basic_info |
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| Product_Name: | 2-[3,5-DIMETHYL-1-(PENTAN-3-YL)-1H-PYRAZOL-4-YL]PROPANOIC ACID |
| EnglishSynonyms: | 2-[3,5-DIMETHYL-1-(PENTAN-3-YL)-1H-PYRAZOL-4-YL]PROPANOIC ACID |
| pro_mdlNumber: | MFCD17436679 |
| pro_acceptors: | 4 |
| pro_donors: | 1 |
| pro_smile: | CCC(CC)n1c(c(c(n1)C)C(C)C(=O)O)C |
| InChi: | InChI=1S/C13H22N2O2/c1-6-11(7-2)15-10(5)12(9(4)14-15)8(3)13(16)17/h8,11H,6-7H2,1-5H3,(H,16,17) |
| InChiKey: | InChIKey=VJDKZPCFWVKYCR-UHFFFAOYSA-N |
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