methyl 3-acetoxyoctanoate
methyl 3-acetyloxyoctanoate
Identification
| Name | methyl 3-acetoxyoctanoate |
| IUPAC | methyl 3-acetyloxyoctanoate |
| CAS Number | 35234-21-0 |
| EINECS | 252-452-5 |
| FDA UNII | 16KH805BNJ |
| Molecular Formula | C11 H20 O4 |
| Molecular Weight | 216.27720000 |
| Nikkaji Number | J289.943D |
Regulatory
| JECFA Food Flavoring | 1956 methyl 3-acetoxyoctanoate |
| FEMA Number | 4454 |
| FDA | No longer provide for the use of these seven synthetic flavoring substances |
| FDA Mainterm (SATF) | 35234-21-0 ; METHYL 3-ACETOXYOCTANOATE |
Physical Properties
| Appearance | colorless to yellow clear liquid (est) |
| Assay | 96.00 to 100.00 |
| Food Chemicals Codex Listed | No |
| Specific Gravity | 0.93400 to 0.99400 @ 20.00 °C. |
| Pounds per Gallon - (est). | 7.781 to 8.281 |
| Refractive Index | 1.41300 to 1.43300 @ 20.00 °C. |
| Boiling Point | 217.00 to 219.00 °C. @ 760.00 mm Hg |
| Vapor Pressure | 0.111000 mmHg @ 25.00 °C. (est) |
| Flash Point | 198.00 °F. TCC ( 92.22 °C. ) |
| logP (o/w) | 2.585 (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 | flavor and fragrance agents |
| RIFM Fragrance Material Safety Assessment | Search |
| Recommendation for methyl 3-acetoxyoctanoate usage levels up to | 2.0000 % in the fragrance concentrate. |
| baked goods | - |
| beverages(nonalcoholic) | 1.00000 |
| beverages(alcoholic) | 0.50000 |
| breakfast cereal | - |
| cheese | - |
| chewing gum | - |
| condiments / relishes | - |
| confectionery froastings | - |
| egg products | - |
| fats / oils | - |
| fish products | - |
| frozen dairy | - |
| fruit ices | 1.00000 |
| gelatins / puddings | - |
| granulated sugar | - |
| gravies | - |
| hard candy | 5.00000 |
| imitation dairy | - |
| instant coffee / tea | - |
| jams / jellies | 2.00000 |
| 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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Potential Uses
Natural Occurrence
Synonyms
3-(
acetyl oxy) octanoic acid methyl ester
3-(
acetyloxy)octanoic acid methyl ester
methyl 3-(acetoxy) octanoate
methyl 3-(acetoxy)octanoate
methyl 3-acetyloxyoctanoate
octanoic acid, 3-(acetyloxy)-, methyl ester
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