2,3-dimethylphenyl isocyanate

Properties Image MNX_ID MNXM34452 reference chebi:63899 formula C9H9NO global charge 0 mol weight 147.177 InChIKey KNHJIEOCVVIBIV-UHFFFAOYSA-N InChI InChI=1S/C9H9NO/c1-7-4-3-5-9(8(7)2)10-6-11/h3-5H,1-2H3 SMILES CC1=C(C)C(N=C=O)=CC=C1 MNX internals InChI (mnx) InChI=1/C9H9NO/c1-7-4-3-5-9(8(7)2)10-6-11/h3-5H,1-2H3 SMILES (mnx) [CH3:1][C:7]1=[C:8]([CH3:2])[C:9]([N:10]=[C:6]=[O:11])=[CH:5][CH:3]=[CH:4]1

Parent-child relations graph

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