basic_info |
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| Product_Name: | 4-BROMO-3,5-DINITROBENZOIC ACID METHYL ESTER |
| CAS: | 23938-86-5 |
| EnglishSynonyms: | 4-BROMO-3,5-DINITROBENZOIC ACID METHYL ESTER ; METHYL 4-BROMO-3,5-DINITROBENZOATE |
| pro_mdlNumber: | MFCD00688169 |
| pro_acceptors: | 8 |
| pro_donors: | 0 |
| pro_smile: | COC(=O)c1cc(c(c(c1)[N+](=O)[O-])Br)[N+](=O)[O-] |
| InChi: | InChI=1S/C8H5BrN2O6/c1-17-8(12)4-2-5(10(13)14)7(9)6(3-4)11(15)16/h2-3H,1H3 |
| InChiKey: | InChIKey=ACAXUEJPCRJXRJ-UHFFFAOYSA-N |
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