Articles:
| None found yet. Try the PubMed Search. |
4,6-dimethyl-2-(1-methylethyl)dihydro-1,3,5-dithiazine
Notes:
Isol. from dried squid aroma. Flavouring ingredient
-
Chemical sources Association Inc Exchange of knowledge Need This Item for Flavor? You can contact the Chemical Sources Association. Events Links Product(s):
-
| CAS Number: | 104691-40-9 |  3D/inchi
|
| FDA UNII: | 215S2I93XT | |
| XlogP3-AA: | 3.00 (est) | |
| Molecular Weight: | 191.36049000 | |
| Formula: | C8 H17 N S2 | |
| NMR Predictor: | Predict (works with chrome or firefox) | |
| EFSA/JECFA Comments: | At least 44 % 2-Isopropyl-4,6-dimethyl and 27 % 4-Isopropyl-2,6-dimethyl; sec comp. at least 24 % 2,4,6-Trimethyldihydro--; 6-Methyl-2,4-diisopropyl-;4-Methyl-2,6-diisopropyl, 2,4,6-Triisopropyldihydro-1,3,5-dithiazine (EFFA, 2011h). Mixture of 4 diastereoisomers (25 % of each) (EFFA, 2013b). At least 44 % 2-Isopropyl-4,6-dimethyl and 27% 4-Isopropyl-2,6-dimethyl; sec comp at least 24% 2,4,6-Trimethyldihydro-; 6-Methyl-2,4-diisopropyl-; 4-Methyl-2,6-diisopropyl-, 2,4,6-Triisopropyldihydro-1,3,5-dithiazine (EFFA, 2011c). | |
Category: flavoring agents
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
| Google Scholar: | Search |
| Google Books: | Search |
| Google Scholar: with word "volatile" | Search |
| Google Scholar: with word "flavor" | Search |
| Google Scholar: with word "odor" | Search |
| Perfumer and Flavorist: | Search |
| Google Patents: | Search |
| US Patents: | Search |
| EU Patents: | Search |
| Pubchem Patents: | Search |
| PubMed: | Search |
| NCBI: | Search |
| DG SANTE Food Flavourings: | 15.057 4,6-dimethyl-2-(1-methylethyl)dihydro-1,3,5-dithiazine |
| FEMA Number: | 3782 4,6-dimethyl-2-(1-methylethyl)dihydro-1,3,5-dithiazine |
| FDA: | No longer provide for the use of these seven synthetic flavoring substances |
Physical Properties:
| Assay: | 71.00 to 100.00 % |
| Food Chemicals Codex Listed: | No |
| Specific Gravity: | 0.95100 to 0.95900 @ 25.00 °C. |
| Pounds per Gallon - (est).: | 7.913 to 7.980 |
| Refractive Index: | 1.49600 to 1.50000 @ 20.00 °C. |
| Boiling Point: | 264.00 to 265.00 °C. @ 760.00 mm Hg (est) |
| Vapor Pressure: | 0.016200 mmHg @ 25.00 °C. (est) |
| Flash Point: | 236.00 °F. TCC ( 113.33 °C. ) (est) |
| logP (o/w): | 1.430 (est) |
| Soluble in: | |
| water, 4836 mg/L @ 25 °C (est) | |
Organoleptic Properties:
| Odor and/or flavor descriptions from others (if found). | |
Cosmetic Information:
| None found |
Suppliers:
| Chemical Sources Association |
| Need This Item for Flavor/Food?: You can contact the CSA |
Safety Information:
| Hazards identification | |
| Classification of the substance or mixture | |
| GHS Classification in accordance with 29 CFR 1910 (OSHA HCS) | |
| None found. | |
| GHS Label elements, including precautionary statements | |
| Pictogram | |
| Hazard statement(s) | |
| None found. | |
| Precautionary statement(s) | |
| None found. | |
| Oral/Parenteral Toxicity: | |
| Not determined | |
| Dermal Toxicity: | |
| Not determined | |
| Inhalation Toxicity: | |
| Not determined | |
Safety in Use Information:
| Category: | flavoring agents | ||
| Recommendation for 4,6-dimethyl-2-(1-methyl ethyl) dihydro-1,3,5-dithiazine usage levels up to: | |||
| not for fragrance use. | |||
| Maximised Survey-derived Daily Intakes (MSDI-EU): | 1.60 (μg/capita/day) | ||
| Threshold of Concern: | 90 (μg/person/day) | ||
| Structure Class: | III | ||
