| Preferred name | chamomile octenone |
| Trivial Name | (E)-2,7-dimethyloct-5-en-4-one |
| Short Description | isotagetone |
| Formula | C10 H18 O |
| CAS Number | 68419-46-5 |
| CAS Number | 68419-46-5 (Z) |
| ECHA Number | 270-267-8 |
| FDA UNII | 5L2NZP42Y7 |
| Nikkaji Number | J1.954.849J |
| xLogP3-AA | 2.80 (est) |
| Bio Activity Summary | External link |
| NMR Predictor | External link |
| Synonyms |
|
| 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 |
| (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: | 3302.90.0000 |
| ChemSpider: | View |
| The John D. Walsh Company | Taytonn ASCC |
| Material listed in food chemical codex | No |
| Molecular weight | 154.2526550293 |
| Specific gravity | @ 20 °C |
| Pounds per Gallon | 7.014 to 7.039 |
| Refractive Index | 1.439 to 1.442 @ 20 °C |
| Boiling Point | 209 to 210°C @ 760 mm Hg |
| Vapor Pressure | 0.19 mmHg @ 25 °C |
| Flash Point TCC Value | 85 °C TCC |
| logP (o/w) | 2.851 est |
| Solubility | |
| alcohol | Yes |
| water, 154.5 mg/L @ 25 °C (est) | Yes |
| water | No |
| Odor Type: Herbal | |
| tagette, chamomile, animal, fruity | |
| Odor strength | medium , recommend smelling in a 10.00 % solution or less |
| Substantivity | 16 hour(s) at 100.00 % |
| Luebke, William tgsc, (1985) | At 10.00 % in dipropylene glycol. tagette chamomile animal fruity |
| Applications | |
| Odor purposes | Aldehydic , Chamomile , Chypre , Citrus , Geranium , Grapefruit , Green , Lavender , Marigold , Neroli , Oriental , Rose |
| Flavoring purposes | Marigold |
| Other purposes | Natural |
| Cosmetic purposes | Perfuming agents |
| 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 | |
| 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 chamomile octenone usage levels up to: | |||
| 5.0000 % in the fragrance concentrate. | |||
| Recommendation for chamomile octenone flavor usage levels up to: | |||
| not for flavor use. | |||
| EPI System: View |
| AIDS Citations:Search |
| Cancer Citations:Search |
| Toxicology Citations:Search |
| EPA Substance Registry Services (TSCA):68419-46-5 |
| EPA ACToR:Toxicology Data |
| EPA Substance Registry Services (SRS):Registry |
| Laboratory Chemical Safety Summary :1738173 |
| National Institute of Allergy and Infectious Diseases:Data |
| (E)-2,7-dimethyloct-5-en-4-one |
| Chemidplus:0068419465 |
| (Z)-2,7-dimethyloct-5-en-4-one |