9-Octadecenoic acid (9Z)-, 2-mercaptoethyl ester (CHEM012940)
| Record Information | |||||||||
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| Version | 1.0 | ||||||||
| Creation Date | 2016-05-19 04:04:41 UTC | ||||||||
| Update Date | 2026-08-20 06:59:35 UTC | ||||||||
| Accession Number | CHEM012940 | ||||||||
| Identification | |||||||||
| Common Name | 9-Octadecenoic acid (9Z)-, 2-mercaptoethyl ester | ||||||||
| Class | Small Molecule | ||||||||
| Description | 9-Octadecenoic acid (9Z)-, 2-mercaptoethyl ester belongs to the fatty acid esters, a subclass of fatty acyls within the organic compounds. It is classified under the superclass of lipids and lipid-like molecules. The compound has the formula C20H38O2S and an average molecular weight of 342.60 g/mol. | ||||||||
| Contaminant Sources |
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| Contaminant Type | Not Available | ||||||||
| Chemical Structure |  | ||||||||
| Synonyms | Not Available | ||||||||
| Chemical Formula | C20H38O2S | ||||||||
| Average Molecular Mass | 342.600 g/mol | ||||||||
| Monoisotopic Mass | 342.259 g/mol | ||||||||
| CAS Registry Number | 59118-78-4 | ||||||||
| IUPAC Name | 2-sulfanylethyl (Z)-octadec-9-enoate | ||||||||
| Traditional Name | Not Available | ||||||||
| SMILES | CCCCCCCCC=CCCCCCCCC(=O)OCCS | ||||||||
| InChI Identifier | InChI=1S/C20H38O2S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20(21)22-18-19-23/h9-10,23H,2-8,11-19H2,1H3/b10-9- | ||||||||
| InChI Key | WEMJWKKJHSZRQT-KTKRTIGZSA-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 | ||||||||
