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Substance Name: Methylethoxyphosphorylthiocholine iodide
RN: 2478-92-4
InChIKey: CPKWXPBTBIGHPG-UHFFFAOYSA-M

Molecular Formula

  • C8-H21-N-O2-P-S.I

Molecular Weight

  • 353.199
 
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Names and Synonyms

Results Name

  • Methylethoxyphosphorylthiocholine iodide

Synonyms

  • Ammonium, (2-mercaptoethyl)trimethyl-, iodide, ethyl methylphosphonothioate, (ester)
  • Ethoxy methylphosphoryl thio choline iodide
  • Methylethoxyphosphorylthiocholine iodide
  • O-Ethyl S-trimethylammoniumethyl methylphosphonothioate iodide

Systematic Name

  • Ammonium, (2-mercaptoethyl)trimethyl-, iodide, S-ester with O-ethyl methylphosphonothioate

Registry Numbers

CAS Registry Number

  • 2478-92-4

System Generated Number

  • 0002478924

Molecular Formulas

Molecular Formula

  • C8-H21-N-O2-P-S.I

Molecular Formula Fragments

  • C8-H21-N-O2-P-S
  • COMPONENT
  • I

Structure Descriptors

InChI

1S/C8H21NO2PS.HI/c1-6-11-12(5,10)13-8-7-9(2,3)4;/h6-8H2,1-5H3;1H/q+1;/p-1

InChIKey

CPKWXPBTBIGHPG-UHFFFAOYSA-M

Smiles

S([P@@](OCC)(C)=O)CC[N+](C)(C)C.[IH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 26ug/kg (0.026mg/kg)   Toxicology and Applied Pharmacology. Vol. 6, Pg. 269, 1964.