citronellyl phenyl acetate
3,7-dimethyl-6-octenyl phenylacetate
Identification
| Name | citronellyl phenyl acetate |
| IUPAC | 3,7-dimethyloct-6-enyl 2-phenylacetate |
| CAS Number | 139-70-8 |
| EINECS | 205-373-5 |
| FDA UNII | HH43UJ4D76 |
| Molecular Formula | C18 H26 O2 |
| Molecular Weight | 274.40362000 |
| Nikkaji Number | J74.799H |
| CoE Number | 2157 |
Regulatory
| JECFA Food Flavoring | 1021 citronellyl phenylacetate |
| DG SANTE Food Flavourings | 09.785 citronellyl phenylacetate |
| FEMA Number | 2315 |
| FDA | No longer provide for the use of these seven synthetic flavoring substances |
| FDA Mainterm (SATF) | 139-70-8 ; CITRONELLYL PHENYLACETATE |
| 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 | No |
| Specific Gravity | 0.99200 @ 25.00 °C., 0.95800 to 0.96000 @ 25.00 °C. |
| Pounds per Gallon - est. | 7.972 to 7.988 |
| Refractive Index | 1.49100 to 1.50100 @ 20.00 °C. |
| Boiling Point | 342.00 °C. @ 760.00 mm Hg |
| Acid Value | 1.00 max. KOH/g |
| Flash Point | > 212.00 °F. TCC ( > 100.00 °C. ) |
| logP (o/w) | 5.840 (est) |
| Soluble in | alcohol |
| Insoluble in | water |
| Similar Items | note |
Cosmetic Information
| CosIng | cosmetic data |
| Cosmetic Uses | perfuming agents |
Organoleptic Properties
| Odor Strength | medium |
| Substantivity | 192 hour(s) at 100.00 % |
| Odor Description |
at 100.00 %. SWEET, ROSY, FLORAL, HONEY, WAXY fresh aromatic; somewhat honey-like SWEET, ROSY, FLORAL, HONEY, WAXY
|
| Odor sample from | Nickstadt Moeller, Inc. |
| Taste Description | sweet floral rose honey waxy |
Safety Information
| Human Experience | 4 % solution: no irritation or sensitization. |
| 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 citronellyl phenyl acetate usage levels up to | 5.0000 % in the fragrance concentrate. |
| Maximised Survey-derived Daily Intakes (MSDI-EU) | 1.20 (μg/capita/day) |
| Maximised Survey-derived Daily Intakes (MSDI-USA) | 2.00 (μg/capita/day) |
| Structure Class | I |
| baked goods | - |
| beverages(nonalcoholic) | - |
| 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 | - |
| 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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