol | | 3,4- | dimethyl-1,2-cyclopentadione natural 5% in ethyl alcohol | | 3,4- | dimethyl-1,2-cyclopentane dione | | 3,4- | dimethyl-1,2-cyclopentanedione | | 3,4- | dimethyl-2-hydroxy-2-cyclopentenyl-1-one | | | dimethyl-3 4 1 2-cyclopentadione | | 3,4- | dimethylcyclopentan-1,2-dione | | 3,4- | dimethylcyclopentane-1,2-dione | | | methyl corylone (Givaudan) |
Articles:
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