1,1-diisocyanatohexane; 1,3-diisocyanatohexane

Systemtic Name: 1,1-diisocyanatohexane; 1,3-diisocyanatohexane Openeye Name: 1,1-diisocyanatohexane; 1,3-diisocyanatohexane CAS Name: 1,1-diisocyanatohexane; 1,3-diisocyanatohexane IUPAC Name: 1,1-diisocyanatohexane; 1,3-diisocyanatohexane Traditional Name: 1,1-diisocyanatohexane; 1,3-diisocyanatohexane Formula: C40H60N10O10 MolecularWeight: 840.9654

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(N=C=O)N=C=O.CCCC(CCN=C=O)N=C=O.CCCC(CCN=C=O)N=C=O.CCCC(CCN=C=O)N=C=O.CCCC(CCN=C=O)N=C=O

Isomeric SMILES

CCCCCC(N=C=O)N=C=O.CCCC(CCN=C=O)N=C=O.CCCC(CCN=C=O)N=C=O.CCCC(CCN=C=O)N=C=O.CCCC(CCN=C=O)N=C=O

InChI

InChI=1S/5C8H12N2O2/c4*1-2-3-8(10-7-12)4-5-9-6-11;1-2-3-4-5-8(9-6-11)10-7-12/h5*8H,2-5H2,1H3