3-octyl butyrate
octan-3-yl butanoate
Identification
| Name | 3-octyl butyrate |
| IUPAC | octan-3-yl butanoate |
| CAS Number | 20286-45-7 |
| EINECS | 243-687-4 |
| FDA UNII | 484AMY2W8G |
| Molecular Formula | C12 H24 O2 |
| Molecular Weight | 200.32168000 |
| Nikkaji Number | J280.512J |
Regulatory
| JECFA Food Flavoring | 2073 3-octyl butyrate |
| FEMA Number | 4402 |
| FDA | No longer provide for the use of these seven synthetic flavoring substances |
| FDA Mainterm (SATF) | 20286-45-7 ; 3-OCTYL BUTYRATE |
Physical Properties
| Appearance | colorless clear liquid (est) |
| Assay | 98.00 to 100.00 |
| Food Chemicals Codex Listed | No |
| Specific Gravity | 0.85800 to 0.86300 @ 20.00 °C. |
| Pounds per Gallon - (est). | 7.148 to 7.189 |
| Refractive Index | 1.42000 to 1.42500 @ 20.00 °C. |
| Boiling Point | 243.00 to 245.00 °C. @ 760.00 mm Hg |
| Vapor Pressure | 0.061000 mmHg @ 25.00 °C. (est) |
| Flash Point | 201.00 °F. TCC ( 93.89 °C. ) |
| logP (o/w) | 4.705 (est) |
| Soluble in | alcohol |
Organoleptic Properties
| Odor Description | at 100.00 %. |
Safety Information
| 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 | flavoring agents |
| Recommendation for 3-octyl butyrate usage levels up to | not for fragrance use. |
| Structure Class | I |
| baked goods | - |
| beverages(nonalcoholic) | 1.00000 |
| 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 | 10.00000 |
| 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 | - |
Alfrebro LLC/ Archer Daniels Midland Company
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Potential Uses
Natural Occurrence
Synonyms
butanoic acid 1-ethyl hexyl ester
butanoic acid 1-ethylhexyl ester
butanoic acid, 1-ethylhexyl ester
butanoic acid,1-ethylhexyl ester
1-
ethyl hexyl butyrate
1-(
ethyl hexyl) butanoate
1-
ethylhexyl butyrate
1-(
ethylhexyl)butanoate
octan-3-yl butanoate
octan-3-yl butyrate
3-
octyl butanoate
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