basic_info |
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Product_Name: | HE-CHEMICAL 47035 |
EnglishSynonyms: | HE-CHEMICAL 47035 |
pro_mdlNumber: | MFCD18404222 |
pro_acceptors: | 4 |
pro_donors: | 3 |
pro_smile: | c1cc(c(c(c1)F)F)c2cc3c(c[nH]c3c(c2)O)CC(=O)O |
InChi: | InChI=1S/C16H11F2NO3/c17-12-3-1-2-10(15(12)18)8-4-11-9(6-14(21)22)7-19-16(11)13(20)5-8/h1-5,7,19-20H,6H2,(H,21,22) |
InChiKey: | InChIKey=KQHJZEXGYRJPFS-UHFFFAOYSA-N |
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