bornyl butyrate
DL-bornyl butyrate
Identification
| Name | bornyl butyrate |
| IUPAC | (1,7,7-trimethyl-6-bicyclo[2.2.1]heptanyl) butanoate |
| CAS Number | 13109-70-1 |
| EINECS | 236-036-0 |
| FDA UNII | Y7PT44NK8A |
| Molecular Formula | C14 H24 O2 |
| Molecular Weight | 224.34368000 |
| MDL Number | MFCD00135667 |
| Nikkaji Number | J3.087.869H |
| CoE Number | 9319 |
| XlogP3 | 4.10 (est) |
Regulatory
| JECFA Food Flavoring | 1412 bornyl butyrate |
| DG SANTE Food Flavourings | 09.319 DL-bornyl butyrate |
| FEMA Number | 3907 |
| FDA | No longer provide for the use of these seven synthetic flavoring substances |
| FDA Mainterm (SATF) | 13109-70-1 ; BORNYL BUTYRATE |
Physical Properties
| Appearance | colorless clear liquid (est) |
| Assay | 97.00 to 100.00 |
| Food Chemicals Codex Listed | No |
| Specific Gravity | 0.98100 to 0.99100 @ 25.00 °C. |
| Pounds per Gallon - (est). | 8.163 to 8.246 |
| Refractive Index | 1.46200 to 1.46900 @ 20.00 °C. |
| Boiling Point | 120.00 to 121.00 °C. @ 10.00 mm Hg, 247.00 °C. @ 760.00 mm Hg |
| Acid Value | 1.00 max. KOH/g |
| Vapor Pressure | 0.018000 mmHg @ 25.00 °C. (est) |
| Flash Point | 231.00 °F. TCC ( 110.56 °C. ) |
| logP (o/w) | 4.535 (est) |
| Soluble in | alcohol |
| Insoluble in | water |
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 bornyl butyrate usage levels up to | 8.0000 % in the fragrance concentrate. |
| Maximised Survey-derived Daily Intakes (MSDI-EU) | 6.10 (μg/capita/day) |
| Maximised Survey-derived Daily Intakes (MSDI-USA) | 9.00 (μg/capita/day) |
| Threshold of Concern | 1800 (μg/person/day) |
| Structure Class | I |
| baked goods | 2.00000 |
| beverages(nonalcoholic) | 0.50000 |
| beverages(alcoholic) | - |
| breakfast cereal | - |
| cheese | - |
| chewing gum | 0.10000 |
| condiments / relishes | 0.10000 |
| confectionery froastings | - |
| egg products | - |
| fats / oils | - |
| fish products | - |
| frozen dairy | 2.00000 |
| fruit ices | - |
| gelatins / puddings | 2.50000 |
| 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 | 2.00000 |
| soups | - |
| sugar substitutes | - |
| sweet sauces | - |
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Potential Uses
Natural Occurrence
Synonyms
bornyl butanoate
DL-
bornyl butyrate
endo-
bornyl butyrate
butanoic acid rel-(1R,2S,4R)-1,7,7-trimethyl bicyclo(2.2.1)hept-2-yl ester
butanoic acid, 1,7,7-trimethylbicyclo(2.2.1)hept-2-yl ester, endo-
butanoic acid, 1,7,7-trimethylbicyclo[2.2.1]hept-2-yl ester, endo-
butyric acid 2-bornyl ester
butyric acid, 2-bornyl ester
rel-(1R,2S,4R)-1,7,7-
trimethyl bicyclo(2.2.1)butanoic acid hept-2-yl ester
endo-1,7,7-
trimethyl bicyclo(2.2.1)hept-2-yl butanoic acid ester
(1,7,7-
trimethyl norbornan-2-yl) butanoate
(1,7,7-
trimethyl-6-bicyclo[2.2.1]heptanyl) butanoate
1,7,7-
trimethyl-bicyclo(2.2.1)heptan-2-yl butanoate
(1,7,7-
trimethylnorbornan-2-yl) butanoate
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