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| IUPAC Name: | 3-hydroxy-3-(4-hydroxyphenyl)propanoic acid |
| Description: | β,4-Dihydroxybenzenepropanoic Acid was used as an analyte for comparative metabolite profiling of carboxylic acids in rat urine. |
| Molecular Weight: | 182.17 |
| Molecular Formula: | C9H10O4 |
| Canonical SMILES: | C1=CC(=CC=C1C(CC(=O)O)O)O |
| InChI: | InChI=1S/C9H10O4/c10-7-3-1-6(2-4-7)8(11)5-9(12)13/h1-4,8,10-11H,5H2,(H,12,13) |
| InChI Key: | AKWHTKRUNUYXDS-UHFFFAOYSA-N |
| Melting Point: | 109-112°C |
| Solubility: | DMSO (Slightly), Methanol (Slightly) |
| Appearance: | White Solid |
| Storage: | -20°C Freezer |
| References: | Yang, W., et al. Electrophoresis, 29, 4549 (2008). |
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