basic_info |
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| Product_Name: | 2,5-CYCLOHEXADIENE-1,4-DIONE, 2-HYDROXY-5,6-DIMETHYL-3-(3-OXOBUTYL)- |
| CAS: | 502182-47-0 |
| EnglishSynonyms: | 2-HYDROXY-5,6-DIMETHYL-3-(3-OXOBUTYL)-2,5-CYCLOHEXADIENE-1,4-DIONE ; 2,5-CYCLOHEXADIENE-1,4-DIONE, 2-HYDROXY-5,6-DIMETHYL-3-(3-OXOBUTYL)- |
| pro_mdlNumber: | MFCD18812480 |
| pro_acceptors: | 4 |
| pro_donors: | 1 |
| pro_smile: | CC1=C(C(=O)C(=C(C1=O)CCC(=O)C)O)C |
| InChi: | InChI=1S/C12H14O4/c1-6(13)4-5-9-10(14)7(2)8(3)11(15)12(9)16/h16H,4-5H2,1-3H3 |
| InChiKey: | InChIKey=WXZYOLICYYVCEM-UHFFFAOYSA-N |
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