basic_info |
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Product_Name: | 2-SULFO-CYCLOHEX-1-ENECARBOXYLIC ACID ETHYL ESTER |
CAS: | 1007028-46-7 |
EnglishSynonyms: | 2-SULFO-CYCLOHEX-1-ENECARBOXYLIC ACID ETHYL ESTER |
pro_mdlNumber: | MFCD12545821 |
pro_acceptors: | 5 |
pro_donors: | 1 |
pro_smile: | CCOC(=O)C1=C(CCCC1)S(=O)(=O)O |
InChi: | InChI=1S/C9H14O5S/c1-2-14-9(10)7-5-3-4-6-8(7)15(11,12)13/h2-6H2,1H3,(H,11,12,13) |
InChiKey: | InChIKey=SIIGGFCBVDNNNU-UHFFFAOYSA-N |
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