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| Right Click Jmol Molecule For More Options. (Safari 1.2 (v125) Compatible). Jmol is a free download found Here. |
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| IUPAC name : | 2-(trimethylazaniumyl)acetate |
| InChI : | InChI=1/C5H11NO2/c1-6(2,3)4-5(7)8/h4H2,1-3H3 |
| InChIKey : | KWIUHFFTVRNATP-UHFFFAOYAI |
| SMILES : | C[N+](C)(C)CC(=O)[O-] |
| cas number : | 107-43-7 |
| (EINECS) number : | 203-490-6 |
| beilstein number : | 3537113 |
| fema number : | 4223 |
| XlogP3-AA : | 0.50 |
| molecular weight : | 117.1463400 (IUPAC) |
| formula : | C5 H11 N O2 |
| BioActivity Analysis : | 562302 |
| NMR Predictor : | Predict |
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| export tariff code : | 2923.90.0000 |
| fda reg : | unspecified |
Suppliers :
|
| Nanjing : | Betaine
orders in chinese only. |
| Penta : | betaine
anhydrous |
| Sigma-Aldrich-Sigma : | Betaine
≥98% (perchloric acid titration) If you get a cover box over Sigma-aldrich web page, click here to set your country of origin. |
| TCI AMERICA : | Betaine Anhydrous
>97.0%(T) |
organoleptics :
|
odor description:
| bland |
properties :
|
| appearence : | white crystalline powder |
| assay : | 98.00 to 100.00 %
|
| Food Chemicals Codex Listed : | No |
| melting point : | 293.00 to 301.00 °C. @ 760.00 mm Hg
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| flash point : | not determined
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| logP (o/w) : | -4.93 |
| shelf life : | 12.00 month(s) or longer if stored properly. |
| storage : | refrigerate in tightly sealed containers. |
safety :
|
| Oral Toxicity(LD50) : | |
| |
intravenous-Mouse 830.00 mg/kg Medicina et Pharmacologia Experimentalis. Vol. 16, Pg. 529, 1967.
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| Dermal Toxicity(LD50) : | |
| |
Subcutaneous-Mouse 10800.00 mg/kg Acta Biologica et Medica Germanica. Vol. 3, Pg. 28, 1959.
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| Inhalation Toxicity(LC50) : | |
| |
Not determined
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safety in use :
|
| Category : | special dietary and nutritional additives |
| |
| recommendation for betaine fragrance usage levels up to : |
| | not for fragrance use.
|
| |
| 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 : 22 |
| | average usual ppm | average maximum ppm |
| baked goods : | 1000.00000 | 5000.00000 |
| beverages(nonalcoholic) : | 1000.00000 | 5000.00000 |
| beverages(alcoholic) : | 1000.00000 | 5000.00000 |
| breakfast cereal : | 1000.00000 | 5000.00000 |
| cheese : | 1000.00000 | 5000.00000 |
| chewing gum : | 1000.00000 | 5000.00000 |
| condiments / relishes : | 1000.00000 | 5000.00000 |
| confectionery froastings : | 1000.00000 | 5000.00000 |
| egg products : | 1000.00000 | 5000.00000 |
| fats / oils : | 1000.00000 | 5000.00000 |
| fish products : | 1000.00000 | 5000.00000 |
| frozen dairy : | 1000.00000 | 5000.00000 |
| fruit ices : | 1000.00000 | 5000.00000 |
| gelatins / puddings : | 1000.00000 | 5000.00000 |
| granulated sugar : | 1000.00000 | 5000.00000 |
| gravies : | 1000.00000 | 5000.00000 |
| hard candy : | 1000.00000 | 5000.00000 |
| imitation dairy : | 1000.00000 | 5000.00000 |
| instant coffee / tea : | 1000.00000 | 5000.00000 |
| jams / jellies : | 1000.00000 | 5000.00000 |
| meat products : | 1000.00000 | 5000.00000 |
| milk products : | 1000.00000 | 5000.00000 |
| nut products : | 1000.00000 | 5000.00000 |
| other grains : | 1000.00000 | 5000.00000 |
| poultry : | 1000.00000 | 5000.00000 |
| processed fruits : | 1000.00000 | 5000.00000 |
| processed vegetables : | 1000.00000 | 5000.00000 |
| reconstituted vegetables : | 1000.00000 | 5000.00000 |
| seasonings / flavors : | 1000.00000 | 5000.00000 |
| snack foods : | 1000.00000 | 5000.00000 |
| soft candy : | 1000.00000 | 5000.00000 |
| soups : | 1000.00000 | 5000.00000 |
| sugar substitutes : | 1000.00000 | 5000.00000 |
| sweet sauces : | 1000.00000 | 5000.00000 |
safety references :
|
| EPI System : | view |
| IUCLID : | view |
| ClinicalTrials.gov : | search |
| Daily Med : | search |
| NLM Hazardous Substances Data Bank : | search |
| AIDS Citations : | Search |
| Cancer Citations : | Search |
| Toxicology Citations : | Search |
| Env. Mutagen Info. Center : | Search |
| NLM Developmental and Reproductive Toxicity : | Search |
| Canada Domestic Sub. List : | Yes |
| EPA Chem. Sub. Inventory : | Yes |
| |
| WGK Germany : | 3 |
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| | 2-(trimethylazaniumyl)acetate |
| (EINECS) number : | 203-490-6 |
| RTECS : | DS5900000 for cas# 107-43-7 |
| chemidplus : | 000107437 |
| EPA Substance Registry Services : | 107-43-7 |
| dtp/nci : | 166511 |
references :
|
| | 2-(trimethylazaniumyl)acetate |
| NIST Chemistry WebBook : | 622412286 |
| pubchem : | 150977 |
Cosmetics :
|
| Cosmetic uses : |
antistatic agents
hair conditioning
humectants
skin conditioning
viscosity controlling agents
|
other :
|
| CosIng : | cosmetic data |
| Dietary Supplements Labels Database : | Search |
| FDA Everything Added to Food in the United States (EAFUS) | View |
| Household Products : | Search |