4-ethylphenyl sulfate

Properties Image MNX_ID MNXM151149 reference chebi:133681 formula C8H9O4S global charge -1 mol weight 201.223 InChIKey DWZGLEPNCRFCEP-UHFFFAOYSA-M InChI InChI=1S/C8H10O4S/c1-2-7-3-5-8(6-4-7)12-13(9,10)11/h3-6H,2H2,1H3,(H,9,10,11)/p-1 SMILES CCC1=CC=C(OS(=O)(=O)[O-])C=C1 MNX internals InChI (mnx) InChI=1/C8H10O4S/c1-2-7-3-5-8(6-4-7)12-13(9,10)11/h3-6H,2H2,1H3,(H,9,10,11) SMILES (mnx) [CH3:1][CH2:2][C:7]1=[CH:4][CH:6]=[C:8]([O:12][S:13]([OH:9])(=[O:10])=[O:11])[CH:5]=[CH:3]1

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 1 in models (compartimentalized) 1