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| IUPAC Name: | 4-propan-2-ylbenzenethiol |
| Description: | 4-Isopropylbenzenethiol (CAS# 4946-14-9) is a useful synthetic intermediate. It is used as a reagent to synthesize various inhibitors such as cyclooxygenase (cyclooxygenase-2, COX-2) inhibitors, HMG CoA reductase inhibitors, and MEK1 inhibitors. |
| Molecular Weight: | 152.26 |
| Molecular Formula: | C9H12S |
| Canonical SMILES: | CC(C)C1=CC=C(C=C1)S |
| InChI: | InChI=1S/C9H12S/c1-7(2)8-3-5-9(10)6-4-8/h3-7,10H,1-2H3 |
| InChI Key: | APDUDRFJNCIWAG-UHFFFAOYSA-N |
| Boiling Point: | 99 ℃ (14 torr) |
| Purity: | 95 % |
| Density: | 0.979 g/mL at 25 ℃ (lit.) |
| Appearance: | Transparent liquid. |
| Storage: | Refrigerator |
| MDL: | MFCD00041505 |
| LogP: | 3.09870 |
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Sulfur Compounds
3-(1,3-Dimethylpyrazol-4-yl)-5-[(1-methylpyrazol-4-yl)methylidene]-2-sulfanylideneimidazolidin-4-one
5-[(5-Methyl-1H-pyrazol-1-yl)methyl]-4-(tetrahydrofuran-2-ylmethyl)-4H-1,2,4-triazole-3-thiol
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