basic_info |
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| Product_Name: | 1H-1,2,4-TRIAZOLE-3-CARBOXYLIC ACID, 1-(4-METHYLPHENYL), METHYL ESTER |
| CAS: | 57226-97-8 |
| EnglishSynonyms: | 1H-1,2,4-TRIAZOLE-3-CARBOXYLIC ACID, 1-(4-METHYLPHENYL), METHYL ESTER ; METHYL 1-P-TOLYL-1H-1,2,4-TRIAZOLE-3-CARBOXYLATE |
| pro_mdlNumber: | MFCD13191559 |
| pro_acceptors: | 5 |
| pro_donors: | 0 |
| pro_smile: | Cc1ccc(cc1)n2cnc(n2)C(=O)OC |
| InChi: | InChI=1S/C11H11N3O2/c1-8-3-5-9(6-4-8)14-7-12-10(13-14)11(15)16-2/h3-7H,1-2H3 |
| InChiKey: | InChIKey=ZFWUUQCFBQKRED-UHFFFAOYSA-N |
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