
19053-94-2
| Name | 2-Acetyl-3,5-dihydroxyphenylacetic acid |
| CAS | 19053-94-2 |
| Molecular Formula | C10H10O5 |
| MDL Number | MFCD24393722 |
| Molecular Weight | 210.18 |
| MOL File | 19053-94-2.mol |
Chemical Properties
| Boiling point | 466.4±24.0 °C(Predicted) |
| density | 1.446±0.06 g/cm3(Predicted) |
| storage temp. | -20°C |
| solubility | DMSO: soluble; Methanol: soluble |
| form | A solid |
| pka | 3.96±0.10(Predicted) |
| Major Application | metabolomics vitamins, nutraceuticals, and natural products |
| InChI | 1S/C10H10O5/c1-5(11)10-6(3-9(14)15)2-7(12)4-8(10)13/h2,4,12-13H,3H2,1H3,(H,14,15) |
| InChIKey | JAHPPWGWEUVLMS-UHFFFAOYSA-N |
| SMILES | O=C(C1=C(C=C(C=C1O)O)CC(O)=O)C |