Articles:
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octanoic acid, 3,7-dimethyl-6-octen-1-yl ester
Notes:
None found
| CAS Number: | 72934-05-5 |  3D/inchi
|
| XlogP3-AA: | 6.80 (est) | |
| Molecular Weight: | 282.46738000 | |
| Formula: | C18 H34 O2 | |
| NMR Predictor: | Predict (works with chrome or firefox) | |
Category: flavor and 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: | 98.00 to 100.00 % |
| Food Chemicals Codex Listed: | No |
| Boiling Point: | 352.00 to 353.00 °C. @ 760.00 mm Hg |
| Flash Point: | 204.00 °F. TCC ( 95.56 °C. ) |
| logP (o/w): | 7.262 (est) |
| Soluble in: | |
| water, 0.006017 mg/L @ 25 °C (est) | |
| Similar Items: note | |
| allyl octanoate | |
| amyl octanoate | |
| isoamyl octanoate | |
| benzyl octanoate | |
| butyl octanoate | |
| isobutyl octanoate | |
| ortho-cresyl octanoate | |
| para-cresyl octanoate | |
| decyl octanoate | |
| ethyl 4-methyl octanoate | |
| ethyl octanoate | |
| furfuryl octanoate | |
| geranyl octanoate | |
| heptyl octanoate | |
| (E)-2-hexen-1-yl octanoate | |
| (Z)-3-hexen-1-yl octanoate | |
| hexyl octanoate | |
| linalyl octanoate | |
| 2-methyl butyl octanoate | |
| methyl octanoate | |
| nonyl octanoate | |
| octyl octanoate | |
| phenethyl octanoate | |
| propyl octanoate | |
| isopropyl octanoate | |
| sulfuryl octanoate | |
Organoleptic Properties:
| 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: | |
| Not determined | |
| Dermal Toxicity: | |
| Not determined | |
| Inhalation Toxicity: | |
| Not determined | |
Safety in Use Information:
| Category: | flavor and fragrance agents | ||
| IFRA Code of Practice Notification of the 49th Amendment to the IFRA Code of Practice | |||
Safety References:
| EPI System: | View |
| AIDS Citations: | Search |
| Cancer Citations: | Search |
| Toxicology Citations: | Search |
| EPA ACToR: | Toxicology Data |
| EPA Substance Registry Services (SRS): | Registry |
| Laboratory Chemical Safety Summary : | 527286 |
| National Institute of Allergy and Infectious Diseases: | Data |
| 3,7-dimethyloct-6-enyl octanoate |
References:
| 3,7-dimethyloct-6-enyl octanoate | |
| NIST Chemistry WebBook: | Search Inchi |
| Pubchem (cid): | 527286 |
| Pubchem (sid): | 10544046 |
| 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 |
| ChemSpider: | View |
Potential Blenders and core components note
| None Found | ||
Potential Uses:
| None Found |
Occurrence (nature, food, other): note
| not found in nature |
Synonyms:
| citronellyl octanoate | |
| 3,7- | dimethyloct-6-enyl octanoate |
| octanoic acid, 3,7-dimethyl-6-octen-1-yl ester |