Articles:
| US Patents: | 7,235,519 - 1,2 Substituted 2,3-dihydro-1H-5,9 dioxacyclohepta[F]indden-7-ones and 7-substituted benzo[B][1,4]dioxepin-3-ones |
7-allylbenzo[b][1,4]dioxepin-3-one
Notes:
None found
| Fragrance Demo Formulas | ||
| CAS not found | NF0131 |  3D/inchi
|
| Nikkaji Web: | J2.012.120C | |
| XlogP3-AA: | 2.60 (est) | |
| Molecular Weight: | 204.22524000 | |
| Formula: | C12 H12 O3 | |
| NMR Predictor: | Predict (works with chrome or firefox) | |
Category: 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 |
| Google Patents: | Search |
| US Patents: | Search |
| EU Patents: | Search |
| Pubchem Patents: | Search |
| PubMed: | Search |
| NCBI: | Search |
Physical Properties:
| Assay: | 95.00 to 100.00 % |
| Food Chemicals Codex Listed: | No |
| Boiling Point: | 328.73 °C. @ 760.00 mm Hg (est) |
| Flash Point: | 291.00 °F. TCC ( 143.70 °C. ) (est) |
| logP (o/w): | 1.756 (est) |
| Soluble in: | |
| water, 66.2 mg/L @ 25 °C (est) | |
Organoleptic Properties:
| Odor Type: herbal | |
| marine floral ozone watermelon fatty aldehydic | |
| Odor Description: at 1.00 % in dipropylene glycol. | marine-floral odor with nuances of ozone, watermelons and fatty aldehydes |
| 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: | fragrance agents | ||
| IFRA Code of Practice Notification of the 49th Amendment to the IFRA Code of Practice | |||
| Recommendation for 7-allyl benzo[b][1,4]dioxepin-3-one flavor usage levels up to: | |||
| not for flavor use. | |||
Safety References:
| EPI System: | View |
| AIDS Citations: | Search |
| Cancer Citations: | Search |
| Toxicology Citations: | Search |
| Laboratory Chemical Safety Summary : | 11138191 |
| 7-prop-2-enyl-1,5-benzodioxepin-3-one |
References:
| 7-prop-2-enyl-1,5-benzodioxepin-3-one | |
| NIST Chemistry WebBook: | Search Inchi |
| Pubchem (cid): | 11138191 |
| Pubchem (sid): | 42193023 |
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
| For Odor | ||
| aldehydic | ||
| citrus carbaldehyde | FR | |
| iso | freshal | FR |
| geranyl oxyacetaldehyde | FR | |
| 3- | methyl-4-(3-methly-3-methoxybutyl oxy) butyraldehyde | FR |
| 3- | methyl-4-octyl oxybutyraldehyde | FR |
| octane nitrile | FR | |
| citrus | ||
| 4- | decenal | FL/FR |
| marine decadienal | FR | |
| octanal glycol acetal | FR | |
| 10- | undecen-1-ol | FL/FR |
| fatty | ||
| (S)-gamma- | undecalactone | FL/FR |
| green | ||
| cilantro leaf oil | FL/FR | |
| heptanal (aldehyde C-7) | FL/FR | |
| hexanal (aldehyde C-6) | FL/FR | |
| (E)-2- | hexenal | FL/FR |
| olive oil absolute | FL/FR | |
| hay | ||
| para- | methyl phenoxyacetaldehyde | FR |
| marine | ||
| ocean carboxaldehyde | FR | |
| spicy | ||
| allspice oleoresin | FL/FR | |
| cumin seed absolute | FL/FR | |
| For Flavor | ||
| No flavor group found for these | ||
| 4- | decenal | FL/FR |
| (S)-gamma- | undecalactone | FL/FR |
| 10- | undecen-1-ol | FL/FR |
| citrus | ||
| cilantro leaf oil | FL/FR | |
| green | ||
| heptanal (aldehyde C-7) | FL/FR | |
| hexanal (aldehyde C-6) | FL/FR | |
| (E)-2- | hexenal | FL/FR |
| oily | ||
| olive oil absolute | FL/FR | |
| spicy | ||
| allspice oleoresin | FL/FR | |
| cumin seed absolute | FL/FR | |
Potential Uses:
| None Found |
Occurrence (nature, food, other): note
| not found in nature |
Synonyms:
| 7- | allyl-2H-1,5-benzodioxepin-3(4H)-one |
| 7- | allylbenzo[b][1,4]dioxepin-3-one |
| 7- | prop-2-enyl-1,5-benzodioxepin-3-one |