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Substance Name: Ammonium, 4-acetamido-4,4-diphenyl-2-butyltrimethyl-, iodide
RN: 64070-88-8
InChIKey: YIWXBCXYQCEEPG-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H29-N2-O.I

Molecular Weight

  • 452.373
 
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Names and Synonyms

Synonyms

  • 4-Acetamido-4,4-diphenyl-2-butyltrimethyl ammonium iodide
  • BL 401

Systematic Name

  • Ammonium, 4-acetamido-4,4-diphenyl-2-butyltrimethyl-, iodide

Registry Numbers

CAS Registry Number

  • 64070-88-8

System Generated Number

  • 0064070888

Molecular Formulas

Molecular Formula

  • C21-H29-N2-O.I

Molecular Formula Fragments

  • C21-H29-N2-O
  • COMPONENT
  • I

Structure Descriptors

InChI

1S/C21H28N2O.HI/c1-17(23(3,4)5)16-21(22-18(2)24,19-12-8-6-9-13-19)20-14-10-7-11-15-20;/h6-15,17H,16H2,1-5H3;1H

InChIKey

YIWXBCXYQCEEPG-UHFFFAOYSA-N

Smiles

C(c1ccccc1)(c1ccccc1)(C[C@@H]([N+](C)(C)C)C)NC(C)=O.[IH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 19410ug/kg (19.41mg/kg) BEHAVIORAL: ALTERED SLEEP TIME (INCLUDING CHANGE IN RIGHTING REFLEX)

LUNGS, THORAX, OR RESPIRATION: CYANOSIS

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD
Journal of Pharmacology and Experimental Therapeutics. Vol. 100, Pg. 325, 1950.
mouse LD50 oral > 600mg/kg (600mg/kg)   Journal of Pharmacology and Experimental Therapeutics. Vol. 100, Pg. 325, 1950.