3-ethylphenyl sulfate

Properties Image MNX_ID MNXM150887 reference chebi:82935 formula C8H10O4S global charge 0 mol weight 202.231 InChIKey DMIBREBMNWKSQY-UHFFFAOYSA-N InChI InChI=1S/C8H10O4S/c1-2-7-4-3-5-8(6-7)12-13(9,10)11/h3-6H,2H2,1H3,(H,9,10,11) SMILES CCC1=CC(OS(=O)(=O)O)=CC=C1 MNX internals InChI (mnx) InChI=1/C8H10O4S/c1-2-7-4-3-5-8(6-7)12-13(9,10)11/h3-6H,2H2,1H3,(H,9,10,11) SMILES (mnx) [CH3:1][CH2:2][C:7]1=[CH:6][C:8]([O:12][S:13]([OH:9])(=[O:10])=[O:11])=[CH:5][CH:3]=[CH:4]1

Parent-child relations graph

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