99541-26-1 Purity
96%
If you have any other questions or need other size, please get a quote.
Specification
The molecular formula of Linoleamidopropyl ethyldimonium ethosulfate is C27H54N2O5S.
The molecular weight of Linoleamidopropyl ethyldimonium ethosulfate is 518.8 g/mol.
The IUPAC name of Linoleamidopropyl ethyldimonium ethosulfate is ethyl-dimethyl-[3-[[(9Z,12Z)-octadeca-9,12-dienoyl]amino]propyl]azanium;ethyl sulfate.
The InChI of Linoleamidopropyl ethyldimonium ethosulfate is InChI=1S/C25H48N2O.C2H6O4S/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-22-25(28)26-23-21-24-27(3,4)6-2;1-2-6-7(3,4)5/h10-11,13-14H,5-9,12,15-24H2,1-4H3;2H2,1H3,(H,3,4,5)/b11-10-,14-13-.
The InChIKey of Linoleamidopropyl ethyldimonium ethosulfate is XMEADQFYVQOZAW-LYJODMERSA-N.
The canonical SMILES of Linoleamidopropyl ethyldimonium ethosulfate is CCCCCC=CCC=CCCCCCCCC(=O)NCCC[N+](C)(C)CC.CCOS(=O)(=O)[O-].
The isomeric SMILES of Linoleamidopropyl ethyldimonium ethosulfate is CCCCC/C=C\C/C=C\CCCCCCCC(=O)NCCC[N+](C)(C)CC.CCOS(=O)(=O)[O-].
The CAS number of Linoleamidopropyl ethyldimonium ethosulfate is 99542-23-1.
Linoleamidopropyl ethyldimonium ethosulfate has 1 hydrogen bond donor.
Linoleamidopropyl ethyldimonium ethosulfate has 5 hydrogen bond acceptors.