basic_info |
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| Product_Name： | 3-(BROMOMETHYL)-5-NITRO-BENZOIC ACID METHYL ESTER |
| CAS： | 597563-44-5 |
| EnglishSynonyms： | BENZOIC ACID, 3-(BROMOMETHYL)-5-NITRO-, METHYL ESTER ; 3-(BROMOMETHYL)-5-NITRO-BENZOIC ACID METHYL ESTER |
| pro_mdlNumber： | MFCD13689046 |
| pro_acceptors： | 5 |
| pro_donors： | 0 |
| pro_smile： | COC(=O)c1cc(cc(c1)[N+](=O)[O-])CBr |
| InChi： | InChI=1S/C9H8BrNO4/c1-15-9(12)7-2-6(5-10)3-8(4-7)11(13)14/h2-4H,5H2,1H3 |
| InChiKey： | InChIKey=XGCWUWVJPDMDMG-UHFFFAOYSA-N |
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