2-ethyl-2-(hydroxymethyl)propane-1,3-diol; 1,1,6-triisocyanatohexane

Systemtic Name: 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; 1,1,6-triisocyanatohexane Openeye Name: 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; 1,1,6-triisocyanatohexane CAS Name: 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; 1,1,6-triisocyanatohexane IUPAC Name: 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; 1,1,6-triisocyanatohexane Traditional Name: 2-ethyl-2-methylol-propane-1,3-diol; 1,1,6-triisocyanatohexane Formula: C33H47N9O12 MolecularWeight: 761.77938

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)(CO)CO.C(CCC(N=C=O)N=C=O)CCN=C=O.C(CCC(N=C=O)N=C=O)CCN=C=O.C(CCC(N=C=O)N=C=O)CCN=C=O

Isomeric SMILES

CCC(CO)(CO)CO.C(CCC(N=C=O)N=C=O)CCN=C=O.C(CCC(N=C=O)N=C=O)CCN=C=O.C(CCC(N=C=O)N=C=O)CCN=C=O

InChI

InChI=1S/3C9H11N3O3.C6H14O3/c3*13-6-10-5-3-1-2-4-9(11-7-14)12-8-15;1-2-6(3-7,4-8)5-9/h3*9H,1-5H2;7-9H,2-5H2,1H3