3,7,9-TRIOXATRICYCLO[4.2.1.0(2,4)]NON-5-YL 4-METHYLBENZENESULFONATE

pro_cas
pro_cdbregno
CCD00257652
pro_formula
C13 H14 O6 S
pro_molWeight
298.314

basic_info

Product_Name: 3,7,9-TRIOXATRICYCLO[4.2.1.0(2,4)]NON-5-YL 4-METHYLBENZENESULFONATE
EnglishSynonyms: 3,7,9-TRIOXATRICYCLO[4.2.1.0(2,4)]NON-5-YL 4-METHYLBENZENESULFONATE ; TOLUENE-4-SULFONIC ACID 3,7,9-TRIOXA-TRICYCLO[4.2.1.0 2,4]NON-5-YL ESTER
pro_mdlNumber: MFCD01820797
pro_acceptors: 6
pro_donors: 0
pro_smile: Cc1ccc(cc1)S(=O)(=O)OC2C3C(O3)C4COC2O4
InChi: InChI=1S/C13H14O6S/c1-7-2-4-8(5-3-7)20(14,15)19-12-11-10(18-11)9-6-16-13(12)17-9/h2-5,9-13H,6H2,1H3
InChiKey: InChIKey=XIOHREILWINAMO-UHFFFAOYSA-N

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