2,5-dichloro-3-methyl-muconolactone

Properties Image MNX_ID MNXM9773 reference metacycM:CPD-10851 formula C7H5Cl2O4 global charge -1 mol weight 224.019 InChIKey SZWLKMNDJDVAHQ-UHFFFAOYSA-M InChI InChI=1S/C7H6Cl2O4/c1-2-3(8)7(12)13-5(2)4(9)6(10)11/h4-5H,1H3,(H,10,11)/p-1 SMILES CC1=C(Cl)C(=O)OC1C(Cl)C(=O)[O-] MNX internals InChI (mnx) InChI=1/C7H6Cl2O4/c1-2-3(8)7(12)13-5(2)4(9)6(10)11/h4-5H,1H3,(H,10,11)/t4?,5? SMILES (mnx) [CH3:1][C:2]1=[C:3]([Cl:8])[C:7](=[O:12])[O:13][CH:5]1[CH:4]([C:6](=[O:10])[OH:11])[Cl:9]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 3 in models (compartimentalized) 0