| 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 Flavor Ingredient Library | |||
| publication number: 16 | |||
| Click here to view publication 16 | |||
| average usual ppm | average maximum ppm | ||
| baked goods: | 0.50000 | 5.00000 | |
| beverages(nonalcoholic): | - | - | |
| beverages(alcoholic): | - | - | |
| breakfast cereal: | 0.50000 | 5.00000 | |
| cheese: | - | - | |
| chewing gum: | 1.00000 | 20.00000 | |
| condiments / relishes: | - | - | |
| confectionery froastings: | 0.50000 | 5.00000 | |
| egg products: | - | - | |
| fats / oils: | - | - | |
| fish products: | - | - | |
| frozen dairy: | - | - | |
| fruit ices: | - | - | |
| gelatins / puddings: | - | - | |
| granulated sugar: | - | - | |
| gravies: | - | - | |
| hard candy: | 0.50000 | 5.00000 | |
| imitation dairy: | - | - | |
| instant coffee / tea: | - | - | |
| jams / jellies: | - | - | |
| meat products: | 0.50000 | 5.00000 | |
| milk products: | 0.05000 | 1.00000 | |
| nut products: | 0.50000 | 5.00000 | |
| other grains: | - | - | |
| poultry: | - | - | |
| processed fruits: | - | - | |
| processed vegetables: | - | - | |
| reconstituted vegetables: | - | - | |
| seasonings / flavors: | - | - | |
| snack foods: | 0.50000 | 5.00000 | |
| soft candy: | 0.50000 | 5.00000 | |
| soups: | 0.10000 | 2.00000 | |
| sugar substitutes: | - | - | |
| sweet sauces: | - | - | |
Safety References:
| European Food Safety Athority(EFSA): | Flavor usage levels; Subacute, Subchronic, Chronic and Carcinogenicity Studies; Developmental / Reproductive Toxicity Studies; Genotoxicity Studies... |
| European Food Safety Authority (EFSA) reference(s): | |
| Scientific Opinion on Flavouring Group Evaluation 21, Revision 3 (FGE.21Rev3): Thiazoles, thiophenes, thiazoline and thienyl derivatives from chemical groups 29 and 30 View page or View pdf | |
| Scientific Opinion on Flavouring Group Evaluation 21, Revision 4 (FGE.21Rev4): Thiazoles, thiophenes, thiazoline and thienyl derivatives from chemical groups 29 and 30 View page or View pdf | |
| Scientific Opinion on Flavouring Group Evaluation 21, Revision 5 (FGE.21Rev5): Thiazoles, thiophenes, thiazoline and thienyl derivatives from chemical groups 29 and 30 View page or View pdf | |
| EPI System: | View |
| AIDS Citations: | Search |
| Cancer Citations: | Search |
| Toxicology Citations: | Search |
| EPA ACToR: | Toxicology Data |
| EPA Substance Registry Services (SRS): | Registry |
| Laboratory Chemical Safety Summary : | 3808445 |
| National Institute of Allergy and Infectious Diseases: | Data |
| 4,6-dimethyl-2-propan-2-yl-4H-1,3,5-dithiazine | |
| Chemidplus: | 0104691409 |
References:
| 4,6-dimethyl-2-propan-2-yl-4H-1,3,5-dithiazine | |
| NIST Chemistry WebBook: | Search Inchi |
| Canada Domestic Sub. List: | 104691-40-9 |
| Pubchem (cid): | 3808445 |
| Pubchem (sid): | 135195300 |
Other Information:
| (IUPAC): | Atomic Weights of the Elements 2011 (pdf) |
| Videos: | The Periodic Table of Videos |
| tgsc: | Atomic Weights use for this web site |
| (IUPAC): | Periodic Table of the Elements |
| HMDB (The Human Metabolome Database): | HMDB40333 |
| FooDB: | FDB020058 |
| VCF-Online: | VCF Volatile Compounds in Food |
Potential Blenders and core components note
| None Found | ||
Potential Uses:
| None Found |
Occurrence (nature, food, other): note
| squid dried squid Search Picture |
Synonyms:
| 4,6- | dimethyl-2-(1-methylethyl)dihydro-1,3,5-dithiazine |
| 4,6- | dimethyl-2-propan-2-yl-4H-1,3,5-dithiazine |