Mecetronium ethylsulfate

ethyl-hexadecyl-dimethylazanium;ethyl sulfate

CAS: 3006-10-8

Molecular Formula	`C22H49NO4S`
Molecular Weight	423.7 g/mol
Topological Polar Surface Area	74.8 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	4
Rotatable Bonds	17
Exact Mass	423.33823
Heavy Atoms	28
Complexity	302.0

Chemical Identifiers

CAS Number	3006-10-8
SMILES	`CCCCCCCCCCCCCCCC[N+](C)(C)CC.CCOS(=O)(=O)[O-]`
InChIKey	`UUHBNESUDPIHCI-UHFFFAOYSA-M`

📖 Product Overview

Mecetronium ethylsulfate (CAS: 3006-10-8) is a chemical compound with molecular formula C22H49NO4S and molecular weight 423.7 g/mol. Its IUPAC systematic name is ethyl-hexadecyl-dimethylazanium;ethyl sulfate. Topological Polar Surface Area 74.8 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 4 Rotatable Bonds 17 Exact Mass 423.33823 Heavy Atoms 28 Complexity 302.0 InChI Key: UUHBNESUDPIHCI-UHFFFAOYSA-M. SMILES: CCCCCCCCCCCCCCCC[N+](C)(C)CC.CCOS(=O)(=O)[O-].

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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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