basic_info |
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| Product_Name： | 4-正庚基苯甲酸-3-氟-4-氰基苯酯 |
| CAS： | 86776-54-7 |
| 中文同义词： | 4-正庚基苯甲酸-3-氟-4-氰基苯酯 |
| EnglishSynonyms： | 4-CYANO-3-FLUOROPHENYL-4-HEPTYLBENZOATE |
| pro_mdlNumber： | MFCD17019212 |
| pro_acceptors： | 3 |
| pro_donors： | 0 |
| pro_smile： | CCCCCCCc1ccc(cc1)C(=O)Oc2ccc(c(c2)F)C#N |
| InChi： | InChI=1S/C21H22FNO2/c1-2-3-4-5-6-7-16-8-10-17(11-9-16)21(24)25-19-13-12-18(15-23)20(22)14-19/h8-14H,2-7H2,1H3 |
| InChiKey： | InChIKey=BJTUQNRKEMWBHS-UHFFFAOYSA-N |
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