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| IUPAC name : | 2-hydroxy-3-methyl-6-propan-2-ylcyclohex-2-en-1-one |
| InChI : | InChI=1/C10H16O2/c1-6(2)8-5-4-7(3)9(11)10(8)12/h6,8,11H,4-5H2,1-3H3 |
| InChIKey : | QSIMLPCPCXVYDD-UHFFFAOYAI |
| SMILES : | CC1=C(C(=O)C(CC1)C(C)C)O |
| (EINECS) number : | 207-704-9 |
| cas number : | 490-03-9 |
| fema number : | 4143 |
| fl. number : | 07.168 |
| molar refractivity : | 47.55 ± 0.3 cm3 |
| parachor : | 399.2 ± 6.0 cm3 |
| index of refraction : | 1.501 ± 0.02 |
| surface tension : | 37.5 ± 3.0 dyne/cm |
| density : | 1.042 ± 0.06 g/cm3 |
| polarizability : | 18.85 ± 0.5 10-24cm3 |
| xlogp : | 2.10 |
| molecular weight : | 168.2328400 |
| formula : | C10 H16 O2 |
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| fda reg : | unspecified |
h. number : | unspecified |
| organoleptics : | |
| odor type : | herbal |
| odor strength : | high ,
recommend smelling in a 0.10 % solution or less |
odor description :
at 0.10 % in dipropylene glycol. | minty buchu leaves black currant |
| properties : | |
| appearence : | colorless to pale yellow crystals |
| assay : | 96.00 - 100.00 %
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| Food Chemicals Codex Listed : | No |
| specific gravity : | 0.95240 @ 25.00 °C.
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| refractive index : | 1.46079 @ 20.00 °C.
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| melting point : | 82.00 - 83.00 °C. @ 760.00 mm Hg
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| logp : | 2.18 |
| safety : | |
| Oral Toxicity(LD50) : |
Not determined
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| Dermal Toxicity(LD50) : |
Not determined
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| flash point ( Deg. F. ) : | > 200.00 °F. TCC ( > 93.33 °C. )
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| recommendation for diosphenol usage levels up to : |
| | 0.3000 % in the fragrance concentrate.
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| Use levels for FEMA GRAS flavoring substances on which the FEMA Expert Panel based its judgments that the substances are generally recognized as safe (GRAS). |
| publication number : 22. |
| 4143 | average usual ppm | average maximum ppm |
| baked goods : | 5.00000 | 25.00000 |
| beverages(nonalcoholic) : | - | - |
| beverages(alcoholic) : | - | - |
| breakfast cereal : | 2.00000 | 10.00000 |
| cheese : | 3.00000 | 15.00000 |
| chewing gum : | - | - |
| condiments / relishes : | 2.00000 | 10.00000 |
| confectionery froastings : | 4.00000 | 20.00000 |
| egg products : | - | - |
| fats / oils : | 2.00000 | 10.00000 |
| fish products : | 1.00000 | 5.00000 |
| frozen dairy : | 3.00000 | 15.00000 |
| fruit ices : | 3.00000 | 15.00000 |
| gelatins / puddings : | - | - |
| granulated sugar : | - | - |
| gravies : | - | - |
| hard candy : | - | - |
| imitation dairy : | 3.00000 | 15.00000 |
| instant coffee / tea : | - | - |
| jams / jellies : | - | - |
| meat products : | 1.00000 | 5.00000 |
| milk products : | 3.00000 | 15.00000 |
| nut products : | - | - |
| other grains : | - | - |
| poultry : | - | - |
| processed fruits : | 2.00000 | 10.00000 |
| processed vegetables : | - | - |
| reconstituted vegetables : | - | - |
| seasonings / flavors : | 2.00000 | 10.00000 |
| snack foods : | 5.00000 | 25.00000 |
| soft candy : | - | - |
| soups : | 2.00000 | 10.00000 |
| sugar substitutes : | - | - |
| sweet sauces : | 2.00000 | 10.00000 |
| safety links : | |
| (EINECS) number : | 207-704-9 |
| chemidplus : | 000490039 |
| epa-srs : | 490-03-9 |
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| other : | |
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| references : | |
| pubchem : | 656038 |
| NIST Chemistry WebBook : | 173122945 |
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