Articles:
| None found yet. |
1,3-oxathiane, 2-ethyl-4,4-dimethyl-
Notes:
None found
| Fragrance Demo Formulas | ||
| CAS Number: | 444880-09-5 |  3D/inchi
|
| Molecular Weight: | 160.27972000 | |
| Formula: | C8 H16 O S | |
| NMR Predictor: | Predict (works with chrome or firefox) | |
Category: fragrance 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 |
Physical Properties:
| Appearance: | colorless to pale yellow clear liquid (est) |
| Assay: | 95.00 to 100.00 % |
| Food Chemicals Codex Listed: | No |
| Boiling Point: | 212.67 °C. @ 760.00 mm Hg (est) |
| Vapor Pressure: | 0.249000 mmHg @ 25.00 °C. (est) |
| Flash Point: | 180.00 °F. TCC ( 82.40 °C. ) (est) |
| logP (o/w): | 2.861 (est) |
| Soluble in: | |
| water, 723.6 mg/L @ 25 °C (est) | |
Organoleptic Properties:
| Odor Type: herbal | |
| Odor Strength: | high , recommend smelling in a 1.00 % solution or less |
| herbal sage tagette currant bud black currant bud minty sulfurous onion | |
| Odor Description: at 1.00 % in dipropylene glycol. | herbal sage tagette cassis minty sulfury onion |
| Odor and/or flavor descriptions from others (if found). | |
Cosmetic Information:
| None found |
Suppliers:
| None found |
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: | fragrance agents | ||
| IFRA Code of Practice Notification of the 49th Amendment to the IFRA Code of Practice | |||
| Recommendation for 1,3-oxathiane, 2-ethyl-4,4-dimethyl- flavor usage levels up to: | |||
| not for flavor use. | |||
Safety References:
| EPI System: | View |
| EPA Substance Registry Services (TSCA): | 444880-09-5 |
| EPA ACToR: | Toxicology Data |
| EPA Substance Registry Services (SRS): | Registry |
| National Institute of Allergy and Infectious Diseases: | Data |
| 2-ethyl-4,4-dimethyl-1,3-oxathiane | |
| Chemidplus: | 0444880095 |
References:
| 2-ethyl-4,4-dimethyl-1,3-oxathiane | |
| NIST Chemistry WebBook: | Search Inchi |
| Pubchem (sid): | 135273360 |
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): | Search |
| ChemSpider: | View |
Potential Blenders and core components note
| For Odor | ||
| fruity | ||
| benzyl heptanoate | FL/FR | |
| green | ||
| thiogeraniol | FL/FR | |
| herbal | ||
| barosma betulina leaf oil | FL/FR | |
| 2-(2,4- | dimethyl-3-cyclohexene-1-yl)-4,4-dimethyl-1,3-oxathiane | FR |
| sulfurous | ||
| grapefruit menthane | FL/FR | |
| thujonic | ||
| armoise oil | FR | |
| For Flavor | ||
| No flavor group found for these | ||
| benzyl heptanoate | FL/FR | |
| herbal | ||
| barosma betulina leaf oil | FL/FR | |
| minty | ||
| thiogeraniol | FL/FR | |
| sulfurous | ||
| grapefruit menthane | FL/FR | |
Potential Uses:
| None Found |
Occurrence (nature, food, other): note
| not found in nature |
Synonyms:
| 2- | ethyl-4,4-dimethyl-1,3-oxathiane |