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| IUPAC Name: | (2-hydroxy-4-prop-2-enylphenyl) methanesulfonate |
| Description: | 4-(2-Propen-1-yl)-1,2-benzenediol 1-Methanesulfonate is an intermediate in the synthesis of Eugenol (E935640), a dental compound which shows cytotoxicity to human oral squamous cell carcinoma and oral cells. When glucosylated, this compound exhibits anti-inflammatory activity. |
| Molecular Weight: | 228.26 |
| Molecular Formula: | C10H12O4S |
| Canonical SMILES: | CS(=O)(=O)OC1=C(C=C(C=C1)CC=C)O |
| InChI: | InChI=1S/C10H12O4S/c1-3-4-8-5-6-10(9(11)7-8)14-15(2,12)13/h3,5-7,11H,1,4H2,2H3 |
| InChI Key: | DGBFOOSPOYZMIZ-UHFFFAOYSA-N |
| Solubility: | Chloroform, DCM, Diethyl Ether, Ethyl Acetate, Methanol, THF |
| Appearance: | Off-White Solid |
| Storage: | Refrigerator, under inert atmosphere |
| References: | Koh, T. et al. In Vivo, 27, 85 (2013); Zhang, P. et al. Arch. Pharm. Res., 36, 109 (2013). |
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