Articles:
| None found yet. Try the PubMed Search. |
hexanethioic acid, S-methyl ester
Notes:
Present in durian fruit (Durio zibethinus), fish oil, beer and hop oil. Flavouring ingredient
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Axxence Aromatic GmbH We bring nature to your flavour Dedicated to provide the best possible quality and supply service of natural aroma ingredients. Axxence Aromatic is entirely dedicated to provide the best possible quality and supply service of natural aroma ingredients to the Flavour & Fragrance Industry worldwide. Email: Service Voice: +49.2822.68561.0 Fax: +49.2822.68561.39 Sustainability Products List: View Product(s): 386200 METHYL HEXANETHIOATE, Natural, Kosher
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BOC Sciences Best of Chemicals Supplier Quality supplier of research chemicals and biochemicals including inhibitors, building blocks, GMP Products, impurities and metabolites, APIs for Veterinary, Natural Compounds, ADCs, Stem Cell Molecule and chiral compounds. BOC Sciences provides a wide range of services to support the pharmaceutical industry through all stages of drug discovery including Custom Synthesis of those chemicals that are not in stock, Isotope Labeling Service, Chiral Synthesis and Resolution, Bioconjugation, PEGylation services, analytical services. BOC Sciences is a brand of BOCSCI Inc. We leverage our wide spectrum of business in the fields of development, manufacturing, marketing, and distribution to help you make best-informed decisions tailored to your evolving needs for premium chemicals. Our complete suite of CRO services spans the entire molecule development pipeline including contract research for target identification, building blocks, compound synthesis, biochemical and cellular analysis, preclinical animal tests, and clinical studies. Email: Marketing US Email: Marketing Email: Sales US Email: Sales Voice: 1-631-485-4226 Fax: 1-631-614-7828 US Voice: 1-631-485-4226 US Fax: 1-631-614-7828 Europe 44-203-286-1088 Facebook Twitter Linkedin Blog Get the App! Product(s): 20756-86-9 S-(Methylthio) hexanoate
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Penta International Corporation Chemistry innovation At Penta, our products and services help businesses do business better. For over 30 years, Penta Manufacturing Company has played a growing role in worldwide chemistry innovations and applications. As an industry leader, Penta continues to pioneer chemistry-based solutions for practically every area of commerce. Our products and expertise have helped fuel technical advances in dozens of commercial applications including flavoring, coloring, fragrances and chemical processes. US Email: Technical Services US Email: Sales US Voice: (973) 740-2300 US Fax: (973) 740-1839 Product(s): 13-50505 S-METHYL HEXANETHIOATE NATURAL 5% IN ETHYL ALCOHOL
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| CAS Number: | 20756-86-9 |  3D/inchi
|
| FDA UNII: | MC7G128ACI | |
| Nikkaji Web: | J125.770F | |
| MDL: | MFCD03426527 | |
| CoE Number: | 11515 | |
| XlogP3-AA: | 2.60 (est) | |
| Molecular Weight: | 162.25198000 | |
| Formula: | C7 H14 O2 S | |
| NMR Predictor: | Predict (works with chrome, Edge or firefox) | |
Category: flavoring 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 |
| JECFA Food Flavoring: | 489 S-methyl hexanethioate |
| DG SANTE Food Flavourings: | 12.156 S-methyl hexanethioate |
Physical Properties:
Organoleptic Properties:
| Odor and/or flavor descriptions from others (if found). | |
Cosmetic Information:
| None found |
Suppliers:
| Axsyn |
| For experimental / research use only. |
| Hexanoic acid, 6-mercapto-, methyl ester |
| Axxence Aromatic |
| METHYL HEXANETHIOATE, Natural, Kosher |
| Sustainability |
| BOC Sciences |
| For experimental / research use only. |
| S-(Methylthio) hexanoate |
| Parchem |
| methyl thiohexanoate |
| Penta International |
| S-METHYL HEXANETHIOATE NATURAL 5% IN ETHYL ALCOHOL |
| Sigma-Aldrich: Aldrich |
| For experimental / research use only. |
| Methyl Hexanethioate |
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: | flavoring agents | ||
| Recommendation for S-methyl hexanethioate usage levels up to: | |||
| not for fragrance use. | |||
| Maximised Survey-derived Daily Intakes (MSDI-EU): | ND (μg/capita/day) | ||
| Structure Class: | I | ||
Safety References:
| European Food Safety Athority(EFSA): | Flavor usage levels; Subacute, Subchronic, Chronic and Carcinogenicity Studies; Developmental / Reproductive Toxicity Studies; Genotoxicity Studies... |
| European Food Safety Authority (EFSA) reference(s): | |
| Flavouring Group Evaluation 8 (FGE.08)[1]: Aliphatic and alicyclic mono-, di-, tri-, and polysulphides with or without additional oxygenated functional groups from chemical group 20 View page or View pdf | |
| Flavouring Group Evaluation 8, Revision 1 (FGE.08Rev1): Aliphatic and alicyclic mono-, di-, tri-, and polysulphides with or without additional oxygenated functional groups from chemical groups 20 and 30 View page or View pdf | |
| Scientific Opinion on Flavouring Group Evaluation 8, Revision 3 (FGE.08Rev3): Aliphatic and alicyclic mono-, di-, tri-, and polysulphides with or without additional oxygenated functional groups from chemical groups 20 and 30 View page or View pdf | |
| Scientific Opinion on Flavouring Group Evaluation 08, Revision 4 (FGE.08Rev4): Aliphatic and alicyclic mono-, di-, tri-, and polysulphides with or without additional oxygenated functional groups from chemical groups 20 and 30 View page or View pdf | |
| EPI System: | View |
| AIDS Citations: | Search |
| Cancer Citations: | Search |
| Toxicology Citations: | Search |
| EPA Substance Registry Services (TSCA): | 20756-86-9 |
| EPA ACToR: | Toxicology Data |
| EPA Substance Registry Services (SRS): | Registry |
| Laboratory Chemical Safety Summary : | 75515 |
| National Institute of Allergy and Infectious Diseases: | Data |
| WGK Germany: | 3 |
| S-methyl hexanethioate | |
| Chemidplus: | 0002432771 |
References:
| S-methyl hexanethioate | |
| NIST Chemistry WebBook: | Search Inchi |
| Pubchem (cid): | 75515 |
| Pubchem (sid): | 135032442 |
| Pherobase: | View |
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): | HMDB39465 |
| FooDB: | FDB019069 |
| VCF-Online: | VCF Volatile Compounds in Food |
| ChemSpider: | View |
| FAO: | S-Methyl hexanethioate |
Potential Blenders and core components note
| None Found | ||
Potential Uses:
| None Found |
Occurrence (nature, food, other): note
| beer Search PMC Picture | |
| durian fruit Search Trop Picture | |
| hop oil Search Trop Picture | |
| mushroom Search PMC Picture |
Synonyms:
| hexanethioic acid, S-methyl ester | |
| methyl hexane thioate | |
| ( | methyl thio) hexanoate |
| methyl thiohexanoate | |
| S- | methyl thiohexanoate |
| methyl thiol hexanoate | |
| methyl-6-mercaptohexanoate | |
| ( | methylthio)hexanoate |