WS-3
N-ethyl 2-isopropyl-5-methylcyclohexanecarboxamide
Identification
| Name | WS-3 |
| IUPAC | N-ethyl-5-methyl-2-propan-2-ylcyclohexane-1-carboxamide |
| CAS Number | 39711-79-0 |
| EINECS | 254-599-0 |
| FDA UNII | 6S7S02945H |
| Molecular Formula | C13 H25 N O |
| Molecular Weight | 211.34845000 |
| MDL Number | MFCD00130071 |
| Nikkaji Number | J261.435I |
| CoE Number | 2298 |
Regulatory
| JECFA Food Flavoring | 1601 N-ethyl 2-isopropyl-5-methylcyclohexanecarboxamide |
| DG SANTE Food Flavourings | 16.013 N-ethyl-2-isopropyl-5-methylcyclohexane carboxamide |
| FEMA Number | 3455 |
| FDA | No longer provide for the use of these seven synthetic flavoring substances |
| FDA Mainterm (SATF) | 39711-79-0 ; N-ETHYL-2-ISOPROPYL-5-METHYLCYCLOHEXANE CARBOXAMIDE |
Physical Properties
| Appearance | white to pale yellow crystalline solid (est) |
| Assay | 98.00 to 100.00 |
| Food Chemicals Codex Listed | No |
| Melting Point | 91.00 to 93.00 °C. @ 760.00 mm Hg |
| Boiling Point | 340.55 °C. @ 760.00 mm Hg (est) |
| Vapor Pressure | 0.000085 mmHg @ 25.00 °C. (est) |
| Flash Point | > 212.00 °F. TCC ( > 100.00 °C. ) |
| logP (o/w) | 3.717 (est) |
| Soluble in | alcohol |
| Insoluble in | water |
Cosmetic Information
| CosIng | cosmetic data |
| Cosmetic Uses | tonic |
Organoleptic Properties
| Odor Strength | low |
| Odor Description |
at 25.00 % in dipropylene glycol. at 10.00 %. MILD MINTY, NEARLY ODORLESS
|
| Odor sample from | Kingchem Laboratories Inc. |
| Taste Description |
mentholic cooling minty eucalyptus camphoreous at 10.00 - 100.00 ppm. INTENSE LINGERING COOLING EFFECT
|
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 | flavoring agents |
| Recommendation for WS-3 usage levels up to | not for fragrance use. |
| Maximised Survey-derived Daily Intakes (MSDI-EU) | 0.40 (μg/capita/day) |
| Maximised Survey-derived Daily Intakes (MSDI-USA) | 127.00 (μg/capita/day) |
| Threshold of Concern | 90 (μg/person/day) |
| Structure Class | III |
| baked goods | - |
| beverages(nonalcoholic) | 10.00000 |
| beverages(alcoholic) | 10.00000 |
| breakfast cereal | - |
| cheese | - |
| chewing gum | 1400.00000 |
| condiments / relishes | - |
| confectionery froastings | 10.00000 |
| egg products | - |
| fats / oils | - |
| fish products | - |
| frozen dairy | 10.00000 |
| fruit ices | 10.00000 |
| gelatins / puddings | - |
| granulated sugar | - |
| gravies | - |
| hard candy | 100.00000 |
| imitation dairy | - |
| instant coffee / tea | - |
| jams / jellies | 10.00000 |
| meat products | - |
| milk products | - |
| nut products | - |
| other grains | - |
| poultry | - |
| processed fruits | - |
| processed vegetables | - |
| reconstituted vegetables | - |
| seasonings / flavors | - |
| snack foods | 66.00000 |
| soft candy | - |
| soups | - |
| sugar substitutes | - |
| sweet sauces | - |
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