basic_info |
|
| Product_Name： | HE-CHEMICAL 47031 |
| EnglishSynonyms： | HE-CHEMICAL 47031 |
| pro_mdlNumber： | MFCD18404218 |
| pro_acceptors： | 4 |
| pro_donors： | 3 |
| pro_smile： | c1cc(c(c(c1)F)F)c2cc(cc3c2c(c[nH]3)CC(=O)O)O |
| InChi： | InChI=1S/C16H11F2NO3/c17-12-3-1-2-10(16(12)18)11-5-9(20)6-13-15(11)8(7-19-13)4-14(21)22/h1-3,5-7,19-20H,4H2,(H,21,22) |
| InChiKey： | InChIKey=ZJPQINFMGSXNOI-UHFFFAOYSA-N |
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