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cascalone (Firmenich)
General Material Information
| Preferred name | cascalone (Firmenich) |
| Trivial Name | 7-(1-Methylethyl)-2H-1,5-benzodioxepin-3(4H)-one |
| Short Description | 2H-1,5-benzodioxepin-3(4H)-one, 7-(1-methylethyl)- |
| Formula | C12 H14 O3 |
| CAS Number | 950919-28-5 |
| FDA UNII | Search |
| Nikkaji Number | J2.497.034E |
| xLogP3-AA | 2.60 (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 |
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 |
Suppliers
| Ernesto Ventós | Firmenich |
| Ernesto Ventós S.A. |
PhysChem Properties
| Material listed in food chemical codex | No |
| Molecular weight | 206.24118041992 |
| logP (o/w) | 2.58 |
| Solubility | |
| water, 57.11 mg/L @ 25 °C (est) | Yes |
Organoleptic Properties
| Odor Type: Marine | |
| marine, watery, fruity, clean | |
| Odor strength | high |
| Substantivity | 336 hour(s) at 100.00 % |
| General comment | At 1.00 % in dipropylene glycol. fresh marine watery fruity clean sweet |
| A sweet, watery version of CALONE ® with a transparent floral signature. CASCALONE ® is used to bring a natural and clean freshwater signature from top to base note. | Fresh, aquatic ingredient, with watery, fruity undertones |
Safety Information
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 | |||
| RIFM Fragrance Material Safety Assessment: Search | |||
| IFRA Code of Practice Notification of the 49th Amendment to the IFRA Code of Practice | |||
| Recommendation for cascalone (Firmenich) 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):950919-28-5 |
| EPA ACToR:Toxicology Data |
| EPA Substance Registry Services (SRS):Registry |
| Laboratory Chemical Safety Summary :22934582 |
| National Institute of Allergy and Infectious Diseases:Data |
| 7-propan-2-yl-1,5-benzodioxepin-3-one |
| Chemidplus:0950919285 |