basic_info |
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| Product_Name: | 4-ACETYL-5-FORMYL-3-METHYL-1H-PYRROLE-2-CARBOXYLIC ACID |
| CAS: | 33548-75-3 |
| EnglishSynonyms: | 4-ACETYL-5-FORMYL-3-METHYL-1H-PYRROLE-2-CARBOXYLIC ACID ; 4-ACETYL-5-FORMYL-3-METHYL-PYRROLE-2-CARBOXYLIC ACID |
| pro_mdlNumber: | MFCD18427159 |
| pro_acceptors: | 5 |
| pro_donors: | 2 |
| pro_smile: | Cc1c(c([nH]c1C(=O)O)C=O)C(=O)C |
| InChi: | InChI=1S/C9H9NO4/c1-4-7(5(2)12)6(3-11)10-8(4)9(13)14/h3,10H,1-2H3,(H,13,14) |
| InChiKey: | InChIKey=XWYIPJLIAUWYCW-UHFFFAOYSA-N |
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