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Substance Name: 1H-Azepine-1-ethanol, hexahydro-alpha-(((1-methylethyl)amino)methyl)-, dihydrochloride
RN: 104317-89-7
InChIKey: CGLBQDDNZLHDSV-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H26-N2-O.2Cl-H

Molecular Weight

  • 287.272
 
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Names and Synonyms

Synonym

  • Hexahydro-alpha-(((1-methylethyl)amino)methyl)-1H-azepine-1-ethanol dihydrochloride

Systematic Name

  • 1H-Azepine-1-ethanol, hexahydro-alpha-(((1-methylethyl)amino)methyl)-, dihydrochloride

Registry Numbers

CAS Registry Number

  • 104317-89-7

System Generated Number

  • 0104317897

Molecular Formulas

Molecular Formula

  • C12-H26-N2-O.2Cl-H

Molecular Formula Fragments

  • C12-H26-N2-O
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C12H26N2O.2ClH/c1-11(2)13-9-12(15)10-14-7-5-3-4-6-8-14;;/h11-13,15H,3-10H2,1-2H3;2*1H

InChIKey

CGLBQDDNZLHDSV-UHFFFAOYSA-N

Smiles

[NH+]1(C[C@@H](C[NH2+]C(C)C)O)CCCCCC1.[ClH-].[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 1gm/kg (1000mg/kg) BEHAVIORAL: CHANGES IN MOTOR ACTIVITY (SPECIFIC ASSAY)

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

BEHAVIORAL: ATAXIA
Acta Poloniae Pharmaceutica. For English translation, see APPFAR. Vol. 42, Pg. 489, 1985.
mouse LD50 oral 3gm/kg (3000mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

BEHAVIORAL: CHANGES IN MOTOR ACTIVITY (SPECIFIC ASSAY)

BEHAVIORAL: ATAXIA
Acta Poloniae Pharmaceutica. For English translation, see APPFAR. Vol. 42, Pg. 489, 1985.
rat LD50 intravenous 400mg/kg (400mg/kg) BEHAVIORAL: CHANGES IN MOTOR ACTIVITY (SPECIFIC ASSAY)

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

BEHAVIORAL: ATAXIA
Acta Poloniae Pharmaceutica. For English translation, see APPFAR. Vol. 42, Pg. 489, 1985.