basic_info |
|
| Product_Name： | BENZETHONIUM HYDROXIDE |
| CAS： | 498-77-1 |
| EnglishSynonyms： | BENZETHONIUM HYDROXIDE |
| pro_mdlNumber： | MFCD00133119 |
| pro_acceptors： | 3 |
| pro_donors： | 0 |
| pro_smile： | CC(C)(C)CC(C)(C)c1ccc(cc1)OCCOCC[N+](C)(C)Cc2ccccc2 |
| InChi： | InChI=1S/C27H42NO2/c1-26(2,3)22-27(4,5)24-13-15-25(16-14-24)30-20-19-29-18-17-28(6,7)21-23-11-9-8-10-12-23/h8-16H,17-22H2,1-7H3/q+1 |
| InChiKey： | InChIKey=SIYLLGKDQZGJHK-UHFFFAOYSA-N |
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