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2-mercapto-3-pentanone
General Material Information
| Preferred name | 2-mercapto-3-pentanone |
| Trivial Name | 2-Mercapto-3-pentanone |
| Short Description | 3-pentanone, 2-mercapto- |
| Formula | C5 H10 O S |
| CAS Number | 17042-24-9 |
| FDA UNII | Search |
| Nikkaji Number | J624.964G |
| xLogP3-AA | 1.10 (est) |
| 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 |
Literature & References
| 2-sulfanylpentan-3-one | |
| NIST Chemistry WebBook: | Search Inchi |
| Pubchem (cid): | 529635 |
| Pubchem (sid): | 11077642 |
| Flavornet: | 17042-24-9 |
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): | HMDB35171 |
| FooDB: | FDB013811 |
| ChemSpider: | View |
Suppliers
| TCI AMERICA |
PhysChem Properties
| Material listed in food chemical codex | No |
| Molecular weight | 118.19889831543 |
| Boiling Point | 157 to 159°C @ 760 mm Hg |
| Vapor Pressure | 2.743 mmHg @ 25 °C |
| Flash Point TCC Value | 48.89 °C TCC |
| logP (o/w) | 1.383 est |
| Solubility | |
| alcohol | Yes |
| water, 3.026e+004 mg/L @ 25 °C (est) | Yes |
| water | No |
Organoleptic Properties
| Odor Type: Meaty | |
| roasted, meaty, meaty roasted meaty | |
| General comment | At 0.01 % in propylene glycol. roasted meat |
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: | |
| 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 2-mercapto-3-pentanone usage levels up to: | |||
| not for fragrance use. | |||
| Recommendation for 2-mercapto-3-pentanone 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 :529635 |
| National Institute of Allergy and Infectious Diseases:Data |
| 2-sulfanylpentan-3-one |