1,5-diisocyanato-2,2-dimethyl-pentane; 1,6-diisocyanatohexane; 1,5-diisocyanatopentane

Systemtic Name: 1,5-diisocyanato-2,2-dimethyl-pentane; 1,6-diisocyanatohexane; 1,5-diisocyanatopentane Openeye Name: 1,5-diisocyanato-2,2-dimethyl-pentane; 1,6-diisocyanatohexane; 1,5-diisocyanatopentane CAS Name: 1,5-diisocyanato-2,2-dimethylpentane; 1,6-diisocyanatohexane; 1,5-diisocyanatopentane IUPAC Name: 1,5-diisocyanato-2,2-dimethylpentane; 1,6-diisocyanatohexane; 1,5-diisocyanatopentane Traditional Name: 1,5-diisocyanato-2,2-dimethyl-pentane; 1,6-diisocyanatohexane; 1,5-diisocyanatopentane Formula: C24H36N6O6 MolecularWeight: 504.57924

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H14N2O2.C8H12N2O2.C7H10N2O2/c1-9(2,6-11-8-13)4-3-5-10-7-12;11-7-9-5-3-1-2-4-6-10-8-12;10-6-8-4-2-1-3-5-9-7-11/h3-6H2,1-2H3;1-6H2;1-5H2