compound 0215027

Properties Image MNX_ID MNXM1174812 reference envipathM:...831517733f3e formula C10H13ClO4 global charge 0 mol weight 232.663 InChIKey FTQGSWJSYZGEBZ-UHFFFAOYSA-N InChI InChI=1S/C10H13ClO4/c11-9-6(7(13)2-1-5-12)3-4-8(14)10(9)15/h3-4,7,12-15H,1-2,5H2 SMILES OCCCC(O)C1=CC=C(O)C(O)=C1Cl MNX internals InChI (mnx) InChI=1/C10H13ClO4/c11-9-6(7(13)2-1-5-12)3-4-8(14)10(9)15/h3-4,7,12-15H,1-2,5H2/t7? SMILES (mnx) [CH2:1]([CH2:2][CH:7]([C:6]1=[C:9]([Cl:11])[C:10]([OH:15])=[C:8]([OH:14])[CH:4]=[CH:3]1)[OH:13])[CH2:5][OH:12]

Parent-child relations graph

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