CTK1H1326

4-[(4-aminocyclohexyl)methyl]cyclohexan-1-amine;carbonic acid;hexane-1,6-diol;5-isocyanato-1-(isocyanatomethyl)-1,3,3-trimethylcyclohexane

Also Known As: (C13-H26-N2.C12-H18-N2-O2.C6-H14-O2.C-H2-O3)x-|Carbonic acid, polymer with 1,6-hexanediol, 5-isocyanato-1-(isocyanatomethyl)-1,3,3-trimethylcyclohexane and 4,4'-methylenebis[cyclohexanamine]|Isophorone diisocyanate, 4,4'-diaminodicyclohexylmethane, carbonic acid, 1,6-hexanediol polymer|4-[(4-aminocyclohexyl)methyl]cyclohexan-1-amine; carbonic acid; hexane-1,6-diol; 5-isocyanato-1-(isocyanatomethyl)-1,3,3-trimethyl-cyclohexane|4-[(4-aminocyclohexyl)methyl]cyclohexan-1-amine; carbonic acid; hexane-1,6-diol; 5-isocyanato-1-(isocyanatomethyl)-1,3,3-trimethylcyclohexane|Carbonic acid, polymer with 1,6-hexanediol, 5-isocyanato-1-(isocyanatomethyl) -1,3,3-trimethylcyclohexane and 4,4'-methylenebis[cyclohexanamine]|Carbonic acid, polymer with 1,6-hexanediol, 5-isocyanato-1-(isocyanatomethyl)-1,3,3-trimethylcyclohexane and 4,4'-methylenebis(cyclohexanamine)|Isophorone diisocyanate, polymer with bis(4-aminocyclohexyl)methane, carbonic acid, and 1,6-hexanediol

Molecular Formula	C32H60N4O7
Molecular Weight	612.4462 g/mol
LogP	5.4083
Topological Polar Surface Area	209.0 Ų
Hydrogen Bond Donors	6
Hydrogen Bond Acceptors	11
Rotatable Bonds	10
Exact Mass	612.4462
Monoisotopic Mass	612.4462
Heavy Atoms	43
Complexity	567.0

Chemical Identifiers

CAS Number	53160-76-2
SMILES	CC1(CC(CC(C1)(C)CN=C=O)N=C=O)C.C1CC(CCC1CC2CCC(CC2)N)N.C(CCCO)CCO.C(=O)(O)O
InChIKey	ZPHBSICRUMSCNL-UHFFFAOYSA-N