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| IUPAC name : | 2-butoxynaphthalene |
| InChI : | InChI=1/C14H16O/c1-2-3-10-15-14-9-8-12-6-4-5-7-13(12)11-14/h4-9,11H,2-3,10H2,1H3 |
| InChIKey : | CDMIQAIIIBPTRK-UHFFFAOYAW |
| SMILES : | CCCCOC1=CC2=CC=CC=C2C=C1 |
| cas number : | 10484-56-7 |
| (EINECS) number : | 233-998-3 |
| fema number : | 4634 |
| molar refractivity : | 64.67 ± 0.3 cm3 |
| parachor : | 487.1 ± 4.0 cm3 |
| index of refraction : | 1.570 ± 0.02 |
| surface tension : | 37.3 ± 3.0 dyne/cm |
| density : | 1.016 ± 0.06 g/cm3 |
| polarizability : | 25.63 ± 0.5 10-24cm3 |
| XlogP : | 4.60 |
| XlogP3 : | 4.70 |
| molecular weight : | 200.2762400 (IUPAC) |
| formula : | C14 H16 O |
| NMR Predictor : | Predict |
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| export tariff code : | unspecified |
| fda reg : | unspecified |
Suppliers :
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| Nanjing : | 2-Butoxynaphthalene
orders in chinese. |
| Need This Molecule?: | You can contact the Chemical Sources Association and ask the Sourceress. |
organoleptics :
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odor description: at 100.00 %. | sweet fruity floral berry |
properties :
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| appearence : | white crystalline powder |
| assay : | 97.00 to 100.00 %
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| Food Chemicals Codex Listed : | No |
| boiling point : | 314.00 to 316.00 °C. @ 760.00 mm Hg
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| flash point : | 254.00 °F. TCC ( 123.33 °C. )
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| logP (o/w) : | 4.96 |
safety :
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| Oral Toxicity(LD50) : | |
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Not determined
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| Dermal Toxicity(LD50) : | |
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Not determined
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| Inhalation Toxicity(LC50) : | |
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Not determined
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safety in use :
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| Category : | flavor and fragrance agents |
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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). |
| The Expert Panel also publishes separate extensive reviews of scientific information on all FEMA GRAS flavoring substances and can be found at FEMA on the "LIBRARY" link. |
| publication number : 24 |
| | average usual ppm | average maximum ppm |
| baked goods : | - | - |
| beverages(nonalcoholic) : | 1.00000 | 10.00000 |
| beverages(alcoholic) : | 0.01000 | 0.50000 |
| breakfast cereal : | - | - |
| cheese : | - | - |
| chewing gum : | - | - |
| condiments / relishes : | - | - |
| confectionery froastings : | - | - |
| egg products : | - | - |
| fats / oils : | - | - |
| fish products : | - | - |
| frozen dairy : | - | - |
| fruit ices : | 2.00000 | 20.00000 |
| gelatins / puddings : | 2.00000 | 20.00000 |
| granulated sugar : | - | - |
| gravies : | - | - |
| hard candy : | 0.20000 | 1.00000 |
| 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 : | - | - |
safety references :
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| EPI System : | view |
| Canada Domestic Sub. List : | Yes |
| EPA Chem. Sub. Inventory : | Yes |
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| | 2-butoxynaphthalene |
| (EINECS) number : | 233-998-3 |
| chemidplus : | 010484567 |
| EPA Substance Registry Services : | 10484-56-7 |
references :
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| | 2-butoxynaphthalene |
| pubchem : | 659582 |
other :
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