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Substance Name: Ammonium, dimethyl(2-((ethoxymethylphosphinyl)thio)ethyl)-p-tolyl-, methyl sulfate
RN: 41294-11-5
InChIKey: NXUQMWVAOQHTST-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H25-N-O2-P-S.C-H3-O4-S

Molecular Weight

  • 413.493
 
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Names and Synonyms

Synonyms

  • Benzenaminium, N-(2-((ethoxymethylphosphinyl)thio)ethyl)-N,N,4-trimethyl-, methyl sulfate
  • Dimethyl(2-((ethoxymethylphosphinyl)thio)ethyl)-p-tolylammonium methyl sulfate

Systematic Name

  • Ammonium, dimethyl(2-((ethoxymethylphosphinyl)thio)ethyl)-p-tolyl-, methyl sulfate

Registry Numbers

CAS Registry Number

  • 41294-11-5

System Generated Number

  • 0041294115

Molecular Formulas

Molecular Formula

  • C14-H25-N-O2-P-S.C-H3-O4-S

Molecular Formula Fragments

  • C-H3-O4-S
  • C14-H25-N-O2-P-S
  • COMPONENT

Structure Descriptors

InChI

1S/C14H25NO2PS.CH4O4S/c1-6-17-18(5,16)19-12-11-15(3,4)14-9-7-13(2)8-10-14;1-5-6(2,3)4/h7-10H,6,11-12H2,1-5H3;1H3,(H,2,3,4)/q+1;/p-1

InChIKey

NXUQMWVAOQHTST-UHFFFAOYSA-M

Smiles

c1([N+](CCS[P@@](OCC)(C)=O)(C)C)ccc(C)cc1.S(OC)(=O)(=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous 40ug/kg (0.04mg/kg)   Acta Pharmaceutica Jugoslavica. Vol. 23, Pg. 9, 1973.