Articles:
7-(3-methylbutyl)-2H-1,5-benzodioxepin-3(4H)-one
Notes:
None found
| Fragrance Demo Formulas | ||
| CAS Number: | 362467-67-2 |  3D/inchi
|
| Nikkaji Web: | J2.012.113K | |
| Molecular Weight: | 234.29506000 | |
| Formula: | C14 H18 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 |
| Perfumer and Flavorist: | 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: | 349.21 °C. @ 760.00 mm Hg (est) |
| Flash Point: | 313.00 °F. TCC ( 156.20 °C. ) (est) |
| logP (o/w): | 3.140 (est) |
| Soluble in: | |
| alcohol | |
| water, 5.876 mg/L @ 25 °C (est) | |
| Insoluble in: | |
| water | |
Organoleptic Properties:
| Odor Description: at 1.00 % in dipropylene glycol. | marine |
| 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 azurone flavor usage levels up to: | |||
| not for flavor use. | |||
Safety References:
| EPI System: | View |
| AIDS Citations: | Search |
| Cancer Citations: | Search |
| Toxicology Citations: | Search |
| EPA Substance Registry Services (TSCA): | 362467-67-2 |
| EPA ACToR: | Toxicology Data |
| EPA Substance Registry Services (SRS): | Registry |
| Laboratory Chemical Safety Summary : | 11064349 |
| National Institute of Allergy and Infectious Diseases: | Data |
| 7-(3-methylbutyl)-1,5-benzodioxepin-3-one | |
| Chemidplus: | 0362467672 |
References:
| 7-(3-methylbutyl)-1,5-benzodioxepin-3-one | |
| NIST Chemistry WebBook: | Search Inchi |
| Pubchem (cid): | 11064349 |
| Pubchem (sid): | 135309240 |
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
Potential Uses:
| ocean sea | FR |
Occurrence (nature, food, other): note
| not found in nature |
Synonyms:
| 2H-1,5- | benzodioxepin-3(4H)-one, 7-(3-methylbutyl)- |
| 7-(3- | methylbutyl)-1,5-benzodioxepin-3-one |
| 7-(3- | methylbutyl)-2H-1,5-benzodioxepin-3(4H)-one |
| 7-iso | pentyl-2H-benzo[b][1,4]dioxepin-3(4H)-one |