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2-methyl-1,3-dithiane
General Material Information
| Preferred name | 2-methyl-1,3-dithiane |
| Trivial Name | 2-Methyl-1,3-dithiane |
| Short Description | 1,3-dithiane, 2-methyl- |
| Formula | C5 H10 S2 |
| CAS Number | 6007-26-7 |
| ECHA Number | 227-859-6 |
| FDA UNII | Search |
| Nikkaji Number | J145.076J |
| Beilstein Number | 0102766 |
| MDL | MFCD00014652 |
| xLogP3-AA | 2.20 (est) |
| Bio Activity Summary | External link |
| NMR Predictor | External link |
| Synonyms |
|
US / EU / FDA / JECFA / FEMA / Scholar / Patents
| Google Scholar | Start search |
| Google Books | Start search |
| Google Patents | Start search |
| Perfumer & Flavorists | Start search |
| EU Patents | Start search |
| PubMeb | Start search |
| NCBI | Start search |
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 |
| Export Tariff Code: | 2934.90.5000 |
| ChemSpider: | View |
Suppliers
| BOC Sciences | Carbosynth |
| Endeavour Specialty Chemicals | Robinson Brothers |
| Santa Cruz Biotechnology | Sigma-Aldrich: Aldrich |
PhysChem Properties
| Material listed in food chemical codex | No |
| Molecular weight | 134.26469421387 |
| Specific gravity | @ 25 °C |
| Pounds per Gallon | |
| Boiling Point | 201 to 202°C @ 760 mm Hg |
| Vapor Pressure | 0.428 mmHg @ 25 °C |
| Flash Point TCC Value | 82.2 °C TCC |
| logP (o/w) | 2.265 est |
| Solubility | |
| alcohol | Yes |
| water, 537.6 mg/L @ 25 °C (est) | Yes |
| water | No |
Organoleptic Properties
| Odor Type: Sulfurous | |
| General comment | At 0.10 % in dipropylene glycol. sulfurous |
| Flavor Type: Onion | |
| onion, metallic | |
| General comment | Onion metallic |
Potential Uses
| Applications | |
| Flavoring purposes | Vegetable |
Safety Information
Safety information
| Preferred SDS: View | |
| 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: | |
| intraperitoneal-mouse LD50 1200 mg/kg European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 19, Pg. 461, 1984. | |
| Dermal Toxicity: | |
| Not determined | |
| Inhalation Toxicity: | |
| Not determined | |
Safety in use information
| Category: | |||
| information only not used for fragrances or flavors | |||
| Recommendation for 2-methyl-1,3-dithiane usage levels up to: | |||
| not for fragrance use. | |||
| Recommendation for 2-methyl-1,3-dithiane flavor usage levels up to: | |||
| not for flavor use. | |||
Safety references
| 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 :22329 |
| National Institute of Allergy and Infectious Diseases:Data |
| WGK Germany:3 |
| 2-methyl-1,3-dithiane |
| Chemidplus:0006007267 |
| RTECS:JO5263000 for cas# 6007-26-7 |