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4-cyclohexylcyclohexanone
Notes:
None found
| CAS Number: | 92-68-2 |  3D/inchi
|
| ECHA EINECS - REACH Pre-Reg: | 202-178-7 | |
| FDA UNII: | 6SLH0OPI94 | |
| Nikkaji Web: | J99.554A | |
| MDL: | MFCD00019468 | |
| XlogP: | 3.40 (est) | |
| Molecular Weight: | 180.29060000 | |
| Formula: | C12 H20 O | |
| BioActivity Summary: | listing | |
| NMR Predictor: | Predict (works with chrome or firefox) | |
Category: cosmetic and 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:
| Appearance: | colorless clear liquid (est) |
| Assay: | 95.00 to 100.00 % |
| Food Chemicals Codex Listed: | No |
| Boiling Point: | 281.00 to 283.00 °C. @ 760.00 mm Hg |
| Vapor Pressure: | 0.003000 mmHg @ 25.00 °C. (est) |
| Flash Point: | 232.00 °F. TCC ( 111.11 °C. ) |
| logP (o/w): | 3.328 (est) |
| Shelf Life: | 25.00 month(s) or longer if stored properly. |
| Storage: | store in cool, dry place in tightly sealed containers, protected from heat and light. |
| Soluble in: | |
| alcohol | |
| water, 30.41 mg/L @ 25 °C (est) | |
| Insoluble in: | |
| water | |
| Stability: | |
| alkali stable | |
Organoleptic Properties:
| Odor Type: floral | |
| Odor Strength: | medium |
| floral orris cyclamen woody ozone fresh | |
| Odor Description: at 100.00 %. | floral orris cyclamen woody ozone fresh |
| Odor and/or flavor descriptions from others (if found). | |
Cosmetic Information:
| None found |
Suppliers:
| Parchem |
| 4-cyclohexyl cyclohexanone |
| Sigma-Aldrich: Aldrich |
| For experimental / research use only. |
| 4-Cyclohexylcyclohexanone |
Safety Information:
| Preferred SDS: View | |
| 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: | cosmetic and fragrance agents | ||
| IFRA Code of Practice Notification of the 49th Amendment to the IFRA Code of Practice | |||
| Recommendation for 4-cyclohexyl cyclohexanone usage levels up to: | |||
| 3.0000 % in the fragrance concentrate. | |||
| Recommendation for 4-cyclohexyl cyclohexanone 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): | 92-68-2 |
| EPA ACToR: | Toxicology Data |
| EPA Substance Registry Services (SRS): | Registry |
| Laboratory Chemical Safety Summary : | 41690 |
| National Institute of Allergy and Infectious Diseases: | Data |
| 4-cyclohexylcyclohexan-1-one | |
| Chemidplus: | 0000092682 |
References:
| 4-cyclohexylcyclohexan-1-one | |
| NIST Chemistry WebBook: | Search Inchi |
| Canada Domestic Sub. List: | 92-68-2 |
| Pubchem (cid): | 41690 |
| Pubchem (sid): | 135019736 |
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 |
| CHEMBL: | View |
| HMDB (The Human Metabolome Database): | Search |
| VCF-Online: | VCF Volatile Compounds in Food |
| ChemSpider: | View |
Potential Blenders and core components note
Potential Uses:
| cyclamen | FR | |
| floral | FR | |
| fresh and clean | FR | |
| herbal | FR | |
| orris | FR | |
| ozone | ||
| tobacco | FR | |
| woody | FR |
Occurrence (nature, food, other): note
| found in nature |
Synonyms:
| (1,1'- | bicyclohexyl)-4-one |
| p- | cyclohexyl cyclohexanone |
| para- | cyclohexyl cyclohexanone |
| 4- | cyclohexylcyclohexan-1-one |
| 4- | cyclohexylcyclohexanone |
| p- | cyclohexylcyclohexanone |
| para- | cyclohexylcyclohexanone |