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Substance Name: 2-Propyn-1-aminium, N,N-diethyl-N-(2-oxo-2-((2,4,6-trimethylphenyl)amino)ethyl)-, chloride
RN: 79143-65-0
InChIKey: KWJMPMFRCSXRMC-UHFFFAOYSA-N

Molecular Formula

  • C18-H27-N2-O.Cl

Molecular Weight

  • 322.8773
 
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Names and Synonyms

Synonyms

  • N,N-Diethyl-N-(2-oxo-2-((2,4,6-trimethylphenyl)amino)ethyl)-2-propyn-1-aminium chloride
  • ZH-94

Systematic Name

  • 2-Propyn-1-aminium, N,N-diethyl-N-(2-oxo-2-((2,4,6-trimethylphenyl)amino)ethyl)-, chloride

Registry Numbers

CAS Registry Number

  • 79143-65-0

System Generated Number

  • 0079143650

Molecular Formulas

Molecular Formula

  • C18-H27-N2-O.Cl

Molecular Formula Fragments

  • C18-H27-N2-O
  • Cl
  • COMPONENT

Structure Descriptors

InChI

1S/C18H26N2O.ClH/c1-7-10-20(8-2,9-3)13-17(21)19-18-15(5)11-14(4)12-16(18)6;/h1,11-12H,8-10,13H2,2-6H3;1H

InChIKey

KWJMPMFRCSXRMC-UHFFFAOYSA-N

Smiles

CC[N+](CC)(CC#C)CC(=O)Nc1c(cc(cc1C)C)C.[Cl-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 42500ug/kg (42.5mg/kg) LUNGS, THORAX, OR RESPIRATION: DYSPNEA

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD
Russian Pharmacology and Toxicology Vol. 46, Pg. 125, 1983.