1,6-diisocyanatohexane; hexane-1,6-diamine; 6-isocyanatohexan-1-amine

Systemtic Name: 1,6-diisocyanatohexane; hexane-1,6-diamine; 6-isocyanatohexan-1-amine Openeye Name: 1,6-diisocyanatohexane; hexane-1,6-diamine; 6-isocyanatohexan-1-amine CAS Name: 1,6-diisocyanatohexane; hexane-1,6-diamine; 6-isocyanato-1-hexanamine IUPAC Name: 1,6-diisocyanatohexane; hexane-1,6-diamine; 6-isocyanatohexan-1-amine Traditional Name: 6-aminohexylamine; 1,6-diisocyanatohexane; 6-isocyanatohexylamine Formula: C21H42N6O3 MolecularWeight: 426.59658

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H12N2O2.C7H14N2O.C6H16N2/c11-7-9-5-3-1-2-4-6-10-8-12;8-5-3-1-2-4-6-9-7-10;7-5-3-1-2-4-6-8/h1-6H2;1-6,8H2;1-8H2