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

Chemical Structure

General Material Information

Preferred name 1,3-oxathiane, 2-ethyl-4,4-dimethyl-
Trivial Name 2-Ethyl-4,4-dimethyl-1,3-oxathiane
Short Description 1,3-oxathiane, 2-ethyl-4,4-dimethyl-
Formula C8 H16 O S
CAS Number 444880-09-5
FDA UNII Search
xLogP3-AA 2.50 (est)
NMR Predictor External link
Synonyms
  • 2-ethyl-4,4-dimethyl-1,3-oxathiane
  • 2-Ethyl-4,4-dimethyl-1,3-oxathiane

US / EU / FDA / JECFA / FEMA / Scholar / Patents

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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

PhysChem Properties

Material listed in food chemical codex No
Molecular weight 160.27972412109
Vapor Pressure 0.249 mmHg @ 25 °C
Flash Point TCC Value 82.4 °C TCC
logP (o/w) 2.861 est
Solubility
water, 723.6 mg/L @ 25 °C (est) Yes

Organoleptic Properties

Odor Type: Herbal
herbal, sage, tagette, currant bud black currant bud, minty, sulfurous, onion
General comment At 1.00 % in dipropylene glycol. herbal sage tagette cassis minty sulfury onion

Safety Information

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