Articles:
(1alpha,2alpha,5beta)-5-methyl-2-(1-methyl ethyl) cyclohexanol acetate
Notes:
None found
| CAS Number: | 2230-87-7 |  3D/inchi
|
| ECHA EINECS - REACH Pre-Reg: | 218-767-7 | |
| FDA UNII: | Search | |
| Nikkaji Web: | J156.147B | |
| XlogP3-AA: | 3.60 (est) | |
| Molecular Weight: | 198.30574000 | |
| Formula: | C12 H22 O2 | |
| BioActivity Summary: | listing | |
| NMR Predictor: | Predict (works with chrome, Edge or firefox) | |
Category: natural substances and extractives
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:
| Appearance: | colorless to pale yellow clear liquid (est) |
| Assay: | 95.00 to 100.00 % |
| Food Chemicals Codex Listed: | No |
| Boiling Point: | 229.00 to 230.00 °C. @ 760.00 mm Hg (est) |
| Vapor Pressure: | 0.071000 mmHg @ 25.00 °C. (est) |
| Flash Point: | 198.00 °F. TCC ( 92.20 °C. ) (est) |
| logP (o/w): | 4.182 (est) |
| Soluble in: | |
| alcohol | |
| water, 17.13 mg/L @ 25 °C (est) | |
| Insoluble in: | |
| water | |
Organoleptic Properties:
| 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: | natural substances and extractives | ||
| Recommendation for neomenthyl acetate usage levels up to: | |||
| not for fragrance use. | |||
| Recommendation for neomenthyl 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 : | 27867 |
| National Institute of Allergy and Infectious Diseases: | Data |
| WGK Germany: | 2 |
| (5-methyl-2-propan-2-ylcyclohexyl) acetate | |
| Chemidplus: | 0002230877 |
References:
| (5-methyl-2-propan-2-ylcyclohexyl) acetate | |
| NIST Chemistry WebBook: | Search Inchi |
| Canada Domestic Sub. List: | 2230-87-7 |
| Pubchem (cid): | 27867 |
| Pubchem (sid): | 135057667 |
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 |
| Typical G.C. | |
| VCF-Online: | VCF Volatile Compounds in Food |
| ChemSpider: | View |
| Wikipedia: | View |
| Formulations/Preparations: grade: 95% min. l-isomer | |
Potential Blenders and core components note
| None Found | ||
Potential Uses:
| None Found |
Occurrence (nature, food, other): note
| cornmint oil india @ 0.12% Data GC Search Trop Picture | |
| pennyroyal oil @ trace% Data GC Search Trop Picture | |
| pennyroyal oil cuba @ 0.28% Data GC Search Trop Picture | |
| peppermint oil CO2 extract @ 0.20% Data GC Search Trop Picture |
Synonyms:
| (1alpha,2alpha,5beta)-5- | methyl-2-(1-methyl ethyl) cyclohexanol acetate |
| (5- | methyl-2-propan-2-ylcyclohexyl) acetate |