basic_info |
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| Product_Name: | 2-THIOPHENECARBOXYLIC ACID, 5-(4-CARBOXYPHENYL), 2-METHYL ESTER |
| CAS: | 597565-50-9 ;1024449-32-8 |
| EnglishSynonyms: | 4-[5-(METHOXYCARBONYL)-2-THIENYL]BENZOIC ACID ; 4-(5-(METHOXYCARBONYL)THIOPHEN-2-YL)BENZOIC ACID ; 2-THIOPHENECARBOXYLIC ACID, 5-(4-CARBOXYPHENYL), 2-METHYL ESTER |
| pro_mdlNumber: | MFCD13195084 |
| pro_acceptors: | 4 |
| pro_donors: | 1 |
| pro_smile: | COC(=O)c1ccc(s1)c2ccc(cc2)C(=O)O |
| InChi: | InChI=1S/C13H10O4S/c1-17-13(16)11-7-6-10(18-11)8-2-4-9(5-3-8)12(14)15/h2-7H,1H3,(H,14,15) |
| InChiKey: | InChIKey=CSIYURZHOBARCQ-UHFFFAOYSA-N |
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