2,4-diisocyanato-1-methyl-benzene; propane-1,2-diol

Systemtic Name: 2,4-diisocyanato-1-methyl-benzene; propane-1,2-diol Openeye Name: 2,4-diisocyanato-1-methyl-benzene; propane-1,2-diol CAS Name: 2,4-diisocyanato-1-methylbenzene; propane-1,2-diol IUPAC Name: 2,4-diisocyanato-1-methylbenzene; propane-1,2-diol Traditional Name: 2,4-diisocyanato-1-methyl-benzene; propane-1,2-diol Formula: C12H14N2O4 MolecularWeight: 250.25056

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N=C=O)N=C=O.CC(CO)O

Isomeric SMILES

CC1=C(C=C(C=C1)N=C=O)N=C=O.CC(CO)O

InChI

InChI=1S/C9H6N2O2.C3H8O2/c1-7-2-3-8(10-5-12)4-9(7)11-6-13;1-3(5)2-4/h2-4H,1H3;3-5H,2H2,1H3