Propanedioic acid, diethyl-, diethyl ester (CHEM075112)
| Record Information | |||||||||
|---|---|---|---|---|---|---|---|---|---|
| Version | 1.0 | ||||||||
| Creation Date | 2026-04-04 13:55:01 UTC | ||||||||
| Update Date | 2026-08-18 13:13:13 UTC | ||||||||
| Accession Number | CHEM075112 | ||||||||
| Identification | |||||||||
| Common Name | Propanedioic acid, diethyl-, diethyl ester | ||||||||
| Class | Small Molecule | ||||||||
| Description | Propanedioic acid, diethyl-, diethyl 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 C11H20O4 and an average molecular weight of 216.28 g/mol. | ||||||||
| Contaminant Sources | Not Available | ||||||||
| Contaminant Type | Not Available | ||||||||
| Chemical Structure |  | ||||||||
| Synonyms | Not Available | ||||||||
| Chemical Formula | C11H20O4 | ||||||||
| Average Molecular Mass | 216.277 g/mol | ||||||||
| Monoisotopic Mass | 216.136 g/mol | ||||||||
| CAS Registry Number | 77-25-8 | ||||||||
| IUPAC Name | diethyl 2,2-diethylpropanedioate | ||||||||
| Traditional Name | Not Available | ||||||||
| SMILES | CCOC(=O)C(CC)(CC)C(=O)OCC | ||||||||
| InChI Identifier | InChI=1S/C11H20O4/c1-5-11(6-2,9(12)14-7-3)10(13)15-8-4/h5-8H2,1-4H3 | ||||||||
| InChI Key | ZKBBUZRGPULIRN-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 |
| ||||||||
| 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 | ||||||||
