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tetrahydrojasmone
General Material Information
| Preferred name | tetrahydrojasmone |
| Trivial Name | 3-Methyl-2-pentylcyclopentanone |
| Short Description | cyclopentanone, 3-methyl-2-pentyl- |
| Formula | C11 H20 O |
| CAS Number | 13074-63-0 |
| ECHA Number | 235-969-0 |
| FDA UNII | Search |
| Nikkaji Number | J317.794G |
| xLogP3-AA | 3.40 (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 |
| ChemSpider: | View |
Suppliers
| Ernesto Ventós | Moellhausen |
| Penta International | Penta International Corporation |
| Ernesto Ventós S.A. |
PhysChem Properties
| Material listed in food chemical codex | No |
| Molecular weight | 168.27960205078 |
| Specific gravity | @ 25 °C |
| Pounds per Gallon | 7.322 to 7.406 |
| Refractive Index | 1.4 to 1.5 @ 20 °C |
| Boiling Point | 230 to 231°C @ 760 mm Hg |
| Vapor Pressure | 0.066 mmHg @ 25 °C |
| Flash Point TCC Value | 93.33 °C TCC |
| logP (o/w) | 3.403 est |
| Solubility | |
| alcohol | Yes |
| water, 73.11 mg/L @ 25 °C (est) | Yes |
| water | No |
Organoleptic Properties
| Odor Type: Coconut | |
| coconut, sweet, jasmin, spicy, fruity | |
| General comment | At 100.00 %. coconut sweet jasmin spicy fruity |
| Used in jasmine, coconut, and tropical blends. | Coconut jasmine character |
Potential Uses
| Applications | |
| Odor purposes | Apricot , Blackberry , Butter , Butterscotch , Caraway seed , Christmas , Coconut , Cream , Gardenia , Honey , Jasmin , Mango , Oakwood , Peach , Pina colada , Raspberry , Root beer , Strawberry , Tuberose , Vanilla |
| Flavoring purposes | Caraway seed , Chocolate cocoa , Cookie , Fat , Fruit tropical fruit , Milk , Tropical |
Safety Information
Safety information
| European information : | |
| Most important hazard(s): | |
| Xi - Irritant | |
| R 36/38 - Irritating to skin and eyes. S 02 - Keep out of the reach of children. S 24/25 - Avoid contact with skin and eyes. S 26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. S 36 - Wear suitable protective clothing. | |
| 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 tetrahydrojasmone usage levels up to: | |||
| 8.0000 % in the fragrance concentrate. | |||
| Recommendation for tetrahydrojasmone 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):13074-63-0 |
| EPA ACToR:Toxicology Data |
| EPA Substance Registry Services (SRS):Registry |
| Laboratory Chemical Safety Summary :114453 |
| National Institute of Allergy and Infectious Diseases:Data |
| WGK Germany:2 |
| 3-methyl-2-pentylcyclopentan-1-one |
| Chemidplus:0013074630 |