Pro_Molecular_Structure:
pro_cdbregno:CCD03262616
5-(2,5-DIMETHYLPHENYL)-4-METHYLISOTHIAZOL-3(2H)-ONE 1,1-DIOXIDE
pro_formula:C12 H13 N O3 S
pro_molWeight:251.305
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| Product_Name： | 5-(2,5-DIMETHYLPHENYL)-4-METHYLISOTHIAZOL-3(2H)-ONE 1,1-DIOXIDE |
| EnglishSynonyms： | 5-(2,5-DIMETHYLPHENYL)-4-METHYLISOTHIAZOL-3(2H)-ONE 1,1-DIOXIDE |
| pro_mdlNumber： | MFCD16990903 |
| pro_acceptors： | 4 |
| pro_donors： | 1 |
| pro_smile： | Cc1ccc(c(c1)C2=C(C(=O)NS2(=O)=O)C)C |
| InChi： | InChI=1S/C12H13NO3S/c1-7-4-5-8(2)10(6-7)11-9(3)12(14)13-17(11,15)16/h4-6H,1-3H3,(H,13,14) |
| InChiKey： | InChIKey=RVIKHRBVNYCDMF-UHFFFAOYSA-N |
basic_info
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