AC1Q6GWW
4-[(4-aminocyclohexyl)methyl]cyclohexan-1-amine;azepan-2-one;hexane-1,6-diamine;hexanedioic acid
Also Known As: (C13-H26-N2.C6-H16-N2.C6-H11-N-O.C6-H10-O4)x-|adipic acid; 4-[(4-aminocyclohexyl)methyl]cyclohexan-1-amine; azepan-2-one; hexane-1,6-diamine|Hexanedioic acid, polymer with hexahydro-2H-azepin-2-one, 1,6-hexanediamine and 4,4'-methylenebis(cyclohexanamine)|Hexanedioic acid, polymer with hexahydro-2H-azepin-2-one, 1,6-hexanediamine and 4,4'-methylenebis[cyclohexanamine]|4-[(4-aminocyclohexyl)methyl]cyclohexan-1-amine; azepan-2-one; hexane-1,6-diamine; hexanedioic acid|4-[(4-aminocyclohexyl)methyl]cyclohexan-1-amine;azepan-2-one;hexane-1,6-diamine;hexanedioic acid|Hexanedioic Acid, Polymer With Hexahydro-2H-Azepin-2-One, Bis(4-Aminocyclohexyl)Methane And 1,6-Hexa
| Molecular Formula | C31H63N5O5 |
|---|---|
| Molecular Weight | 585.4829 g/mol |
| LogP | 4.2683 |
| Topological Polar Surface Area | 208.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 12 |
| Exact Mass | 585.4829 |
| Monoisotopic Mass | 585.4829 |
| Heavy Atoms | 41 |
| Complexity | 393.0 |
Chemical Identifiers
| CAS Number | 999-22-4 |
|---|---|
| SMILES | C1CCC(=O)NCC1.C1CC(CCC1CC2CCC(CC2)N)N.C(CCCN)CCN.C(CCC(=O)O)CC(=O)O |
| InChIKey | LYRSKWHPYTWGPJ-UHFFFAOYSA-N |
Product Overview
AC1Q6GWW (CAS 999-22-4), with molecular formula C31H63N5O5 and molecular weight 585.4829 g/mol. IUPAC: 4-[(4-aminocyclohexyl)methyl]cyclohexan-1-amine;azepan-2-one;hexane-1,6-diamine;hexanedioic acid.