basic_info |
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| Product_Name： | 3-氰基苯硼酸 |
| CAS： | 1072946-04-3 |
| 中文同义词： | 3-氰基苯硼酸 |
| EnglishSynonyms： | (3-((3-CHLORO-4-FLUOROPHENYL)CARBAMOYL)PHENYL)BORONIC ACID ; N-(3-CHLORO-4-FLUOROPHENYL) 3-BORONOBENZAMIDE |
| pro_mdlNumber： | MFCD09972110 |
| pro_acceptors： | 4 |
| pro_donors： | 3 |
| pro_smile： | B(c1cccc(c1)C(=O)Nc2ccc(c(c2)Cl)F)(O)O |
| InChi： | InChI=1S/C13H10BClFNO3/c15-11-7-10(4-5-12(11)16)17-13(18)8-2-1-3-9(6-8)14(19)20/h1-7,19-20H,(H,17,18) |
| InChiKey： | InChIKey=RSMFAQCLGXKQAT-UHFFFAOYSA-N |
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