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cis-3-tert-butyl cyclohexyl acetate
General Material Information
| Preferred name | cis-3-tert-butyl cyclohexyl acetate |
| Trivial Name | Cyclohexanol, 3-(1,1-dimethylethyl)-, acetate, cis- |
| Short Description | cis-3-(1,1-dimethylethyl) cyclohexanol acetate |
| Formula | C12 H22 O2 |
| CAS Number | 20298-72-0 |
| ECHA Number | 243-721-8 |
| FDA UNII | Search |
| Nikkaji Number | J278.199I |
| xLogP3-AA | 3.60 (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 |
| ChemSpider: | View |
PhysChem Properties
| Material listed in food chemical codex | No |
| Molecular weight | 198.30574035645 |
| Boiling Point | 222 to 223°C @ 760 mm Hg |
| Vapor Pressure | 0.103 mmHg @ 25 °C |
| Flash Point TCC Value | 90.8 °C TCC |
| logP (o/w) | 4.057 est |
| Solubility | |
| alcohol | Yes |
| water, 7.462 mg/L @ 25 °C (est) | Yes |
| water | No |
Organoleptic Properties
| Odor Type: Woody | |
| woody, orris, fresh, floral, camphoreous | |
| General comment | At 100.00 %. woody, iris-like, fresh, flowery, slightly camphor-like |
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: | |||
| information only not used for fragrances or flavors | |||
| Recommendation for cis-3-tert-butyl cyclohexyl acetate usage levels up to: | |||
| not for fragrance use. | |||
| Recommendation for cis-3-tert-butyl cyclohexyl acetate flavor usage levels up to: | |||
| not for flavor use. | |||
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 :89315 |
| National Institute of Allergy and Infectious Diseases:Data |
| (1S,3R)-3-tert-butylcyclohexyl acetate |
| Chemidplus:0020298719 |