1,6-diisocyanatohexane; 2-methylprop-2-enoic acid; oxirane

Systemtic Name: 1,6-diisocyanatohexane; 2-methylprop-2-enoic acid; oxirane Openeye Name: 1,6-diisocyanatohexane; 2-methylprop-2-enoic acid; oxirane CAS Name: 1,6-diisocyanatohexane; 2-methyl-2-propenoic acid; oxirane IUPAC Name: 1,6-diisocyanatohexane; 2-methylprop-2-enoic acid; oxirane Traditional Name: 1,6-diisocyanatohexane; ethylene oxide; methacrylic acid Formula: C28H50N2O12 MolecularWeight: 606.7028

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C(=O)O.C1CO1.C1CO1.C1CO1.C1CO1.C1CO1.C1CO1.C1CO1.C1CO1.C(CCCN=C=O)CCN=C=O

Isomeric SMILES

CC(=C)C(=O)O.C1CO1.C1CO1.C1CO1.C1CO1.C1CO1.C1CO1.C1CO1.C1CO1.C(CCCN=C=O)CCN=C=O

InChI

InChI=1S/C8H12N2O2.C4H6O2.8C2H4O/c11-7-9-5-3-1-2-4-6-10-8-12;1-3(2)4(5)6;8*1-2-3-1/h1-6H2;1H2,2H3,(H,5,6);8*1-2H2