| Preferred name | (R)-mercapto-3-methyl hexan-1-ol |
| Trivial Name | (3R)-3-methyl-3-sulfanylhexan-1-ol |
| Short Description | 1-hexanol, 3-mercapto-3-methyl-, (3R)- |
| Formula | C7 H16 O S |
| CAS Number | 828300-39-6 |
| FDA UNII | Search |
| Nikkaji Number | J3.078.694G |
| xLogP3-AA | 1.70 (est) |
| NMR Predictor | External link |
| Synonyms |
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| 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 |
| Leffingwell: | Chirality or Article |
| (3R)-3-methyl-3-sulfanylhexan-1-ol | |
| NIST Chemistry WebBook: | Search Inchi |
| Pubchem (cid): | 9793841 |
| Pubchem (sid): | 162712978 |
| Publications by US Patents | |
| 6,805,893 - Mercapto-alkanol flavor compounds | |
| (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 |
| Aston Chemical |
| Material listed in food chemical codex | No |
| Molecular weight | 148.26872253418 |
| Vapor Pressure | 0.023 mmHg @ 25 °C |
| Flash Point TCC Value | 87.2 °C TCC |
| logP (o/w) | 1.993 est |
| Solubility | |
| water, 1133 mg/L @ 25 °C (est) | Yes |
| Odor Type: Citrus | |
| grapefruit, passion fruit, currant black currant, onion | |
| General comment | At 0.10 % in propylene glycol. grapefruit passion fruit blackcurrant onion |
| 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 | |
| Category: | |||
| information only not used for fragrances or flavors | |||
| Recommendation for (R)-mercapto-3-methyl hexan-1-ol usage levels up to: | |||
| not for fragrance use. | |||
| Recommendation for (R)-mercapto-3-methyl hexan-1-ol flavor usage levels up to: | |||
| not for flavor use. | |||
| EPI System: View |
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| EPA ACToR:Toxicology Data |
| EPA Substance Registry Services (SRS):Registry |
| Laboratory Chemical Safety Summary :9793841 |
| National Institute of Allergy and Infectious Diseases:Data |
| (3R)-3-methyl-3-sulfanylhexan-1-ol |