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Substance Name: Ammonium, (2-mercaptoethyl)trimethyl-, chloride, acetate
RN: 6050-81-3
InChIKey: GZYVLKKMMDFCKR-UHFFFAOYSA-M

Molecular Formula

  • C7-H16-N-O-S.Cl

Molecular Weight

  • 197.728
 
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Names and Synonyms

Synonyms

  • (2-Acetylthio)-N,N,N-trimethylethanaminum chloride
  • (2-Mercaptoethyl)trimethylammonium chloride acetate
  • Acetylthiocholine chloride
  • EINECS 227-953-7

Systematic Names

  • 2-Acetylthioethyltrimethylammonium chloride
  • Ammonium, (2-mercaptoethyl)trimethyl-, chloride, acetate
  • Ethanaminium, 2-(acetylthio)-N,N,N-trimethyl-, chloride

Registry Numbers

CAS Registry Number

  • 6050-81-3

System Generated Number

  • 0006050813

Molecular Formulas

Molecular Formula

  • C7-H16-N-O-S.Cl

Molecular Formula Fragments

  • C7-H16-N-O-S
  • Cl
  • COMPONENT

Structure Descriptors

InChI

1S/C7H16NOS.ClH/c1-7(9)10-6-5-8(2,3)4;/h5-6H2,1-4H3;1H/q+1;/p-1

InChIKey

GZYVLKKMMDFCKR-UHFFFAOYSA-M

Smiles

[N+](CCSC(C)=O)(C)(C)C.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 37500ug/kg (37.5mg/kg)   Archives Internationales de Pharmacodynamie et de Therapie. Vol. 127, Pg. 128, 1960.