![1-[2-Fluoro-6-(trifluoromethyl)benzyl]-5-iodo-6-methylpyrimidine-2,4(1H,3H)-dione](https://resource.bocsci.com/structure/1150560-54-5.gif)
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| IUPAC Name: | 1-[[2-fluoro-6-(trifluoromethyl)phenyl]methyl]-5-iodo-6-methylpyrimidine-2,4-dione |
| Description: | 1-[2-Fluoro-6-(trifluoromethyl)benzyl]-5-iodo-6-methylpyrimidine-2,4(1H,3H)-dione (CAS# 1150560-54-5) is an intermediate in the synthesis of Elagolix, a gonadotropin-releasing hormone antagonist (GnRH) used in the treatment of endometriosis. |
| Molecular Weight: | 428.12 |
| Molecular Formula: | C13H9F4IN2O2 |
| Canonical SMILES: | CC1=C(C(=O)NC(=O)N1CC2=C(C=CC=C2F)C(F)(F)F)I |
| InChI: | InChI=1S/C13H9F4IN2O2/c1-6-10(18)11(21)19-12(22)20(6)5-7-8(13(15,16)17)3-2-4-9(7)14/h2-4H,5H2,1H3,(H,19,21,22) |
| InChI Key: | TZBUKGISILNJCR-UHFFFAOYSA-N |
| Storage: | Keep in dark place, Sealed in dry, 2-8 °C |
| LogP: | 3.06810 |
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