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| IUPAC Name: | 1-(2-hydroxy-3-propyl-4-sulfanylphenyl)ethanone |
| Description: | 1-(2-Hydroxy-4-mercapto-3-propylphenyl)ethanone is an intermediate in the synthesis of Tipelukast-d6 (T444872), the labeled analogue of Tipelukast, a novel oral anti-inflammatory agent, suppresses bladder hyperactivity in a rat model. |
| Molecular Weight: | 210.29 |
| Molecular Formula: | C11H14O2S |
| Canonical SMILES: | CCCC1=C(C=CC(=C1O)C(=O)C)S |
| InChI: | InChI=1S/C11H14O2S/c1-3-4-9-10(14)6-5-8(7(2)12)11(9)13/h5-6,13-14H,3-4H2,1-2H3 |
| InChI Key: | MTPPIDLUKJRAPM-UHFFFAOYSA-N |
| Melting Point: | >51°C (dec.) |
| Solubility: | Chloroform (Slightly), Methanol (Slightly) |
| Appearance: | Light Yellow Solid |
| Storage: | Hygroscopic, Refrigerator, under inert atmosphere |
| References: | Rajasekaran, M., et. al. BJU Int., 98, 430 (2006). |
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