basic_info |
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| Product_Name： | 2-((2,4,6-TRINITROPHENYL)THIO)ETHANOL |
| CAS： | 55548-91-9 |
| EnglishSynonyms： | 2-((2,4,6-TRINITROPHENYL)THIO)ETHANOL |
| pro_mdlNumber： | MFCD00437111 |
| pro_acceptors： | 10 |
| pro_donors： | 1 |
| pro_smile： | c1c(cc(c(c1[N+](=O)[O-])SCCO)[N+](=O)[O-])[N+](=O)[O-] |
| InChi： | InChI=1S/C8H7N3O7S/c12-1-2-19-8-6(10(15)16)3-5(9(13)14)4-7(8)11(17)18/h3-4,12H,1-2H2 |
| InChiKey： | InChIKey=ZJTJZEBQOQZCTI-UHFFFAOYSA-N |
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