basic_info |
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Product_Name: | 4-环己基-2-甲基-2-丁醇 |
CAS: | 84332-27-4 |
中文同义词: | 4-环己基-2-甲基-2-丁醇 |
EnglishSynonyms: | 5-PYRIMIDINECARBOXAMIDE, N-((1-BENZYL-2-PYRROLIDINYL)METHYL)-4-METHOXY-, DIHYDROCHLORIDE, HYDRATE |
pro_mdlNumber: | MFCD01689753 |
pro_acceptors: | 6 |
pro_donors: | 1 |
pro_smile: | COc1c(cncn1)C(=O)NCC2CCCN2Cc3ccccc3.O.Cl.Cl |
InChi: | InChI=1S/C18H22N4O2.2ClH.H2O/c1-24-18-16(11-19-13-21-18)17(23)20-10-15-8-5-9-22(15)12-14-6-3-2-4-7-14;;;/h2-4,6-7,11,13,15H,5,8-10,12H2,1H3,(H,20,23);2*1H;1H2 |
InChiKey: | InChIKey=IWZTVUIQOKVBHW-UHFFFAOYSA-N |
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