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trivalon
Notes:
None found
| CAS Number: | 71566-51-3 |  3D/inchi
|
| Nikkaji Web: | J110.619H | |
| XlogP3-AA: | 1.80 (est) | |
| Molecular Weight: | 142.19798000 | |
| Formula: | C8 H14 O2 | |
| 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 |
| Perfumer and Flavorist: | Search |
| Google Patents: | Search |
| US Patents: | Search |
| EU Patents: | Search |
| Pubchem Patents: | Search |
| PubMed: | Search |
| NCBI: | Search |
Physical Properties:
| Appearance: | colorless clear liquid (est) |
| Assay: | 95.00 to 100.00 % |
| Food Chemicals Codex Listed: | No |
| Specific Gravity: | 0.98100 @ 25.00 °C. |
| Refractive Index: | 1.44600 to 1.45000 @ 20.00 °C. |
| Boiling Point: | 90.00 to 92.00 °C. @ 4.00 mm Hg |
| Vapor Pressure: | 0.154000 mmHg @ 25.00 °C. (est) |
| Flash Point: | > 200.00 °F. TCC ( > 93.33 °C. ) |
| logP (o/w): | 1.347 (est) |
| Soluble in: | |
| alcohol | |
| water, 5449 mg/L @ 25 °C (est) | |
| Insoluble in: | |
| water | |
| Stability: | |
| most media | |
Organoleptic Properties:
| Odor Type: herbal | |
| Odor Strength: | medium , recommend smelling in a 1.00 % solution or less |
| Substantivity: | 100 hour(s) at 100.00 % |
| bitter walnut nutty nut skin acorn saffron citrus herbal | |
| Odor Description: at 1.00 % in dipropylene glycol. | bitter walnut nutty nut skin acorn saffron citrus herbal hot Luebke, William tgsc, (1984) |
| Flavor Type: woody | |
| woody woody old wood nutty nut skin | |
| Taste Description: | woody old wood nutty |
| 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: | |
|
oral-mouse LD50 800 mg/kg | |
| 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 saffron pyranone usage levels up to: | |||
| 4.0000 % in the fragrance concentrate. | |||
| Recommendation for saffron pyranone 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): | 71566-51-3 |
| EPA ACToR: | Toxicology Data |
| EPA Substance Registry Services (SRS): | Registry |
| Laboratory Chemical Safety Summary : | 172843 |
| National Institute of Allergy and Infectious Diseases: | Data |
| WGK Germany: | 1 |
| 4,4,6-trimethyloxan-2-one | |
| Chemidplus: | 0071566513 |
References:
| 4,4,6-trimethyloxan-2-one | |
| NIST Chemistry WebBook: | Search Inchi |
| Canada Domestic Sub. List: | 71566-51-3 |
| Pubchem (cid): | 172843 |
| Pubchem (sid): | 135127970 |
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
Potential Uses:
| chypre | FR | |
| citrus | FR | |
| fern | FR | |
| herbal | FR | |
| lavender | FR | |
| saffron | FR | |
| walnut | FL | |
| woody | FR |
Occurrence (nature, food, other): note
| not found in nature |
Synonyms:
| 2H- | pyran-2-one, tetrahydro-4,4,6(or 4,6,6)-trimethyl- |
| tetrahydro-4,4,6(or 4,6,6)-trimethyl-2H-pyran-2-one | |
| 4,6,6(4,4,6)- | trimethyl tetrahydropyran-2-one |
| 4,4,6- | trimethyloxan-2-one |
| 4,4,6- | trimethyltetrahydro-2H-pyran-2-one |
| 4,6,6(4,4,6)- | trimethyltetrahydropyran-2-one |
| trivalon |