Articles:
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ethanol, 2-(3,3-dimethylbicyclo(2.2.1)hept-2-ylidene)-, (2E)-
Notes:
None found
| CAS Number: | 58437-71-1 |  3D/inchi
|
| ECHA EINECS - REACH Pre-Reg: | 261-252-7 | |
| Nikkaji Web: | J296.937H | |
| XlogP3-AA: | 2.30 (est) | |
| Molecular Weight: | 166.26366000 | |
| Formula: | C11 H18 O | |
| NMR Predictor: | Predict (works with chrome 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: | colorless to pale yellow clear liquid (est) |
| Assay: | 95.00 to 100.00 % |
| Food Chemicals Codex Listed: | No |
| Boiling Point: | 242.80 °C. @ 760.00 mm Hg (est) |
| Flash Point: | 225.00 °F. TCC ( 107.20 °C. ) (est) |
| logP (o/w): | 3.220 (est) |
| Soluble in: | |
| water, 318.1 mg/L @ 25 °C (est) | |
Organoleptic Properties:
| 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 | ||
| IFRA Code of Practice Notification of the 49th Amendment to the IFRA Code of Practice | |||
| Recommendation for (E)-patchouli ethanol 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): | 58437-71-1 |
| EPA ACToR: | Toxicology Data |
| EPA Substance Registry Services (SRS): | Registry |
| Laboratory Chemical Safety Summary : | 5369964 |
| National Institute of Allergy and Infectious Diseases: | Data |
| (2E)-2-(3,3-dimethyl-2-bicyclo[2.2.1]heptanylidene)ethanol | |
| Chemidplus: | 0058437722 |
References:
| (2E)-2-(3,3-dimethyl-2-bicyclo[2.2.1]heptanylidene)ethanol | |
| NIST Chemistry WebBook: | Search Inchi |
| Pubchem (cid): | 5369964 |
| Pubchem (sid): | 135051749 |
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:
| (E)-2-(3,3- | dimethyl bicyclo(2.2.1)hept-2-ylidene) ethanol |
| (2E)-2-(3,3- | dimethyl-2-bicyclo[2.2.1]heptanylidene)ethanol |
| (E)-2-(3,3- | dimethylbicyclo(2.2.1)hept-2-ylidene)ethanol |
| ethanol, 2-(3,3-dimethylbicyclo(2.2.1)hept-2-ylidene)-, (2E)- | |
| ethanol, 2-(3,3-dimethylbicyclo(2.2.1)hept-2-ylidene)-, (E)- | |
| trans- | patchouli ethanol |