citronellyl acetone
3,4,5,6-tetrahydropseudoionone
Identification
| Name | citronellyl acetone |
| IUPAC | 6,10-dimethylundec-9-en-2-one |
| CAS Number | 4433-36-7 |
| EINECS | 224-634-4 |
| FDA UNII | 3DAE8640XJ |
| Molecular Formula | C13 H24 O |
| Molecular Weight | 196.33348000 |
| Nikkaji Number | J40.458F |
| Beilstein | 1765213 |
| CoE Number | 2053 |
Regulatory
| JECFA Food Flavoring | 1121 3,4,5,6-tetrahydropseudoionone |
| DG SANTE Food Flavourings | 07.069 tetrahydro-pseudo-ionone |
| FEMA Number | 3059 |
| FDA | No longer provide for the use of these seven synthetic flavoring substances |
| FDA Mainterm (SATF) | 4433-36-7 ; TETRAHYDRO-PSEUDO-IONONE |
| FDA Regulation | FDA PART 172 -- FOOD ADDITIVES PERMITTED FOR DIRECT ADDITION TO FOOD FOR HUMAN CONSUMPTION |
Physical Properties
| Appearance | colorless to pale yellow clear liquid (est) |
| Assay | 95.00 to 100.00 |
| Food Chemicals Codex Listed | No |
| Specific Gravity | 0.86500 to 0.87500 @ 25.00 °C. |
| Pounds per Gallon - (est). | 7.198 to 7.281 |
| Refractive Index | 1.44900 to 1.45500 @ 20.00 °C. |
| Boiling Point | 234.00 °C. @ 760.00 mm Hg |
| Vapor Pressure | 0.003000 mmHg @ 25.00 °C. (est) |
| Flash Point | 219.00 °F. TCC ( 103.89 °C. ) |
| logP (o/w) | 4.397 (est) |
| Soluble in | alcohol |
Cosmetic Information
| CosIng | cosmetic data |
| Cosmetic Uses | perfuming agents |
Organoleptic Properties
| Odor Description | at 100.00 %. |
Safety Information
| Oral/Parenteral Toxicity | oral-mouse LD50 [sex: M,F] 5200 mg/kg |
| Dermal Toxicity | skin-guinea pig LDLo 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 acetone usage levels up to | 8.0000 % in the fragrance concentrate. |
| Maximised Survey-derived Daily Intakes (MSDI-EU) | 0.012 (μg/capita/day) |
| Maximised Survey-derived Daily Intakes (MSDI-USA) | 0.01 (μg/capita/day) |
| Threshold of Concern | 540 (μg/person/day) |
| Structure Class | II |
| baked goods | - |
| beverages(nonalcoholic) | 0.50000 |
| beverages(alcoholic) | - |
| breakfast cereal | - |
| cheese | - |
| chewing gum | - |
| condiments / relishes | - |
| confectionery froastings | - |
| egg products | - |
| fats / oils | - |
| fish products | - |
| frozen dairy | 0.60000 |
| fruit ices | 0.60000 |
| 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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Potential Uses
Natural Occurrence
Synonyms
citronellyl acetone
citronellylacetone
dihydrogeranyl acetone
dihydrogeranylacetone
dihydropseudoionone
6,10-
dimethyl undec-9-en-2-one
6,10-
dimethyl-9-undecen-2-one
6,10-
dimethylundec-9-en-2-one
6,10-
dimethylundecen-2-one
tetrahydro-pseudo-ionone
3,4,5,6-
tetrahydropsedoionone
tetrahydropseudoionone
3,4,5,6-
tetrahydropseudoionone
undecen-2-one, 6,10-dimethyl-
9-
undecen-2-one, 6,10-dimethyl-
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