basic_info |
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Product_Name: | 4-(4-METHYL-2-NITROPHENOXY)PENTANOIC ACID |
EnglishSynonyms: | 4-(4-METHYL-2-NITROPHENOXY)PENTANOIC ACID |
pro_mdlNumber: | MFCD17453717 |
pro_acceptors: | 6 |
pro_donors: | 1 |
pro_smile: | Cc1ccc(c(c1)[N+](=O)[O-])OC(C)CCC(=O)O |
InChi: | InChI=1S/C12H15NO5/c1-8-3-5-11(10(7-8)13(16)17)18-9(2)4-6-12(14)15/h3,5,7,9H,4,6H2,1-2H3,(H,14,15) |
InChiKey: | InChIKey=CTYACXMIMFSGID-UHFFFAOYSA-N |
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