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The molecular formula is C27H46ClNO4.
The molecular weight is 484.1 g/mol.
It was created on 2007-12-05 and last modified on 2023-12-30.
The IUPAC name is bis(2-acetyloxyethyl)-benzyl-dodecylazanium;chloride.
The InChIKey is XBEANSGDACVEFX-UHFFFAOYSA-M.
The canonical SMILES is CCCCCCCCCCCC[N+](CCOC(=O)C)(CCOC(=O)C)CC1=CC=CC=C1.[Cl-].
The CAS number is 93777-18-5.
It has 5 hydrogen bond acceptor counts.
The topological polar surface area is 52.6 Ų.
Yes, the compound is canonicalized.
93777-11-8
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93777-21-0
93777-25-4
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