1,12-diisocyanatododecane; 2,11-diisocyanatododecane; 1,6-diisocyanatohexane

Systemtic Name: 1,12-diisocyanatododecane; 2,11-diisocyanatododecane; 1,6-diisocyanatohexane Openeye Name: 1,12-diisocyanatododecane; 2,11-diisocyanatododecane; 1,6-diisocyanatohexane CAS Name: 1,12-diisocyanatododecane; 2,11-diisocyanatododecane; 1,6-diisocyanatohexane IUPAC Name: 1,12-diisocyanatododecane; 2,11-diisocyanatododecane; 1,6-diisocyanatohexane Traditional Name: 1,12-diisocyanatododecane; 2,11-diisocyanatododecane; 1,6-diisocyanatohexane Formula: C36H60N6O6 MolecularWeight: 672.8982

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCCCCCCC(C)N=C=O)N=C=O.C(CCCCCCN=C=O)CCCCCN=C=O.C(CCCN=C=O)CCN=C=O

Isomeric SMILES

CC(CCCCCCCCC(C)N=C=O)N=C=O.C(CCCCCCN=C=O)CCCCCN=C=O.C(CCCN=C=O)CCN=C=O

InChI

InChI=1S/2C14H24N2O2.C8H12N2O2/c1-13(15-11-17)9-7-5-3-4-6-8-10-14(2)16-12-18;17-13-15-11-9-7-5-3-1-2-4-6-8-10-12-16-14-18;11-7-9-5-3-1-2-4-6-10-8-12/h13-14H,3-10H2,1-2H3;1-12H2;1-6H2