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| IUPAC name : | 5-(5-methyl-2-propan-2-ylcyclohexyl)oxy-5-oxopentanoic acid |
| InChI : | InChI=1/C15H26O4/c1-10(2)12-8-7-11(3)9-13(12)19-15(18)6-4-5-14(16)17/h10-13H,4-9H2,1-3H3,(H,16,17) |
| InChIKey : | CTMTYSVTTGVYAW-UHFFFAOYAR |
| SMILES : | CC1CCC(C(C1)OC(=O)CCCC(=O)O)C(C)C |
| cas number : | 220621-22-7 |
| fema number : | 4006 |
| jecfa number : | 1414 |
| molar refractivity : | 72.87 ± 0.4 cm3 |
| parachor : | 640.8 ± 6.0 cm3 |
| index of refraction : | 1.478 ± 0.03 |
| surface tension : | 38.4 ± 5.0 dyne/cm |
| density : | 1.05 ± 0.1 g/cm3 |
| polarizability : | 28.88 ± 0.5 10-24cm3 |
| xlogp : | 3.70 |
| molecular weight : | 270.3645400 |
| formula : | C15 H26 O4 |
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| export tariff code : | unspecified |
| fda reg : | unspecified |
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organoleptics :
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| odor type : | minty |
| odor strength : | medium |
odor description : at 100.00 %. | minty menthol |
properties :
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| appearence : | colorless clear viscous liquid |
| assay : | 80.00 to 100.00 %
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| Food Chemicals Codex Listed : | No |
| specific gravity : | 0.89400 to 0.90000 @ 20.00 °C.
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| pounds per gallon - calc. : | 7.448 to 7.498
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| refractive index : | 1.46500 to 1.47100 @ 20.00 °C.
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| boiling point : | 301.00 to 306.00 °C. @ 760.00 mm Hg
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| acid value : | 1.00 max. KOH/g
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| logp : | 4.12 |
safety :
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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. ) : | 279.00 °F. TCC ( 137.22 °C. )
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| recommendation for laevo-monomenthyl glutarate usage levels up to : |
| | 5.0000 % 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 : 20. |
| | average usual ppm | average maximum ppm |
| baked goods : | - | - |
| beverages(nonalcoholic) : | 50.00000 | 125.00000 |
| beverages(alcoholic) : | 50.00000 | 150.00000 |
| breakfast cereal : | - | - |
| cheese : | - | - |
| chewing gum : | 1500.00000 | 4000.00000 |
| condiments / relishes : | - | - |
| confectionery froastings : | 200.00000 | 600.00000 |
| egg products : | - | - |
| fats / oils : | - | - |
| fish products : | - | - |
| frozen dairy : | - | - |
| fruit ices : | - | - |
| gelatins / puddings : | - | - |
| granulated sugar : | - | - |
| gravies : | - | - |
| hard candy : | 300.00000 | 700.00000 |
| 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 : | 40.00000 | 80.00000 |
| soft candy : | 250.00000 | 600.00000 |
| soups : | - | - |
| sugar substitutes : | - | - |
| sweet sauces : | - | - |
safety references :
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| EPI System : | view |
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| | 5-(5-methyl-2-propan-2-ylcyclohexyl)oxy-5-oxopentanoic acid
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| chemidplus : | 220621-22-7 |
| EPA Substance Registry Services : | 220621-22-7 |
| NLM Chemical Carcinogenesis Research Information System : | 220621-22-7 |
| NLM Developmental and Reproductive Toxicity : | 220621-22-7 |
| NLM Env. Mutagen Info. Center : | 220621-22-7 |
| NLM GENetic TOXicology : | 220621-22-7 |
references :
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| | 5-(5-methyl-2-propan-2-ylcyclohexyl)oxy-5-oxopentanoic acid
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| jecfa number : | 1414 |
| pubchem : | 39963803 |
other :
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