compound 0087949

Properties Image MNX_ID MNXM1196500 reference envipathM:...f44e48479860 formula C12H12Cl2O4 global charge 0 mol weight 291.13 InChIKey FEIJZVIARVWMIL-UHFFFAOYSA-N InChI InChI=1S/C12H12Cl2O4/c13-5-4-1-2-9(5,14)8-10(15)3-11(16,12(4,8)17)7-6(10)18-7/h1-2,4-8,15-17H,3H2 SMILES OC12CC(O)(C3OC31)C1(O)C3C=CC(Cl)(C3Cl)C21 MNX internals InChI (mnx) InChI=1/C12H12Cl2O4/c13-5-4-1-2-9(5,14)8-10(15)3-11(16,12(4,8)17)7-6(10)18-7/h1-2,4-8,15-17H,3H2/t4?,5?,6?,7?,8?,9?,10?,11?,12? SMILES (mnx) [CH:1]1=[CH:2][C:9]2([Cl:14])[CH:5]([Cl:13])[CH:4]1[C:12]1([OH:17])[CH:8]2[C:10]2([OH:15])[CH2:3][C:11]1([OH:16])[CH:7]1[CH:6]2[O:18]1

Parent-child relations graph

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