basic_info |
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| Product_Name: | 2(3H)-ISOTHIAZOLEACETIC ACID, ALPHA-METHYL-, METHYL ESTER, 1,1-DIOXIDE, (ALPHAS) |
| CAS: | 515130-03-7 |
| EnglishSynonyms: | 2(3H)-ISOTHIAZOLEACETIC ACID, ALPHA-METHYL-, METHYL ESTER, 1,1-DIOXIDE, (ALPHAS) |
| pro_mdlNumber: | MFCD08460300 |
| pro_acceptors: | 5 |
| pro_donors: | 0 |
| pro_smile: | C[C@@H](C(=O)OC)N1CC=CS1(=O)=O |
| InChi: | InChI=1S/C7H11NO4S/c1-6(7(9)12-2)8-4-3-5-13(8,10)11/h3,5-6H,4H2,1-2H3/t6-/m0/s1 |
| InChiKey: | InChIKey=XEHGECHCFAZGQM-LURJTMIESA-N |
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