AC1L591X structure

AC1L591X

3-(aminomethyl)-3,5,5-trimethylcyclohexan-1-amine;hexanedioic acid;octadecanoic acid

Also Known As: C18-H36-O2.x-(C10H22-N2.C6-H10-O4)x-|Hexanedioic acid, polymer with 5-amino-1,3,3-trimethylcyclohexanemethanamine, octadecanoate|3-(aminomethyl)-3,5,5-trimethyl-cyclohexan-1-amine; hexanedioic acid; octadecanoic acid|3-(aminomethyl)-3,5,5-trimethylcyclohexan-1-amine; hexanedioic acid; octadecanoic acid

CAS: 69929-45-9
Molecular Formula C34H68N2O6
Molecular Weight 600.50775 g/mol
LogP 8.5373
Topological Polar Surface Area 164.0 Ų
Hydrogen Bond Donors 5
Hydrogen Bond Acceptors 8
Rotatable Bonds 22
Exact Mass 600.50775
Monoisotopic Mass 600.50775
Heavy Atoms 42
Complexity 481.0

Chemical Identifiers

CAS Number 69929-45-9
SMILES CCCCCCCCCCCCCCCCCC(=O)O.CC1(CC(CC(C1)(C)CN)N)C.C(CCC(=O)O)CC(=O)O
InChIKey ZAKJREUORPJTRA-UHFFFAOYSA-N

Product Overview

AC1L591X (CAS 69929-45-9), with molecular formula C34H68N2O6 and molecular weight 600.50775 g/mol. IUPAC: 3-(aminomethyl)-3,5,5-trimethylcyclohexan-1-amine;hexanedioic acid;octadecanoic acid.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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