sorbyl isobutyrate
2,4-hexadienyl isobutyrate
Identification
| Name | sorbyl isobutyrate |
| IUPAC | hexa-2,4-dienyl 2-methylpropanoate |
| CAS Number | 16491-24-0 |
| EINECS | 240-551-6 |
| FDA UNII | Search |
| Molecular Formula | C10 H16 O2 |
| Molecular Weight | 168.23592000 |
| Nikkaji Number | J318.214B |
Regulatory
| JECFA Food Flavoring | 1782 2,4-hexadienyl isobutyrate |
| FEMA Number | 4134 |
| FDA | No longer provide for the use of these seven synthetic flavoring substances |
| FDA Mainterm (SATF) | 16491-24-0 ; 2,4-HEXADIENYL ISOBUTYRATE |
Physical Properties
| Appearance | yellow clear liquid (est) |
| Assay | 98.00 to 100.00 |
| Food Chemicals Codex Listed | No |
| Boiling Point | 80.00 °C. @ 15.00 mm Hg |
| Vapor Pressure | 0.104000 mmHg @ 25.00 °C. (est) |
| Flash Point | 180.00 °F. TCC ( 82.22 °C. ) |
| logP (o/w) | 3.058 (est) |
| Soluble in | alcohol |
| Insoluble in | water |
Cosmetic Information
| CosIng | cosmetic data |
| Cosmetic Uses | perfuming agents |
Organoleptic Properties
| Odor Strength | medium |
| Substantivity | > 1 hour(s) at 100.00 % |
| Odor Description |
at 100.00 %. A sweet pineapple odor with cinnamon undertones
|
| Taste Description |
cinnamon green
|
Safety Information
| Preferred SDS | View |
| European information | Most important hazard(s): |
| Oral/Parenteral Toxicity | oral-rat LD50 5000 mg/kg |
| Dermal Toxicity | skin-rabbit LD50 > 5000 mg/kg |
| 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 sorbyl isobutyrate usage levels up to | 5.0000 % in the fragrance concentrate. |
| baked goods | 0.50000 |
| beverages(nonalcoholic) | 2.00000 |
| beverages(alcoholic) | 2.00000 |
| breakfast cereal | 0.50000 |
| cheese | - |
| chewing gum | 1.00000 |
| condiments / relishes | - |
| confectionery froastings | 5.00000 |
| egg products | - |
| fats / oils | - |
| fish products | - |
| frozen dairy | 1.00000 |
| fruit ices | 1.00000 |
| gelatins / puddings | 5.00000 |
| granulated sugar | - |
| gravies | - |
| hard candy | 1.00000 |
| imitation dairy | - |
| instant coffee / tea | - |
| jams / jellies | 5.00000 |
| meat products | - |
| milk products | 5.00000 |
| nut products | - |
| other grains | - |
| poultry | - |
| processed fruits | 5.00000 |
| processed vegetables | - |
| reconstituted vegetables | - |
| seasonings / flavors | 1.00000 |
| snack foods | - |
| soft candy | 1.00000 |
| soups | - |
| sugar substitutes | - |
| sweet sauces | 1.00000 |
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Potential Uses
Natural Occurrence
Synonyms
iso
butyric acid 2,4-hexadien-1-yl ester
iso
butyric acid, 2,4-hexadienyl ester
hexa-2,4-dien-1-yl 2-methylpropanoate
hexa-2,4-dienyl 2-methyl propanoate
hexa-2,4-dienyl 2-methylpropanoate
hexa-2,4-dienyl isobutyrate
hexadien-1-yl isobutyrate
2,4-
hexadien-1-yl isobutyrate
2,4-
hexadienyl 2-methyl propanoate
2,4-
hexadienyl 2-methylpropanoate
2,4-
hexadienyl isobutyrate
2-
methyl propanoic acid 2,4-hexadienyl ester
2-
methylpropanoic acid 2,4-hexadienyl ester
propanoic acid, 2-methyl-, 2,4-hexadien-1-yl ester
sorbyl isobutyrate
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