4-(2,4,6-Trimethyl-3-cyclohexen-1-yl)-3-buten-2-one (CHEM058372)
| Record Information | |||||||||
|---|---|---|---|---|---|---|---|---|---|
| Version | 1.0 | ||||||||
| Creation Date | 2026-03-31 22:10:28 UTC | ||||||||
| Update Date | 2026-05-20 16:46:58 UTC | ||||||||
| Accession Number | CHEM058372 | ||||||||
| Identification | |||||||||
| Common Name | 4-(2,4,6-Trimethyl-3-cyclohexen-1-yl)-3-buten-2-one | ||||||||
| Class | Small Molecule | ||||||||
| Description | Not Available | ||||||||
| Contaminant Sources | Not Available | ||||||||
| Contaminant Type | Not Available | ||||||||
| Chemical Structure |  | ||||||||
| Synonyms | Not Available | ||||||||
| Chemical Formula | C13H20O1 | ||||||||
| Average Molecular Mass | 192.302 g/mol | ||||||||
| Monoisotopic Mass | 192.151 g/mol | ||||||||
| CAS Registry Number | 67801-38-1 | ||||||||
| IUPAC Name | 4-(2,4,6-Trimethylcyclohex-3-en-1-yl)but-3-en-2-one | ||||||||
| Traditional Name | Not Available | ||||||||
| SMILES | CC1CC(C)=CC(C)C1C=CC(C)=O | ||||||||
| InChI Identifier | InChI=1S/C13H20O/c1-9-7-10(2)13(11(3)8-9)6-5-12(4)14/h5-7,10-11,13H,8H2,1-4H3/b6-5+ | ||||||||
| InChI Key | FETSKTIMHFKZNF-AATRIKPKSA-N | ||||||||
| Chemical Taxonomy | |||||||||
| Classification | Not classified | ||||||||
| Biological Properties | |||||||||
| Status | Detected and Not Quantified | ||||||||
| Origin | Not Available | ||||||||
| Cellular Locations | Not Available | ||||||||
| Biofluid Locations | Not Available | ||||||||
| Tissue Locations | Not Available | ||||||||
| Pathways | Not Available | ||||||||
| Applications | Not Available | ||||||||
| Biological Roles | Not Available | ||||||||
| Chemical Roles | Not Available | ||||||||
| Physical Properties | |||||||||
| State | Not Available | ||||||||
| Appearance | Not Available | ||||||||
| Experimental Properties |
| ||||||||
| Predicted Properties | Not Available | ||||||||
| Spectra | |||||||||
| Spectra |
| ||||||||
| Toxicity Profile | |||||||||
| Route of Exposure | Not Available | ||||||||
| Mechanism of Toxicity | Not Available | ||||||||
| Metabolism | Not Available | ||||||||
| Toxicity Values | Not Available | ||||||||
| Lethal Dose | Not Available | ||||||||
| Carcinogenicity (IARC Classification) | Not Available | ||||||||
| Uses/Sources | Not Available | ||||||||
| Minimum Risk Level | Not Available | ||||||||
| Health Effects | Not Available | ||||||||
| Symptoms | Not Available | ||||||||
| Treatment | Not Available | ||||||||
| Concentrations | |||||||||
| Not Available | |||||||||
| External Links | |||||||||
| Identifiers | Not Available | ||||||||
| References | |||||||||
| Synthesis Reference | Not Available | ||||||||
| MSDS | Not Available | ||||||||
| General References | Not Available | ||||||||
