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Substance Name: 1-Adamantanemethylamine, 2-bromo-N-methyl-, hydrochloride
RN: 59177-85-4
InChIKey: GSMFRXVXEZYITF-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H20-Br-N.Cl-H

Molecular Weight

  • 294.662
 
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Names and Synonyms

Synonym

  • 2-Bromo-N-methyl-1-adamantanemethanamine hydrochloride

Systematic Name

  • 1-Adamantanemethylamine, 2-bromo-N-methyl-, hydrochloride

Registry Numbers

CAS Registry Number

  • 59177-85-4

System Generated Number

  • 0059177854

Molecular Formulas

Molecular Formula

  • C12-H20-Br-N.Cl-H

Molecular Formula Fragments

  • C12-H20-Br-N
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C12H20BrN.ClH/c1-14-7-12-5-8-2-9(6-12)4-10(3-8)11(12)13;/h8-11,14H,2-7H2,1H3;1H

InChIKey

GSMFRXVXEZYITF-UHFFFAOYSA-N

Smiles

Cl.C1[C@@H]2CC3C[C@@H]1CC([C@@H]3Br)(C2)CNC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 295mg/kg (295mg/kg)   Journal of Medicinal Chemistry. Vol. 19, Pg. 967, 1976.
mouse LD50 oral 295mg/kg (295mg/kg)   Journal of Medicinal Chemistry. Vol. 19, Pg. 967, 1976.