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Substance Name: O-Ethyl N,N-dimethylamino-S-(2-diethylaminoethyl)thiophosphate
RN: 90730-92-0
InChIKey: CXCGHLQJPZBJAD-UHFFFAOYSA-M

Note

  • Thiocholine-like analog of tabun.

Molecular Formula

  • C11-H28-N2-O2-P-S.C-H3-O4-S

Molecular Weight

  • 394.491
 
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Names and Synonyms

Name of Substance

  • O-Ethyl N,N-dimethylamino-S-(2-diethylaminoethyl)thiophosphate

Synonyms

  • O-Ethyl N,N-dimethylamino-S-(2-diethylaminoethyl)thiophosphate methylsulfomethylate
  • Ta-S-N+

Systematic Names

  • Ethanaminium, 2-(((dimethylamino)ethoxyphosphinyl)thio)-N,N-diethyl-N-methyl-, (6R-(6alpha,7beta(Z)))-
  • Ethanaminium, N,N-diethyl-2-(((dimethylamino)ethoxyphosphinyl)thio)-N-methyl-, methyl sulfate

Registry Numbers

CAS Registry Number

  • 90730-92-0

System Generated Number

  • 0090730920

Molecular Formulas

Molecular Formula

  • C11-H28-N2-O2-P-S.C-H3-O4-S

Molecular Formula Fragments

  • C-H3-O4-S
  • C11-H28-N2-O2-P-S
  • COMPONENT

Structure Descriptors

InChI

1S/C11H28N2O2PS.CH4O4S/c1-6-13(5,7-2)9-11-17-16(14)15-10-8-12(3)4;1-5-6(2,3)4/h16H,6-11H2,1-5H3;1H3,(H,2,3,4)/q+1;/p-1

InChIKey

CXCGHLQJPZBJAD-UHFFFAOYSA-M

Smiles

[N+](CCS[P@@](OCCN(C)C)=O)(CC)(CC)C.S(OC)(=O)(=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 subcutaneous 907ug/kg (0.907mg/kg)   Fundamental and Applied Toxicology. Vol. 4, Pg. S116, 1984.