1,3-oxathiane, 2-ethyl-4,4-dimethyl-
1,3-oxathiane, 2-ethyl-4,4-dimethyl-

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Fragrance Demo Formulas Name: 2-ethyl-4,4-dimethyl-1,3-oxathiane CAS Number: 444880-09-5 3D/inchi FDA UNII: Search XlogP3-AA: 2.50 (est) Molecular Weight: 160.27972000 Formula: C8 H16 O S NMR Predictor: Predict (works with chrome, Edge 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 Pubchem Patents: Search PubMed: Search NCBI: 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 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 RIFM Fragrance Material Safety Assessment: Search 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 AIDS Citations:Search Cancer Citations:Search Toxicology Citations:Search EPA Substance Registry Services (TSCA):444880-09-5 EPA ACToR:Toxicology Data EPA Substance Registry Services (SRS):Registry Laboratory Chemical Safety Summary :18539814 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 (cid): 18539814 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 green green thiogeraniol FL/FR herbal barosma betulina leaf oil 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   Articles:   None found yet. Try the PubMed Search.

Notes: None found

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