3-[2,3-bis(3-oxidanylpropoxy)propoxy]propan-1-ol; 1,3-diisocyanato-2-methyl-benzene; 2,4-diisocyanato-1-methyl-cyclohexane

Systemtic Name: 3-[2,3-bis(3-oxidanylpropoxy)propoxy]propan-1-ol; 1,3-diisocyanato-2-methyl-benzene; 2,4-diisocyanato-1-methyl-cyclohexane Openeye Name: 3-[2,3-bis(3-hydroxypropoxy)propoxy]propan-1-ol; 1,3-diisocyanato-2-methyl-benzene; 2,4-diisocyanato-1-methyl-cyclohexane CAS Name: 3-[2,3-bis(3-hydroxypropoxy)propoxy]-1-propanol; 1,3-diisocyanato-2-methylbenzene; 2,4-diisocyanato-1-methylcyclohexane IUPAC Name: 3-[2,3-bis(3-hydroxypropoxy)propoxy]propan-1-ol; 1,3-diisocyanato-2-methylbenzene; 2,4-diisocyanato-1-methylcyclohexane Traditional Name: 3-[2,3-bis(3-hydroxypropoxy)propoxy]propan-1-ol; 1,3-diisocyanato-2-methyl-benzene; 2,4-diisocyanato-1-methyl-cyclohexane Formula: C30H44N4O10 MolecularWeight: 620.69116

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1N=C=O)N=C=O.CC1=C(C=CC=C1N=C=O)N=C=O.C(CO)COCC(COCCCO)OCCCO

Isomeric SMILES

CC1CCC(CC1N=C=O)N=C=O.CC1=C(C=CC=C1N=C=O)N=C=O.C(CO)COCC(COCCCO)OCCCO

InChI

InChI=1S/C12H26O6.C9H12N2O2.C9H6N2O2/c13-4-1-7-16-10-12(18-9-3-6-15)11-17-8-2-5-14;1-7-2-3-8(10-5-12)4-9(7)11-6-13;1-7-8(10-5-12)3-2-4-9(7)11-6-13/h12-15H,1-11H2;7-9H,2-4H2,1H3;2-4H,1H3