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22041-26-5

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Basic Information
CAS No.: 22041-26-5
Name: 2-methoxy-N,N,N-trimethyl-2-oxoethanaminium iodide
Article Data: 5
Molecular Structure:
Molecular Structure of 22041-26-5 (2-methoxy-N,N,N-trimethyl-2-oxoethanaminium iodide)
Formula: C6H14 N O2 . I
Molecular Weight: 259.087
Synonyms: Ammonium,(carboxymethyl)trimethyl-, iodide, methyl ester (8CI)
Safety: A poison by intravenous route. When heated to decomposition it emits toxic vapors of NOx and I−.
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    Ethanaminium,2-methoxy-N,N,N-trimethyl-2-oxo-, iodide (1:1)

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Chemistry

Molecular Structure of Ammonium, (carboxymethyl)trimethyl-, iodide, methyl ester (CAS NO. 22041-26-5):

IUPAC Name: (2-Methoxy-2-oxoethyl)-trimethylazanium iodide 
Molecular Formula: C6H14INO2
Molecular Weight: 259.085330 g/mol
H-Bond Donor: 0
H-Bond Acceptor: 3
Canonical SMILES: C[N+](C)(C)CC(=O)OC.[I-]
InChI: InChI=1S/C6H14NO2.HI/c1-7(2,3)5-6(8)9-4;/h5H2,1-4H3;1H/q+1;/p-1
InChIKey: HFRWZUARBOFSTB-UHFFFAOYSA-M
Polar Surface Area of Ammonium, (carboxymethyl)trimethyl-, iodide, methyl ester (CAS NO. 22041-26-5): 26.3 Å2

Toxicity Data With Reference

1.    

ivn-mus LD50:10 mg/kg

     BJPCBM    British Journal of Pharmacology. 34 (1968),345.

Safety Profile

A poison by intravenous route. When heated to decomposition it emits toxic vapors of NOx and I−.

Specification

  Ammonium, (carboxymethyl)trimethyl-, iodide, methyl ester with cas registry number of 22041-26-5 is also called for (Carboxymethyl)trimethylammonium iodide methyl ester .