2-[[(1-Oxoheptyl)oxy]methyl]-2-[[(1-oxohexyl)oxy]methyl]propane-1,3-diyl dioctanoate (CHEM098891)
| Record Information | |||||||||
|---|---|---|---|---|---|---|---|---|---|
| Version | 1.0 | ||||||||
| Creation Date | 2026-04-05 10:11:17 UTC | ||||||||
| Update Date | 2026-04-05 10:11:17 UTC | ||||||||
| Accession Number | CHEM098891 | ||||||||
| Identification | |||||||||
| Common Name | 2-[[(1-Oxoheptyl)oxy]methyl]-2-[[(1-oxohexyl)oxy]methyl]propane-1,3-diyl dioctanoate | ||||||||
| Class | Small Molecule | ||||||||
| Description | 2-[[(1-Oxoheptyl)oxy]methyl]-2-[[(1-oxohexyl)oxy]methyl]propane-1,3-diyl dioctanoate belongs to the tetracarboxylic acids and derivatives, a subclass of carboxylic acids and derivatives within the organic compounds. With an average molecular weight of 598.86 g/mol, 2-[[(1-Oxoheptyl)oxy]methyl]-2-[[(1-oxohexyl)oxy]methyl]propane-1,3-diyl dioctanoate is a heavy molecule. Its chemical formula is C34H62O8. | ||||||||
| Contaminant Sources | Not Available | ||||||||
| Contaminant Type | Not Available | ||||||||
| Chemical Structure |  | ||||||||
| Synonyms | Not Available | ||||||||
| Chemical Formula | C34H62O8 | ||||||||
| Average Molecular Mass | 598.862 g/mol | ||||||||
| Monoisotopic Mass | 598.444 g/mol | ||||||||
| CAS Registry Number | 94278-16-7 | ||||||||
| IUPAC Name | Not Available | ||||||||
| Traditional Name | Not Available | ||||||||
| SMILES | CCCCCCCC(=O)OCC(COC(=O)CCCCC)(COC(=O)CCCCCC)COC(=O)CCCCCCC | ||||||||
| InChI Identifier | InChI=1/C34H62O8/c1-5-9-13-16-20-24-32(37)41-28-34(26-39-30(35)22-18-12-8-4,27-40-31(36)23-19-15-11-7-3)29-42-33(38)25-21-17-14-10-6-2/h5-29H2,1-4H3 | ||||||||
| InChI Key | VPBRIDYBYLKMLY-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 | ||||||||
