basic_info |
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Product_Name: | 2-METHOXY-5-(ETHYLSULFONYL)BENZOIC ACID |
CAS: | 4840-63-5 |
EnglishSynonyms: | 5-(ETHYLSULFONYL)-2-METHOXYBENZOIC ACID ; 5-(ETHYLSULPHONYL)-O-ANISIC ACID ; 2-METHOXY-5-(ETHYLSULFONYL)BENZOIC ACID ; 2-METHOXYL-5-ETHYLSULFONYLBENZOIC ACID ; 5-(ETHANESULFONYL)-2-METHOXYBENZOIC ACID |
pro_mdlNumber: | MFCD01317546 |
pro_acceptors: | 5 |
pro_donors: | 1 |
pro_smile: | CCS(=O)(=O)c1ccc(c(c1)C(=O)O)OC |
InChi: | InChI=1S/C10H12O5S/c1-3-16(13,14)7-4-5-9(15-2)8(6-7)10(11)12/h4-6H,3H2,1-2H3,(H,11,12) |
InChiKey: | InChIKey=NBFYWQQYIJTQQV-UHFFFAOYSA-N |
property |
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