1-acetyl cyclohexyl acetate
methyl 1-acetoxycyclohexyl ketone
Identification
| Name | 1-acetyl cyclohexyl acetate |
| IUPAC | (1-acetylcyclohexyl) acetate |
| CAS Number | 52789-73-8 |
| EINECS | 258-186-6 |
| FDA UNII | 987IZ840TA |
| Molecular Formula | C10 H16 O3 |
| Molecular Weight | 184.23512000 |
| Nikkaji Number | J295.802C |
Regulatory
| JECFA Food Flavoring | 442 methyl 1-acetoxycyclohexyl ketone |
| FEMA Number | 3701 |
| FDA | No longer provide for the use of these seven synthetic flavoring substances |
| FDA Mainterm (SATF) | 52789-73-8 ; METHYL 1-ACETOXYCYCLOHEXYL KETONE |
Physical Properties
| Appearance | colorless clear liquid (est) |
| Assay | 98.00 to 100.00 |
| Food Chemicals Codex Listed | No |
| Specific Gravity | 1.04000 to 1.05000 @ 25.00 °C. |
| Pounds per Gallon - (est). | 8.654 to 8.737 |
| Refractive Index | 1.46000 to 1.47000 @ 20.00 °C. |
| Boiling Point | 67.00 °C. @ 3.00 mm Hg |
| Vapor Pressure | 0.022000 mmHg @ 25.00 °C. (est) |
| Flash Point | 217.00 °F. TCC ( 102.78 °C. ) |
| logP (o/w) | 1.741 (est) |
| Soluble in | alcohol |
| Insoluble in | water |
| Similar Items | note |
Organoleptic Properties
| Odor Description | at 100.00 %. |
Safety Information
| Oral/Parenteral Toxicity | gavage-rat LD50 [sex: M,F] 2150 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 | flavoring agents |
| Recommendation for 1-acetyl cyclohexyl acetate usage levels up to | not for fragrance use. |
| Maximised Survey-derived Daily Intakes (MSDI-EU) | ND (μg/capita/day) |
| 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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Potential Uses
Natural Occurrence
Synonyms
1-
acetoxy-1-acetyl cyclohexane
1-
acetoxy-1-acetylcyclohexane
1-
acetoxycyclohexyl acetate
1-
acetoxycyclohexyl methyl ketone
(1-
acetyl cyclohexyl) acetate
1-(1-(
acetyl oxy)cyclohexyl) ethanone
1-
acetylcyclohexyl acetate
(1-
acetylcyclohexyl) acetate
1-(1-(
acetyloxy)cyclohexyl)ethanone
ethanone, 1-(1-(acetyloxy)cyclohexyl)-
ethanone, 1-[1-(acetyloxy)cyclohexyl]-
1-
hydroxycyclohexyl methyl ketone acetate
ketone, 1-hydroxycyclohexyl methyl, acetate
methyl 1-acetoxycyclohexyl ketone
US Patents:
Process for enhancing the organoleptic properties of perfumed articles using alkyl esters of 1-alkanolyl cycloalkanols
US Patents:
Alkyl esters of 1-alkanoyl cycloalkanols and organoleptic uses thereof