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autumn carboxylate
General Material Information
| Preferred name | autumn carboxylate |
| Trivial Name | Ethyl 2-methyl-4-oxo-6-pentyl-2-cyclohexene-1-carboxylate |
| Short Description | calyxol (Quest) |
| Formula | C15 H24 O3 |
| CAS Number | 59151-19-8 |
| ECHA Number | 261-629-6 |
| FDA UNII | Search |
| Nikkaji Number | J308.631C |
| xLogP3-AA | 3.30 (est) |
| NMR Predictor | External link |
| Synonyms |
|
US / EU / FDA / JECFA / FEMA / Scholar / Patents
| 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 |
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 |
| Export Tariff Code: | 2910.30.000 |
| ChemSpider: | View |
PhysChem Properties
| Material listed in food chemical codex | No |
| Molecular weight | 252.35388183594 |
| Specific gravity | @ 25 °C |
| Pounds per Gallon | 8.205 to 8.288 |
| Refractive Index | 1.475 to 1.481 @ 20 °C |
| Boiling Point | 244 to 245°C @ 760 mm Hg |
| Flash Point TCC Value | 98.89 °C TCC |
| logP (o/w) | 3.439 est |
| Solubility | |
| alcohol | Yes |
| water, 7.423 mg/L @ 25 °C (est) | Yes |
| water | No |
Organoleptic Properties
| Odor Type: Floral | |
| sweet, anise, floral, clean, autumn, jasmin | |
| Odor strength | medium |
| Substantivity | 24 hour(s) at 100.00 % |
| Luebke, William tgsc, (1985) | At 100.00 %. sweet anise floral clean autumn jasmin |
Potential Uses
| Applications | |
| Odor purposes | Amber , Autumn , Incense , Jasmin , Orchid , Peach |
| Other purposes | Calyx |
| Cosmetic purposes | Perfuming agents |
Safety Information
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 autumn carboxylate usage levels up to: | |||
| 20.0000 % in the fragrance concentrate. | |||
| Recommendation for autumn carboxylate 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):59151-19-8 |
| EPA ACToR:Toxicology Data |
| EPA Substance Registry Services (SRS):Registry |
| Laboratory Chemical Safety Summary :100968 |
| National Institute of Allergy and Infectious Diseases:Data |
| WGK Germany:2 |
| ethyl 2-methyl-4-oxo-6-pentylcyclohex-2-ene-1-carboxylate |
| Chemidplus:0059151198 |