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geranyl octanoate
General Material Information
| Preferred name | geranyl octanoate |
| Trivial Name | Geranyl octanoate |
| Short Description | octanoic acid, 3,7-dimethyl-2,6-octadienyl ester, (E)- |
| Formula | C18 H32 O2 |
| CAS Number | 51532-26-4 |
| ECHA Number | 257-256-3 |
| FDA UNII | Search |
| Nikkaji Number | J261.751J |
| xLogP3-AA | 6.50 (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 |
Literature & References
| [(2E)-3,7-dimethylocta-2,6-dienyl] octanoate | |
| NIST Chemistry WebBook: | Search Inchi |
| Canada Domestic Sub. List: | 51532-26-4 |
| Pubchem (cid): | 6365696 |
| Pubchem (sid): | 135062012 |
| Pherobase: | View |
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 |
| Typical G.C. | |
| VCF-Online: | VCF Volatile Compounds in Food |
| ChemSpider: | View |
PhysChem Properties
| Material listed in food chemical codex | No |
| Molecular weight | 280.4514465332 |
| Specific gravity | @ 25 °C |
| Pounds per Gallon | 7.339 to 7.422 |
| Refractive Index | 1.458 to 1.468 @ 20 °C |
| Vapor Pressure | 1.6E-5 mmHg @ 25 °C |
| Flash Point TCC Value | 100 °C TCC |
| logP (o/w) | 7.292 est |
| Solubility | |
| alcohol | Yes |
| water, 0.007307 mg/L @ 25 °C (est) | Yes |
| water | No |
Organoleptic Properties
| Odor Type: Herbal | |
| herbal, rose, fruity, cognac | |
| General comment | At 100.00 %. herbal rose fruity cognac |
| Used for tropical and rose notes. | An herbaceous rose fruity odor |
Occurrences
| (data available) |
Potential Uses
| Applications | |
| Odor purposes | Geranium , Herbal , Rose |
| Flavoring purposes | Fruit tropical fruit |
| Other purposes | Enhancer |
Safety Information
Safety information
| European information : | |
| Most important hazard(s): | |
| None - None found. | |
| S 02 - Keep out of the reach of children. S 24/25 - Avoid contact with skin and eyes. | |
| 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: | |||
| flavor and 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 geranyl octanoate usage levels up to: | |||
| 4.0000 % in the fragrance concentrate. | |||
Safety references
| EPI System: View |
| AIDS Citations:Search |
| Cancer Citations:Search |
| Toxicology Citations:Search |
| EPA Substance Registry Services (TSCA):51532-26-4 |
| EPA ACToR:Toxicology Data |
| EPA Substance Registry Services (SRS):Registry |
| Laboratory Chemical Safety Summary :6365696 |
| National Institute of Allergy and Infectious Diseases:Data |
| WGK Germany:2 |
| [(2E)-3,7-dimethylocta-2,6-dienyl] octanoate |
| Chemidplus:0051532264 |