2,5-dichloro-4-methyl-muconolactone

Properties Image MNX_ID MNXM14139 reference metacycM:CPD-10861 formula C7H5Cl2O4 global charge -1 mol weight 224.019 InChIKey OWFNQSUVNYAOKE-UHFFFAOYSA-M InChI InChI=1S/C7H6Cl2O4/c1-7(4(9)5(10)11)2-3(8)6(12)13-7/h2,4H,1H3,(H,10,11)/p-1 SMILES CC1(C(Cl)C(=O)[O-])C=C(Cl)C(=O)O1 MNX internals InChI (mnx) InChI=1/C7H6Cl2O4/c1-7(4(9)5(10)11)2-3(8)6(12)13-7/h2,4H,1H3,(H,10,11)/t4?,7? SMILES (mnx) [CH3:1][C:7]1([CH:4]([C:5](=[O:10])[OH:11])[Cl:9])[CH:2]=[C:3]([Cl:8])[C:6](=[O:12])[O:13]1

Parent-child relations graph

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