Methylacetoacetic acid

Properties Image MNX_ID MNXM61723 reference chebi:166454 formula C5H8O3 global charge 0 mol weight 116.116 InChIKey WRQNANDWMGAFTP-UHFFFAOYSA-N InChI InChI=1S/C5H8O3/c1-4(6)3-5(7)8-2/h3H2,1-2H3 SMILES COC(=O)CC(C)=O MNX internals InChI (mnx) InChI=1/C5H8O3/c1-4(6)3-5(7)8-2/h3H2,1-2H3 SMILES (mnx) [CH3:1][C:4]([CH2:3][C:5](=[O:7])[O:8][CH3:2])=[O:6]
Parent-child relations graph	Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 2 in models (compartimentalized) 0