(2-Chloroethyl)ethylmethyl(naphthylmethyl)ammonium methyl sulfate

2-chloroethyl-ethyl-methyl-(naphthalen-1-ylmethyl)azanium;hydrogen sulfate

CAS: 69781-88-0

Molecular Formula	`C16H22ClNO4S`
Molecular Weight	359.9 g/mol
Topological Polar Surface Area	85.8 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	4
Rotatable Bonds	5
Exact Mass	359.0958
Heavy Atoms	23
Complexity	331.0

Chemical Identifiers

CAS Number	69781-88-0
SMILES	`CC[N+](C)(CCCl)CC1=CC=CC2=CC=CC=C21.OS(=O)(=O)[O-]`
InChIKey	`DODAINIGKXVPDD-UHFFFAOYSA-M`

📖 Product Overview

(2-Chloroethyl)ethylmethyl(naphthylmethyl)ammonium methyl sulfate (CAS: 69781-88-0) is a chemical compound with molecular formula C16H22ClNO4S and molecular weight 359.9 g/mol. Its IUPAC systematic name is 2-chloroethyl-ethyl-methyl-(naphthalen-1-ylmethyl)azanium;hydrogen sulfate. Topological Polar Surface Area 85.8 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 4 Rotatable Bonds 5 Exact Mass 359.0958 Heavy Atoms 23 Complexity 331.0 InChI Key: DODAINIGKXVPDD-UHFFFAOYSA-M. SMILES: CC[N+](C)(CCCl)CC1=CC=CC2=CC=CC=C21.OS(=O)(=O)[O-].

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