basic_info |
|
| Product_Name： | 己脒定 |
| CAS： | 3811-75-4 |
| 中文同义词： | 己脒定 |
| EnglishSynonyms： | HEXAMIDINE |
| pro_mdlNumber： | MFCD00866761 |
| pro_acceptors： | 6 |
| pro_donors： | 4 |
| pro_smile： | c1cc(ccc1C(=N)N)OCCCCCCOc2ccc(cc2)C(=N)N |
| InChi： | InChI=1S/C20H26N4O2/c21-19(22)15-5-9-17(10-6-15)25-13-3-1-2-4-14-26-18-11-7-16(8-12-18)20(23)24/h5-12H,1-4,13-14H2,(H3,21,22)(H3,23,24) |
| InChiKey： | InChIKey=OQLKNTOKMBVBKV-UHFFFAOYSA-N |
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