3,7-Dimethyloct-1-en-3-yl acetate (CHEM093583)
| Record Information | |||||||||
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| Version | 1.0 | ||||||||
| Creation Date | 2026-04-05 05:26:09 UTC | ||||||||
| Update Date | 2026-08-18 20:43:49 UTC | ||||||||
| Accession Number | CHEM093583 | ||||||||
| Identification | |||||||||
| Common Name | 3,7-Dimethyloct-1-en-3-yl acetate | ||||||||
| Class | Small Molecule | ||||||||
| Description | 3,7-Dimethyloct-1-en-3-yl acetate belongs to the carboxylic acid derivatives, a subclass of carboxylic acids and derivatives within the organic compounds. This compound has the formula C12H22O2 and an average molecular weight of 198.31 g/mol. It is further classified under the superclass of organic acids and derivatives. | ||||||||
| Contaminant Sources | Not Available | ||||||||
| Contaminant Type | Not Available | ||||||||
| Chemical Structure |  | ||||||||
| Synonyms | Not Available | ||||||||
| Chemical Formula | C12H22O2 | ||||||||
| Average Molecular Mass | 198.306 g/mol | ||||||||
| Monoisotopic Mass | 198.162 g/mol | ||||||||
| CAS Registry Number | 68345-17-5 | ||||||||
| IUPAC Name | 3,7-dimethyloct-1-en-3-yl acetate | ||||||||
| Traditional Name | Not Available | ||||||||
| SMILES | CC(C)CCCC(C)(OC(C)=O)C=C | ||||||||
| InChI Identifier | InChI=1/C12H22O2/c1-6-12(5,14-11(4)13)9-7-8-10(2)3/h6,10H,1,7-9H2,2-5H3 | ||||||||
| InChI Key | DMSMQGBPJBKXNU-UHFFFAOYSA-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 |
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| Predicted Properties | Not Available | ||||||||
| Spectra | |||||||||
| Spectra |
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| 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 | |||||||||
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| Identifiers | Not Available | ||||||||
| References | |||||||||
| Synthesis Reference | Not Available | ||||||||
| MSDS | Not Available | ||||||||
| General References | Not Available | ||||||||
