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| IUPAC Name: | 2-methylsulfanylpyrimidine-4-carboxylic acid |
| Description: | 2-Thiomethylpyrimidine-4-carboxylic Acid was a useful reagent in development of orally bioavailable bicyclic pyrazolones as inhibitors of tumor necrosis factor. |
| Molecular Weight: | 170.19 |
| Molecular Formula: | C6H6N2O2S |
| Canonical SMILES: | CSC1=NC=CC(=N1)C(=O)O |
| InChI: | InChI=1S/C6H6N2O2S/c1-11-6-7-3-2-4(8-6)5(9)10/h2-3H,1H3,(H,9,10) |
| InChI Key: | IAGNLKODEFUQDV-UHFFFAOYSA-N |
| Boiling Point: | 378.4 ℃ at 760 mmHg |
| Density: | 1.45 g/cm3 |
| Storage: | Keep in dark place, Inert atmosphere, Room temperature |
| MDL: | MFCD09834808 |
| LogP: | 0.89670 |
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