Articles:
pyrazinethiol, 3,6-dimethyl-
Notes:
None found
| CAS Number: | 5788-49-8 |  3D/inchi
|
| Nikkaji Web: | J727.906J | |
| XlogP3-AA: | 0.20 (est) | |
| Molecular Weight: | 140.20876000 | |
| Formula: | C6 H8 N2 S | |
| NMR Predictor: | Predict (works with chrome or firefox) | |
Category: information only not used for fragrances or flavors
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 |
| Google Patents: | Search |
| US Patents: | Search |
| EU Patents: | Search |
| Pubchem Patents: | Search |
| PubMed: | Search |
| NCBI: | Search |
Physical Properties:
| Assay: | 95.00 to 100.00 % |
| Food Chemicals Codex Listed: | No |
| Melting Point: | 182.00 to 185.00 °C. @ 760.00 mm Hg |
| Boiling Point: | 212.00 to 213.00 °C. @ 760.00 mm Hg (est) |
| Vapor Pressure: | 0.169000 mmHg @ 25.00 °C. (est) |
| Flash Point: | 181.00 °F. TCC ( 82.50 °C. ) (est) |
| logP (o/w): | 0.508 (est) |
| Soluble in: | |
| alcohol | |
| water, 5585 mg/L @ 25 °C (est) | |
| Insoluble in: | |
| water | |
Organoleptic Properties:
| Flavor Type: coffee | |
| coffee | |
| Taste Description: | coffee-like |
| 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: | information only not used for fragrances or flavors | ||
| Recommendation for 3,6-dimethyl pyrazine-2-thiol usage levels up to: | |||
| not for fragrance use. | |||
| Recommendation for 3,6-dimethyl pyrazine-2-thiol 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 : | 3036242 |
| National Institute of Allergy and Infectious Diseases: | Data |
| 3,6-dimethyl-1H-pyrazine-2-thione | |
| Chemidplus: | 0005788498 |
References:
| 3,6-dimethyl-1H-pyrazine-2-thione | |
| NIST Chemistry WebBook: | Search Inchi |
| Pubchem (cid): | 3036242 |
| Pubchem (sid): | 135089668 |
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
| None Found | ||
Potential Uses:
| None Found |
Occurrence (nature, food, other): note
| not found in nature |
Synonyms:
| 3,6- | dimethyl pyrazine thiol |
| 3,6- | dimethyl-1H-pyrazine-2-thione |
| 3,6- | dimethyl-2(1H)-pyrazine thione |
| 3,6- | dimethyl-2(1H)-pyrazinethione |
| 2,5- | dimethyl-3-mercaptopyrazine |
| 3,6- | dimethylpyrazine-2-thiol |
| pyrazinethiol, 3,6-dimethyl- | |
| 2(1H)- | pyrazinethione, 3,6-dimethyl- |