basic_info |
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| Product_Name: | 1H-1,2,4-TRIAZOLE-3-CARBOXYLIC ACID, 1-[2-(2-FLUORO-4-METHYLPHENYL)-2-OXOETHYL], METHYL ESTER |
| CAS: | 885945-87-9 |
| EnglishSynonyms: | METHYL 1-(2-(2-FLUORO-4-METHYLPHENYL)-2-OXOETHYL)-1H-1,2,4-TRIAZOLE-3-CARBOXYLATE ; 1H-1,2,4-TRIAZOLE-3-CARBOXYLIC ACID, 1-[2-(2-FLUORO-4-METHYLPHENYL)-2-OXOETHYL], METHYL ESTER |
| pro_mdlNumber: | MFCD13191569 |
| pro_acceptors: | 6 |
| pro_donors: | 0 |
| pro_smile: | Cc1ccc(c(c1)F)C(=O)Cn2cnc(n2)C(=O)OC |
| InChi: | InChI=1S/C13H12FN3O3/c1-8-3-4-9(10(14)5-8)11(18)6-17-7-15-12(16-17)13(19)20-2/h3-5,7H,6H2,1-2H3 |
| InChiKey: | InChIKey=ODLBXCXHCXURJV-UHFFFAOYSA-N |
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