grape butyrate
ethyl 3-hydroxybutyrate
Identification
| Name | grape butyrate |
| IUPAC | ethyl 3-hydroxybutanoate |
| CAS Number | 5405-41-4 |
| EINECS | 226-456-2 |
| FDA UNII | 52008C87PV |
| Molecular Formula | C6 H12 O3 |
| Molecular Weight | 132.15924000 |
| MDL Number | MFCD00004545 |
| Nikkaji Number | J140.266H |
| Beilstein | 1446190 |
| CoE Number | 10596 |
Regulatory
| JECFA Food Flavoring | 594 ethyl 3-hydroxybutyrate |
| DG SANTE Food Flavourings | 09.522 ethyl 3-hydroxybutyrate |
| FEMA Number | 3428 |
| FDA | No longer provide for the use of these seven synthetic flavoring substances |
| FDA Mainterm (SATF) | 5405-41-4 ; ETHYL 3-HYDROXYBUTYRATE |
Physical Properties
| Appearance | colorless clear viscous liquid (est) |
| Assay | 96.00 to 100.00 |
| Food Chemicals Codex Listed | No |
| Specific Gravity | 1.00900 to 1.01900 @ 25.00 °C., 1.01200 to 1.01600 @ 20.00 °C. |
| Pounds per Gallon - (est). | 8.396 to 8.479 |
| Pounds per Gallon - est. | 8.431 to 8.464 |
| Refractive Index | 1.41500 to 1.42500 @ 20.00 °C., 1.42000 to 1.42300 @ 20.00 °C. |
| Boiling Point | 170.00 to 175.00 °C. @ 760.00 mm Hg, 81.00 °C. @ 18.00 mm Hg |
| Vapor Pressure | 0.362000 mmHg @ 25.00 °C. (est) |
| Flash Point | 142.00 °F. TCC ( 61.11 °C. ) |
| logP (o/w) | 0.098 (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 |
Cosmetic Information
| CosIng | cosmetic data |
| Cosmetic Uses | perfuming agents |
Organoleptic Properties
| Odor Strength | medium |
| Substantivity | 4 hour(s) at 100.00 % |
| Odor Description |
at 100.00 %. Fruity, grape-like with green waxy nuances, apple skin like Fresh, Fruity, Grape Mild ethereal, fruity odor with black currant reminiscence Mild etheral fruity odor, with blackcurrant reminiscence
|
| Odor sample from | Alfrebro LLC/ Archer Daniels Midland Company |
| Taste Description |
at 30.00 ppm. green fruity wine Fruity winey taste with reminiscence of pineapple and strawberry
|
Safety Information
| Preferred SDS | View |
| European information | Most important hazard(s): |
| Oral/Parenteral Toxicity | Not determined |
| 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 | flavor and fragrance agents |
| RIFM Fragrance Material Safety Assessment | Search |
| Recommendation for grape butyrate usage levels up to | 2.0000 % in the fragrance concentrate. |
| Maximised Survey-derived Daily Intakes (MSDI-EU) | 7.90 (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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