citronellyl acetate
3,7-dimethyl-6-octen-1-yl acetate
Identification
| Name | citronellyl acetate |
| IUPAC | 3,7-dimethyloct-6-enyl acetate |
| CAS Number | 150-84-5 |
| EINECS | 205-775-0 |
| FDA UNII | IZ420RT3OY |
| Molecular Formula | C12 H22 O2 |
| Molecular Weight | 198.30574000 |
| MDL Number | MFCD00015039 |
| Nikkaji Number | J2.964E |
| Beilstein | 1723886 |
| CoE Number | 202 |
Regulatory
| JECFA Food Flavoring | 57 citronellyl acetate |
| DG SANTE Food Flavourings | 09.012 citronellyl acetate |
| FEMA Number | 2311 |
| FDA | No longer provide for the use of these seven synthetic flavoring substances |
| FDA Mainterm (SATF) | 150-84-5 ; CITRONELLYL ACETATE |
| FDA Regulation | FDA PART 172 -- FOOD ADDITIVES PERMITTED FOR DIRECT ADDITION TO FOOD FOR HUMAN CONSUMPTION |
Physical Properties
| Appearance | colorless clear liquid (est) |
| Assay | 98.00 to 100.00 |
| Food Chemicals Codex Listed | Yes |
| Specific Gravity | 0.88300 to 0.89300 @ 25.00 °C., 0.88400 to 0.89200 @ 20.00 °C. |
| Pounds per Gallon - (est). | 7.347 to 7.431 |
| Pounds per Gallon - est. | 7.364 to 7.431 |
| Refractive Index | 1.43100 to 1.49600 @ 20.00 °C. |
| Boiling Point | 229.00 °C. @ 760.00 mm Hg, 119.00 to 121.00 °C. @ 15.00 mm Hg |
| Acid Value | 1.00 max. KOH/g |
| Saponification Value | 92.00 to 108.00 |
| Vapor Pressure | 0.050000 mmHg @ 20.00 °C. |
| Vapor Density | 6.8 ( Air = 1 ) |
| Flash Point | 218.00 °F. TCC ( 103.33 °C. ) |
| logP (o/w) | 4.220 |
| Shelf Life | 24.00 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 | propylene glycol |
| Stability | antiperspirant |
Cosmetic Information
| CosIng | cosmetic data |
| Cosmetic Uses | fragrance |
Organoleptic Properties
| Odor Strength | medium |
| Substantivity | 8 hour(s) at 100.00 % |
| Odor Description |
at 100.00 %. at 1.00 %. fresh, rose, fruity Rose-like character with green, leafy, pear undertones. Reminds also of certain fruits (plums, lychees) Slight rosy note with some fresh citrus, fruity facets Fruity, Floral, Honey, Pear fresh fruity rose lime bergamot lavender suggestion fresh floral fruity clean rose bergamot green leafy Floral, Green, Rose, Fruity, Citrus, Woody, Tropical, Fruit Floral, Green, Rose, Fruity, Citrus, Woody, Tropical, Fruit
|
| Odor sample from | Givaudan Corporation |
| Taste Description |
at 1.00 - 5.00 ppm. floral
|
Safety Information
| Preferred SDS | View |
| European information | Most important hazard(s): |
| Human Experience | 4 % solution: no irritation or sensitization. |
| Oral/Parenteral Toxicity | gavage-rat LD50 [sex: M/F] 6800 mg/kg |
| 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 citronellyl acetate usage levels up to | 50.0000 % in the fragrance concentrate. |
| Maximised Survey-derived Daily Intakes (MSDI-EU) | 190.00 (μg/capita/day) |
| baked goods | - |
| beverages(nonalcoholic) | - |
| beverages(alcoholic) | - |
| breakfast cereal | - |
| cheese | - |
| chewing gum | 6.90000 |
| condiments / relishes | - |
| confectionery froastings | - |
| egg products | - |
| fats / oils | - |
| fish products | - |
| frozen dairy | - |
| fruit ices | - |
| gelatins / puddings | 0.71000 |
| 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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