3-decanone
ethyl heptyl ketone
Identification
| Name | 3-decanone |
| IUPAC | decan-3-one |
| CAS Number | 928-80-3 |
| EINECS | 213-183-9 |
| FDA UNII | CBT4991PRJ |
| Molecular Formula | C10 H20 O |
| Molecular Weight | 156.26860000 |
| MDL Number | MFCD00009554 |
| Nikkaji Number | J80.015E |
| Beilstein | 1748021 |
| CoE Number | 11056 |
| XlogP3 | 3.60 (est) |
Regulatory
| JECFA Food Flavoring | 1118 3-decanone |
| DG SANTE Food Flavourings | 07.151 decan-3-one |
| FEMA Number | 3966 |
| FDA | No longer provide for the use of these seven synthetic flavoring substances |
| FDA Mainterm (SATF) | 928-80-3 ; 3-DECANONE |
Physical Properties
| Appearance | colorless clear liquid (est) |
| Assay | 97.00 to 100.00 |
| Food Chemicals Codex Listed | No |
| Specific Gravity | 0.82000 to 0.83000 @ 25.00 °C. |
| Pounds per Gallon - (est). | 6.823 to 6.906 |
| Refractive Index | 1.42100 to 1.42700 @ 20.00 °C. |
| Melting Point | 2.00 to 2.50 °C. @ 760.00 mm Hg |
| Boiling Point | 204.00 to 205.00 °C. @ 760.00 mm Hg, 71.00 °C. @ 4.00 mm Hg |
| Acid Value | 2.00 max. KOH/g |
| Vapor Pressure | 0.449000 mmHg @ 25.00 °C. |
| Vapor Density | >1 ( Air = 1 ) |
| Flash Point | 145.00 °F. TCC ( 62.78 °C. ) |
| logP (o/w) | 3.525 (est) |
| Soluble in | alcohol |
| Insoluble in | water |
Organoleptic Properties
| Odor Description |
at 100.00 %. waxy fruity
|
| Taste Description | waxy |
Safety Information
| Preferred SDS | View |
| European information | Most important hazard(s): |
| 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 3-decanone usage levels up to | 1.0000 % in the fragrance concentrate. |
| Maximised Survey-derived Daily Intakes (MSDI-EU) | 3.00 (μg/capita/day) |
| Maximised Survey-derived Daily Intakes (MSDI-USA) | 3.00 (μg/capita/day) |
| Threshold of Concern | 540 (μg/person/day) |
| Structure Class | II |
| baked goods | 8.00000 |
| beverages(nonalcoholic) | 5.00000 |
| beverages(alcoholic) | 5.00000 |
| breakfast cereal | - |
| cheese | - |
| chewing gum | 30.00000 |
| condiments / relishes | - |
| confectionery froastings | - |
| egg products | - |
| fats / oils | - |
| fish products | - |
| frozen dairy | 6.00000 |
| fruit ices | - |
| gelatins / puddings | - |
| granulated sugar | - |
| gravies | - |
| hard candy | 8.00000 |
| imitation dairy | 6.00000 |
| 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
decan-3-one
ethyl heptyl ketone
ethyl N-heptyl ketone
ketone, ethyl heptyl
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