93942-05-3 Purity
96%
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Specification
The molecular formula is C26H56N4O3.
Some synonyms include N-(2-((2-((2-Aminoethyl)amino)ethyl)amino)ethyl)stearamide monoacetate, 93942-08-6, and N-[2-[[2-[(2-AMINOETHYL)AMINO]ETHYL]AMINO]ETHYL]STEARAMIDE MONOACETATE.
The molecular weight is 472.7 g/mol.
The IUPAC name is acetic acid;N-[2-[2-(2-aminoethylamino)ethylamino]ethyl]octadecanamide.
The InChIKey is ZPHYJDBFRAZJAL-UHFFFAOYSA-N.
The Canonical SMILES representation is CCCCCCCCCCCCCCCCCC(=O)NCCNCCNCCN.CC(=O)O.
The CAS number is 93942-08-6.
It has 5 hydrogen bond donor counts.
The topological polar surface area is 117 Ų.
Yes, the compound is canonicalized.