basic_info |
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| Product_Name： | 3-AMINO-4-METHYL-5-NITRO-BENZOIC ACID |
| CAS： | 54591-62-7 |
| EnglishSynonyms： | BENZOIC ACID, 3-AMINO-4-METHYL-5-NITRO- ; 5-AMINO-4-METHYL-3-NITROBENZOIC ACID ; 3-AMINO-4-METHYL-5-NITRO-BENZOIC ACID |
| pro_mdlNumber： | MFCD00456404 |
| pro_acceptors： | 6 |
| pro_donors： | 2 |
| pro_smile： | Cc1c(cc(cc1[N+](=O)[O-])C(=O)O)N |
| InChi： | InChI=1S/C8H8N2O4/c1-4-6(9)2-5(8(11)12)3-7(4)10(13)14/h2-3H,9H2,1H3,(H,11,12) |
| InChiKey： | InChIKey=LHZXZCIDEFEXPM-UHFFFAOYSA-N |
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