compound 0054665

Properties Image MNX_ID MNXM1172458 reference envipathM:...7dfb54a2e167 formula C9H10Cl4O3S global charge 0 mol weight 340.055 InChIKey KRGLIRQNRNVLDW-UHFFFAOYSA-N InChI InChI=1S/C9H10Cl4O3S/c10-6-5-3-1-15-17(14)16-2-4(3)9(13,7(5)11)8(6)12/h3-8H,1-2H2 SMILES O=S1OCC2C3C(Cl)C(Cl)C(Cl)(C3Cl)C2CO1 MNX internals InChI (mnx) InChI=1/C9H10Cl4O3S/c10-6-5-3-1-15-17(14)16-2-4(3)9(13,7(5)11)8(6)12/h3-8H,1-2H2/t3?,4?,5?,6?,7?,8?,9?,17? SMILES (mnx) [CH2:1]1[CH:3]2[CH:4]([CH2:2][O:16][S:17](=[O:14])[O:15]1)[C:9]1([Cl:13])[CH:7]([Cl:11])[CH:5]2[CH:6]([Cl:10])[CH:8]1[Cl:12]

Parent-child relations graph

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