basic_info |
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| Product_Name： | 2-(P-BROMOPHENYL)-2-NITRO-1,3-PROPANEDIOL |
| CAS： | 90561-94-7 |
| EnglishSynonyms： | 2-(4-BROMOPHENYL)-2-NITROPROPANE-1,3-DIOL ; 2-(P-BROMOPHENYL)-2-NITRO-1,3-PROPANEDIOL |
| pro_mdlNumber： | MFCD00218498 |
| pro_acceptors： | 5 |
| pro_donors： | 2 |
| pro_smile： | c1cc(ccc1C(CO)(CO)[N+](=O)[O-])Br |
| InChi： | InChI=1S/C9H10BrNO4/c10-8-3-1-7(2-4-8)9(5-12,6-13)11(14)15/h1-4,12-13H,5-6H2 |
| InChiKey： | InChIKey=NUDNCFJMKHVXDX-UHFFFAOYSA-N |
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