RefChem:863475 structure

RefChem:863475

2-[4-(2-hexadecanoyloxyethyl)-1,4-dimethylpiperazine-1,4-diium-1-yl]ethyl hexadecanoate;methyl sulfate

Also Known As: EINECS 264-792-1|Piperazinium, 1,4-dimethyl-1,4-bis[2-[(1-oxohexadecyl)oxy]ethyl]-, bis(methyl sulfate)|Piperazinium, 1,4-dimethyl-1,4-bis(2-((1-oxohexadecyl)oxy)ethyl)-, bis(methyl sulfate)|Piperazinium, 1,4-dimethyl-1,4-bis(2-((1-oxohexadecyl)oxy)ethyl)-, methyl sulfate (1:2)|1,4-Bis[2-(hexadecanoyloxy)ethyl]-1,4-dimethylpiperazine-1,4-diium bis(methyl sulfate)|1,4-Dimethyl-1,4-bis(2-(palmitoyloxy)ethyl)piperazindiium S,S'-dimethyl disulphate|1,4-dimethyl-1,4-bis[2-(palmitoyloxy)ethyl]piperazindiium S,S'-dimethyl disulphate|Piperazinium, 1,4-dimethyl-1,4-bis[2-[(1-oxohexadecyl)oxy]ethyl]-, methyl sulfate (1:2)|2-[4-(2-hexadecanoyloxyethyl)-1,4-dimethylpiperazine-1,4-diium-1-yl]ethyl hexadecanoate; methyl sulfate

CAS: 64346-20-9
Molecular Formula C44H90N2O12S2
Molecular Weight 902.5935 g/mol
LogP 9.13
Topological Polar Surface Area 185.46 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 12
Rotatable Bonds 36
Exact Mass 902.5935
Heavy Atoms 60
Complexity 1133.4

Chemical Identifiers

CAS Number 64346-20-9
SMILES CCCCCCCCCCCCCCCC(=O)OCC[N+]1(CC[N+](CC1)(C)CCOC(=O)CCCCCCCCCCCCCCC)C.COS(=O)(=O)[O-].COS(=O)(=O)[O-]

Product Overview

RefChem:863475 (CAS 64346-20-9), with molecular formula C44H90N2O12S2 and molecular weight 902.5935 g/mol. IUPAC: 2-[4-(2-hexadecanoyloxyethyl)-1,4-dimethylpiperazine-1,4-diium-1-yl]ethyl hexadecanoate;methyl sulfate.

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