basic_info |
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| Product_Name: | 6-AMINO-HEXANOIC ACID BENZYL ESTER, COMPOUND WITH TOLUENE-4-SULFONIC ACID |
| CAS: | 5514-99-8 |
| EnglishSynonyms: | 6-AMINO-HEXANOIC ACID BENZYL ESTER, COMPOUND WITH TOLUENE-4-SULFONIC ACID |
| pro_mdlNumber: | MFCD00187200 |
| pro_acceptors: | 3 |
| pro_donors: | 1 |
| pro_smile: | Cc1ccc(cc1)S(=O)(=O)O.c1ccc(cc1)COC(=O)CCCCCN |
| InChi: | InChI=1S/C13H19NO2.C7H8O3S/c14-10-6-2-5-9-13(15)16-11-12-7-3-1-4-8-12;1-6-2-4-7(5-3-6)11(8,9)10/h1,3-4,7-8H,2,5-6,9-11,14H2;2-5H,1H3,(H,8,9,10) |
| InChiKey: | InChIKey=LYALXYNFZAQLQW-UHFFFAOYSA-N |
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