1,6-diisocyanatohexane; 2,2-dimethylbutane

Systemtic Name: 1,6-diisocyanatohexane; 2,2-dimethylbutane Openeye Name: 1,6-diisocyanatohexane; 2,2-dimethylbutane CAS Name: 1,6-diisocyanatohexane; 2,2-dimethylbutane IUPAC Name: 1,6-diisocyanatohexane; 2,2-dimethylbutane Traditional Name: 1,6-diisocyanatohexane; 2,2-dimethylbutane Formula: C14H26N2O2 MolecularWeight: 254.36844

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C.C(CCCN=C=O)CCN=C=O

Isomeric SMILES

CCC(C)(C)C.C(CCCN=C=O)CCN=C=O

InChI

InChI=1S/C8H12N2O2.C6H14/c11-7-9-5-3-1-2-4-6-10-8-12;1-5-6(2,3)4/h1-6H2;5H2,1-4H3