basic_info |
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Product_Name: | 4-BROMO-3-(1,1-DIMETHYLETHYL)-1H-PYRAZOLE-5-CARBOXYLIC ACID ETHYL ESTER |
EnglishSynonyms: | 4-BROMO-3-(1,1-DIMETHYLETHYL)-1H-PYRAZOLE-5-CARBOXYLIC ACID ETHYL ESTER ; ETHYL 4-BROMO-3-(TERT-BUTYL)-1H-PYRAZOLE-5-CARBOXYLATE ; 4-BROMO-5-TERT-BUTYL-2H-PYRAZOLE-3-CARBOXYLIC ACID ETHYL ESTER |
pro_mdlNumber: | MFCD08447738 |
pro_acceptors: | 4 |
pro_donors: | 1 |
pro_smile: | CCOC(=O)c1c(c(n[nH]1)C(C)(C)C)Br |
InChi: | InChI=1S/C10H15BrN2O2/c1-5-15-9(14)7-6(11)8(13-12-7)10(2,3)4/h5H2,1-4H3,(H,12,13) |
InChiKey: | InChIKey=QTWJONUIFJTELY-UHFFFAOYSA-N |
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