acetoin butyrate
butan-3-one-2-yl butanoate
Identification
| Name | acetoin butyrate |
| IUPAC | 3-oxobutan-2-yl butanoate |
| CAS Number | 84642-61-5 |
| EINECS | 283-438-7 |
| FDA UNII | SEN8DCI58L |
| Molecular Formula | C8 H14 O3 |
| Molecular Weight | 158.19718000 |
| MDL Number | MFCD00053090 |
| Nikkaji Number | J333.551H |
| CoE Number | 10525 |
Regulatory
| JECFA Food Flavoring | 407 butan-3-one-2-yl butanoate |
| DG SANTE Food Flavourings | 09.264 sec-butan-3-onyl butyrate |
| FEMA Number | 3332 |
| FDA | No longer provide for the use of these seven synthetic flavoring substances |
| FDA Mainterm (SATF) | 84642-61-5 ; BUTAN-3-ONE-2-YL BUTANOATE |
Physical Properties
| Appearance | colorless to yellow clear liquid (est) |
| Assay | 98.00 to 100.00 |
| Food Chemicals Codex Listed | Yes |
| Specific Gravity | 0.97400 to 0.98400 @ 25.00 °C. |
| Pounds per Gallon - (est). | 8.105 to 8.188 |
| Refractive Index | 1.41200 to 1.42200 @ 20.00 °C. |
| Boiling Point | 77.00 °C. @ 30.00 mm Hg, 76.00 °C. @ 11.00 mm Hg |
| Vapor Pressure | 0.236000 mmHg @ 25.00 °C. (est) |
| Flash Point | 179.00 °F. TCC ( 81.67 °C. ) |
| logP (o/w) | 1.076 (est) |
| Shelf Life | 12.00 month(s) or longer if stored properly. |
| Storage | store in cool, dry place in tightly sealed containers, protected from heat and light. |
| Soluble in | alcohol |
| Insoluble in | water |
| Similar Items | note |
Organoleptic Properties
| Odor Strength | medium , |
| Substantivity | 12 hour(s) at 100.00 % |
| Odor Description |
at 10.00 % in propylene glycol. Creamy, musty and buttery Fruit, Cheese, Sweet, red Berry
|
| Odor sample from | Alfrebro LLC/ Archer Daniels Midland Company |
| Taste Description | at 50.00 ppm. |
Safety Information
| Preferred SDS | View |
| European information | Most important hazard(s): |
| Oral/Parenteral Toxicity | oral-mouse LD50 > 8000 mg/kg |
| Dermal Toxicity | Not determined |
| Inhalation Toxicity | Not determined |
GHS Classification
['GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)', 'GHS Label elements, including precautionary statements']
Safety in Use
| Category | flavoring agents |
| Recommendation for acetoin butyrate usage levels up to | not for fragrance use. |
| Maximised Survey-derived Daily Intakes (MSDI-EU) | 0.012 (μg/capita/day) |
| baked goods | - |
| 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 | - |
| 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 | - |
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