2,3-dinitrotoluene

Properties Image MNX_ID MNXM165600 reference chebi:142287 formula C7H6N2O4 global charge 0 mol weight 182.135 InChIKey DYSXLQBUUOPLBB-UHFFFAOYSA-N InChI InChI=1S/C7H6N2O4/c1-5-3-2-4-6(8(10)11)7(5)9(12)13/h2-4H,1H3 SMILES CC1=C([N+](=O)[O-])C([N+](=O)[O-])=CC=C1 MNX internals InChI (mnx) InChI=1/C7H6N2O4/c1-5-3-2-4-6(8(10)11)7(5)9(12)13/h2-4H,1H3 SMILES (mnx) [CH3:1][C:5]1=[C:7]([N+:9]([O-:12])=[O:13])[C:6]([N+:8]([O-:10])=[O:11])=[CH:4][CH:2]=[CH:3]1

Parent-child relations graph

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