2-Butenoic acid, 3-methyl-, 3,7-dimethyl-6-octen-1-yl ester (CHEM058098)
| Record Information | |||||||||
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| Version | 1.0 | ||||||||
| Creation Date | 2026-03-31 21:39:46 UTC | ||||||||
| Update Date | 2026-05-20 16:27:46 UTC | ||||||||
| Accession Number | CHEM058098 | ||||||||
| Identification | |||||||||
| Common Name | 2-Butenoic acid, 3-methyl-, 3,7-dimethyl-6-octen-1-yl ester | ||||||||
| Class | Small Molecule | ||||||||
| Description | Not Available | ||||||||
| Contaminant Sources | Not Available | ||||||||
| Contaminant Type | Not Available | ||||||||
| Chemical Structure |  | ||||||||
| Synonyms | Not Available | ||||||||
| Chemical Formula | C15H26O2 | ||||||||
| Average Molecular Mass | 238.371 g/mol | ||||||||
| Monoisotopic Mass | 238.193 g/mol | ||||||||
| CAS Registry Number | 20770-40-5;57035-88-8;77750-02-8 | ||||||||
| IUPAC Name | 3,7-dimethyloct-6-enyl 3-methylbut-2-enoate | ||||||||
| Traditional Name | Not Available | ||||||||
| SMILES | CC(CCOC(=O)C=C(C)C)CCC=C(C)C | ||||||||
| InChI Identifier | InChI=1S/C15H26O2/c1-12(2)7-6-8-14(5)9-10-17-15(16)11-13(3)4/h7,11,14H,6,8-10H2,1-5H3 | ||||||||
| InChI Key | DCEUMOZSMAUPSP-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 | |||||||||
| External Links | |||||||||
| Identifiers | Not Available | ||||||||
| References | |||||||||
| Synthesis Reference | Not Available | ||||||||
| MSDS | Not Available | ||||||||
| General References | Not Available | ||||||||
