Articles:
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ethanone, 1-((3R,3aS,7R,8aS)-2,3,4,7,8,8a-hexahydro-3,6,8,8-tetramethyl-1H-3a,7-methanoazulen-5-yl)-
Notes:
None found
| CAS Number: | 73398-84-2 |  3D/inchi
|
| FDA UNII: | Search | |
| MDL: | MFCD03410252 | |
| XlogP3-AA: | 4.70 (est) | |
| Molecular Weight: | 248.40936000 | |
| Formula: | C17 H28 O | |
| NMR Predictor: | Predict (works with chrome, Edge or firefox) | |
Category: fragrance 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 |
| Google Patents: | Search |
| US Patents: | Search |
| EU Patents: | Search |
| Pubchem Patents: | Search |
| PubMed: | Search |
| NCBI: | Search |
Physical Properties:
| Appearance: | yellow to brown clear oily liquid (est) |
| Assay: | 95.00 to 100.00 % |
| Food Chemicals Codex Listed: | No |
| Soluble in: | |
| water, 2.235 mg/L @ 25 °C (exp) | |
Organoleptic Properties:
| Odor Type: woody | |
| woody vetiver | |
| Odor Description: at 100.00 %. | woody vetiver |
| 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: | fragrance agents | ||
| RIFM Fragrance Material Safety Assessment: Search | |||
| IFRA Code of Practice Notification of the 49th Amendment to the IFRA Code of Practice | |||
| Recommendation for (R,S)-methyl cedryl ketone flavor usage levels up to: | |||
| not for flavor use. | |||
Safety References:
| EPI System: | View |
| AIDS Citations: | Search |
| Cancer Citations: | Search |
| Toxicology Citations: | Search |
| EPA Substance Registry Services (TSCA): | 73398-84-2 |
| EPA ACToR: | Toxicology Data |
| EPA Substance Registry Services (SRS): | Registry |
| Laboratory Chemical Safety Summary : | 175481 |
| National Institute of Allergy and Infectious Diseases: | Data |
| Chemidplus: | 073398842 |
References:
| NIST Chemistry WebBook: | Search Inchi |
| Canada Domestic Sub. List: | 73398-84-2 |
| Pubchem (cid): | 175481 |
| Pubchem (sid): | 135153371 |
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:
| ethanone, 1-((3R,3aS,7R,8aS)-2,3,4,7,8,8a-hexahydro-3,6,8,8-tetramethyl-1H-3a,7-methanoazulen-5-yl)- | |
| ethanone, 1-(octahydro-3,6,8,8-tetramethyl-1H-3a,7-methanoazulen-6-yl)-, (3R-(3alpha,3abeta,6beta,7beta,8aalpha))- | |
| 1-((3R-(3alpha,3abeta,6beta,7beta,8aalpha))- | octahydro-3,6,8,8-tetramethyl-1H-3a,7-methanoazulen-6-yl)-ethanone |
| 1-((3R,3aS,6S,7R,8aS)- | octahydro-3,6,8,8-tetramethyl-1H-3a,7-methanoazulen-6-yl)-ethanone |