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Substance Name: Ammonium, diethyl(3-hydroxypropyl)methyl-, iodide, 2-phenylbutyrate
RN: 73664-07-0
InChIKey: ADOMOBOBDDVOLP-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H30-N-O2.I

Molecular Weight

  • 419.34
 
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Names and Synonyms

Synonyms

  • alpha-Phenyl-butyrate du diethylamino-propanol iodomethylate
  • alpha-Phenyl-butyrate du diethylamino-propanol iodomethylate [French]
  • Diethyl(3-hydroxypropyl)methyl ammonium iodide, 2-phenylbutyrate

Systematic Name

  • Ammonium, diethyl(3-hydroxypropyl)methyl-, iodide, 2-phenylbutyrate

Registry Numbers

CAS Registry Number

  • 73664-07-0

System Generated Number

  • 0073664070

Molecular Formulas

Molecular Formula

  • C18-H30-N-O2.I

Molecular Formula Fragments

  • C18-H30-N-O2
  • COMPONENT
  • I

Structure Descriptors

InChI

1S/C18H30NO2.HI/c1-5-17(16-12-9-8-10-13-16)18(20)21-15-11-14-19(4,6-2)7-3;/h8-10,12-13,17H,5-7,11,14-15H2,1-4H3;1H/q+1;/p-1

InChIKey

ADOMOBOBDDVOLP-UHFFFAOYSA-M

Smiles

c1([C@@H](C(OCCC[N+](CC)(CC)C)=O)CC)ccccc1.[IH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intradermal 150mg/kg (150mg/kg) BEHAVIORAL: EXCITEMENT

LUNGS, THORAX, OR RESPIRATION: DYSPNEA

BEHAVIORAL: ATAXIA
Archives Internationales de Pharmacodynamie et de Therapie. Vol. 59, Pg. 149, 1938.