LBF08000OX02
From Metabolomics.JP
Upper classes
| IDs and Links | |
|---|---|
| LipidBank | DFA0401 |
| LipidMaps | LMFA01060017 |
| CAS | |
| KEGG | {{{KEGG}}} |
| KNApSAcK | |
| CDX file | |
| MOL file | LBF08000OX02.mol |
| 3-Keto-n-caprylic acid | |
|---|---|
| |
| Structural Information | |
| Systematic Name | 3-Oxooctanoic acid |
| Common Name |
|
| Symbol | |
| Formula | C8H14O3 |
| Exact Mass | 158.094294314 |
| Average Mass | 158.19495999999998 |
| SMILES | CCCCCC(=O)CC(O)=O |
| Physicochemical Information | |
| Melting Point | 74 °C ( Decomposes to 2-heptanone / methyl valeryl ketone. ) |
| Boiling Point | |
| Density | |
| Optical Rotation | |
| Reflactive Index | |
| Solubility | soluble in water, most organic solvents; insoluble in petroleum ether <<0186>> |
| Spectral Information | |
| Mass Spectra | |
| UV Spectra | |
| IR Spectra | |
| NMR Spectra | |
| Chromatograms | |
