Articles:
5,7-octadien-4-one, 2,6-dimethyl-, (5E)-
Notes:
None found
| CAS Number: | 6752-80-3 |  3D/inchi
|
| ECHA EINECS - REACH Pre-Reg: | 229-813-0 | |
| FDA UNII: | 9V8N4C9UN5 | |
| Nikkaji Web: | J14.106B | |
| XlogP3-AA: | 3.10 (est) | |
| Molecular Weight: | 152.23672000 | |
| Formula: | C10 H16 O | |
| NMR Predictor: | Predict (works with chrome or firefox) | |
Category: natural substances and extractives
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 |
| Google Patents: | Search |
| US Patents: | Search |
| EU Patents: | Search |
| Pubchem Patents: | Search |
Physical Properties:
| Appearance: | pale yellow clear liquid (est) |
| Assay: | 96.00 to 100.00 % |
| Food Chemicals Codex Listed: | No |
| Boiling Point: | 222.00 to 223.00 °C. @ 760.00 mm Hg |
| Vapor Pressure: | 0.099000 mmHg @ 25.00 °C. (est) |
| Flash Point: | 187.00 °F. TCC ( 86.11 °C. ) |
| logP (o/w): | 2.543 (est) |
| Soluble in: | |
| alcohol | |
| water, 159.8 mg/L @ 25 °C (est) | |
| Insoluble in: | |
| water | |
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: | natural substances and extractives | ||
| Recommendation for (E)-tagetone usage levels up to: | |||
| not for fragrance use. | |||
| Recommendation for (E)-tagetone flavor usage levels up to: | |||
| not for flavor use. | |||
Safety References:
| EPI System: | View |
| EPA ACToR: | Toxicology Data |
| EPA Substance Registry Services (SRS): | Registry |
| Laboratory Chemical Safety Summary : | 5368938 |
| National Institute of Allergy and Infectious Diseases: | Data |
| (5E)-2,6-dimethylocta-5,7-dien-4-one | |
| Chemidplus: | 0006752803 |
References:
| (5E)-2,6-dimethylocta-5,7-dien-4-one | |
| NIST Chemistry WebBook: | Search Inchi |
| Pubchem (cid): | 5368938 |
| Pubchem (sid): | 135062791 |
| 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 |
Potential Blenders and core components note
| None Found | ||
Potential Uses:
| None Found |
Occurrence (nature, food, other): note
| boronia absolute @ 0.02% Data GC Search Trop Picture | |
| cistus oil @ 0.2% Data GC Search Trop Picture | |
| tagete flower oil rwanda @ 3.40% Data GC Search Trop Picture | |
| tagete oil CO2 extract @ 2.81% Data GC Search Trop Picture | |
| tagete oil egypt @ 7.49% Data GC Search Trop Picture | |
| tagete oil rwanda @ 2.86% Data GC Search Trop Picture | |
| tagete oil turkey @ 4.80% Data GC Search Trop Picture | |
| tagete oil zambia @ 6.30% Data GC Search Trop Picture |
Synonyms:
| (E)-2,6- | dimethyl octa-5,7-dien-4-one |
| trans-2,6- | dimethyl octa-5,7-dien-4-one |
| (E)-2,6- | dimethyl-5,7-octadien-4-one |
| trans-2,6- | dimethyl-5,7-octadien-4-one |
| (5E)-2,6- | dimethylocta-5,7-dien-4-one |
| (E)-2,6- | dimethylocta-5,7-dien-4-one |
| trans-2,6- | dimethylocta-5,7-dien-4-one |
| 5,7- | octadien-4-one, 2,6-dimethyl-, (5E)- |
| 5,7- | octadien-4-one, 2,6-dimethyl-, (E)- |
| trans- | tagetone |