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| IUPAC name : | N-[(2E)-3,7-dimethylocta-2,6-dien-1-yl]cyclopropanecarboximidic acid |
| InChI : | InChI=1/C14H23NO/c1-11(2)5-4-6-12(3)9-10-15-14(16)13-7-8-13/h5,9,13H,4,6-8,10H2,1-3H3,(H,15,16)/b12-9+ |
| InChIKey : | UKNMSFRSBQONET-FMIVXFBMBR |
| SMILES : | CC(=CCC/C(=C/CNC(=O)C1CC1)/C)C |
| cas number : | 744251-93-2 |
| fema number : | 4267 |
| jecfa number : | 1779 |
| fl. number : | 16.095 |
| molar refractivity : | 68.13 ± 0.3 cm3 |
| parachor : | 560.3 ± 6.0 cm3 |
| index of refraction : | 1.507 ± 0.02 |
| surface tension : | 36.0 ± 3.0 dyne/cm |
| density : | 0.967 ± 0.06 g/cm3 |
| polarizability : | 27.00 ± 0.5 10-24cm3 |
| molecular weight : | 221.3385200 |
| formula : | C14 H23 N O |
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| fda reg : | unspecified |
h. number : | unspecified |
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| organoleptics : | |
| odor strength : | high ,
recommend smelling in a 0.10 % solution or less |
odor description :
at 0.10 % in propylene glycol. | roasted meaty |
| properties : | |
| appearence : | white to pale yellow solid |
| assay : | 98.00 - 100.00 %
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| Food Chemicals Codex Listed : | No |
| melting point : | 53.00 - 57.00 °C. @ 760.00 mm Hg
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| safety : | |
| Oral Toxicity(LD50) : |
Oral-Rat >2000.00 mg/kg (Culling, 2005)
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| Dermal Toxicity(LD50) : |
Not determined
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| flash point ( Deg. F. ) : | not determined
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| recommendation for 3,7-dimethyl-2,6-octadien-1-yl cyclopropyl carboxamide usage levels up to : | | | not for fragrance use.
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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 : 23. |
| 4267 | average usual ppm | average maximum ppm |
| baked goods : | 0.20000 | 1.00000 |
| beverages(nonalcoholic) : | 0.40000 | 2.00000 |
| beverages(alcoholic) : | - | - |
| breakfast cereal : | - | - |
| cheese : | 2.00000 | 8.00000 |
| chewing gum : | - | - |
| condiments / relishes : | 4.00000 | 20.00000 |
| confectionery froastings : | - | - |
| egg products : | 2.00000 | 10.00000 |
| fats / oils : | - | - |
| fish products : | 2.00000 | 10.00000 |
| frozen dairy : | - | - |
| fruit ices : | - | - |
| gelatins / puddings : | - | - |
| granulated sugar : | - | - |
| gravies : | 4.00000 | 10.00000 |
| hard candy : | - | - |
| imitation dairy : | 2.00000 | 10.00000 |
| instant coffee / tea : | - | - |
| jams / jellies : | - | - |
| meat products : | 2.00000 | 10.00000 |
| milk products : | - | - |
| nut products : | 1.00000 | 4.00000 |
| other grains : | - | - |
| poultry : | 2.00000 | 10.00000 |
| processed fruits : | - | - |
| processed vegetables : | 1.00000 | 5.00000 |
| reconstituted vegetables : | 1.00000 | 4.00000 |
| seasonings / flavors : | - | - |
| snack foods : | 5.00000 | 20.00000 |
| soft candy : | - | - |
| soups : | 2.00000 | 10.00000 |
| sugar substitutes : | - | - |
| sweet sauces : | 2.00000 | 10.00000 |
| safety links : | |
| chemidplus : | 744251-93-2 |
| epa-srs : | 744251-93-2 |
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| other : | |
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| references : | |
| jecfa number : | 1779 |
| fl. number : | 16.095 |
| pubchem : | 23759374 |
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| synonyms : |
| 3,7- | dimethyl-2,6-octadien-1-yl cyclopropyl carboxamide | | N-3,7- | dimethyl-2,6-octadien-1-yl cyclopropyl carboxamide | | 3,7- | dimethyl-2,6-octadienyl cyclopropyl carboxamide | | N-3,7- | dimethyl-2,6-octadienyl cyclopropyl carboxamide | | N-3,7- | dimethyl-2,6-octadienyl cyclopropylcarboxamide | | 3,7- | dimethyl-2,6-octadienylcyclopropylcarboxamide |
| soluble in : |
| | alcohol, slightly | | | water, slightly |
| insoluble in : |
| | water |
| stability : |
| (odor and/or flavor) blends with : |
| 2,6- | dimethyl thiophenol |
| 2,5- | dimethyl-3-thiofuroyl furan |
| 1,1- | ethane dithiol 1% in ethanol |
| 2- | mercapto-3-pentanone |
| 2- | methyl-1-methyl thio-2-butene |
| 2- | methyl-3-(methyl thio) pyrazine |
| bis(2- | methyl-3-furyl) disulfide |
| S-(2- | methyl-3-furyl) ethane thioate |
| 3-((2- | methyl-3-furyl)thio)-4-heptanone |
| | nutty thiazole |
| | propyl 2-mercaptopropionate |
| 2- | pyridinyl methane thiol |
| | roasted butanol |
| | thialdine |
| (odor and/or flavor) used in : |
| | meat |
| natural occurrence in : |
| not found in nature |
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