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| Right Click Picture For More Options. (Safari 1.2 (v125) Compatible). |
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| IUPAC name : | (10Z)-1-oxacycloheptadec-10-en-2-one |
| InChI : | InChI=1/C16H28O2/c17-16-14-12-10-8-6-4-2-1-3-5-7-9-11-13-15-18-16/h1,3H,2,4-15H2/b3-1- |
| InChIKey : | QILMAYXCYBTEDM-IWQZZHSRBZ |
| SMILES : | C1CCC\C=C/CCCCCCOC(=O)CCC1 |
| (EINECS) number : | 249-120-7 |
| cas number : | 28645-51-4 |
| fema number : | 4145 |
| fl. number : | 10.063 |
| molar refractivity : | 75.12 ± 0.3 cm3 |
| parachor : | 654.5 ± 6.0 cm3 |
| index of refraction : | 1.444 ± 0.02 |
| surface tension : | 28.8 ± 3.0 dyne/cm |
| density : | 0.893 ± 0.06 g/cm3 |
| polarizability : | 29.78 ± 0.5 10-24cm3 |
| xlogp : | 6.10 |
| molecular weight : | 252.3923200 |
| formula : | C16 H28 O2 |
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| fda reg : | unspecified |
h. number : | 2932.29.6000 |
| organoleptics : | |
| odor type : | musk |
| odor strength : | medium , recommend smelling in a 10.00 % solution or less |
odor description : at 10.00 % in dipropylene glycol. | sweet musk ambrette fruity |
| substantivity : | 248 Hour(s) |
| properties : | |
| appearence : | colorless to pale yellow clear liquid |
| assay : | 98.00 - 100.00 %
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| Food Chemicals Codex Listed : | No |
| specific gravity : | 0.94800 - 0.95600 @ 25.00 °C.
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| pounds per gallon - calc. : | 7.888 to 7.955
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| specific gravity : | 0.94900 - 0.95700 @ 20.00 °C.
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| pounds per gallon - calc. : | 7.906 to 7.972
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| refractive index : | 1.47700 - 1.48200 @ 20.00 °C.
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| boiling point : | 185.00 - 190.00 °C. @ 16.00 mm Hg
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| boiling point : | 307.00 - 308.00 °C. @ 760.00 mm Hg
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| logp : | 6.51 |
| shelf life : | 24.00 month(s) or longer if stored properly. |
| storage : | store in cool, dry place in tightly sealed containers, protected from heat and light. |
| safety : | |
| most important hazard(s) : |
Xi - Irritant |
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| Oral Toxicity(LD50) : |
Not determined
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| Dermal Toxicity(LD50) : |
Not determined
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| flash point ( Deg. F. ) : | > 212.00 °F. TCC ( > 100.00 °C. )
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| recommendation for ambrettolide usage levels up to : |
| | 4.0000 % 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. |
| 4145 | average usual ppm | average maximum ppm |
| baked goods : | 0.10000 | 1.00000 |
| beverages(nonalcoholic) : | 0.05000 | 0.50000 |
| beverages(alcoholic) : | 0.20000 | 2.00000 |
| breakfast cereal : | 0.10000 | 1.00000 |
| cheese : | - | - |
| chewing gum : | 1.00000 | 5.00000 |
| condiments / relishes : | - | - |
| confectionery froastings : | 0.20000 | 2.00000 |
| egg products : | - | - |
| fats / oils : | - | - |
| fish products : | - | - |
| frozen dairy : | 0.10000 | 1.00000 |
| fruit ices : | 0.10000 | 2.00000 |
| gelatins / puddings : | 0.10000 | 1.00000 |
| granulated sugar : | - | - |
| gravies : | - | - |
| hard candy : | 0.20000 | 2.00000 |
| imitation dairy : | - | - |
| instant coffee / tea : | - | - |
| jams / jellies : | 0.10000 | 1.00000 |
| meat products : | - | - |
| milk products : | 0.10000 | 1.00000 |
| nut products : | - | - |
| other grains : | - | - |
| poultry : | - | - |
| processed fruits : | 0.20000 | 2.00000 |
| processed vegetables : | - | - |
| reconstituted vegetables : | - | - |
| seasonings / flavors : | - | - |
| snack foods : | - | - |
| soft candy : | 0.20000 | 2.00000 |
| soups : | - | - |
| sugar substitutes : | - | - |
| sweet sauces : | 0.10000 | 1.00000 |
| safety links : | |
| msds : | msds |
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| (EINECS) number : | 249-120-7 |
| chemidplus : | 028645514 |
| epa-srs : | 28645-51-4 |
| dtp/nci : | 31697 |
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| other : | |
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C of A
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| references : | |
| fl. number : | 10.063 |
| pubchem : | 671490 |
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