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Substance Name: 3-Isoquinolineethanamine, 3,4-dihydro-1-cyclohexyl-N,N-dimethyl-, hydrochloride, hydrate (2:4:3)
RN: 83658-50-8
InChIKey: FIMJKCDOCONPLM-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C38-H56-N4.4Cl-H.3H2-O

Molecular Weight

  • 357.366
 
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Names and Synonyms

  • 3-Isoquinolineethanamine, 3,4-dihydro-1-cyclohexyl-N,N-dimethyl-, hydrochloride, hydrate (2:4:3)

Registry Numbers

CAS Registry Number

  • 83658-50-8

System Generated Number

  • 0083658508

Molecular Formulas

Molecular Formula

  • C38-H56-N4.4Cl-H.3H2-O

Molecular Formula Fragments

  • C38-H56-N4
  • Cl-H
  • COMPONENT
  • H2-O

Structure Descriptors

InChI

1S/C19H28N2.2ClH/c1-21(2)13-12-17-14-16-10-6-7-11-18(16)19(20-17)15-8-4-3-5-9-15;;/h6-7,10-11,15,17H,3-5,8-9,12-14H2,1-2H3;2*1H

InChIKey

FIMJKCDOCONPLM-UHFFFAOYSA-N

Smiles

CN(C)CCC1Cc2ccccc2C(=N1)C3CCCCC3.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 82mg/kg (82mg/kg)   United States Patent Document. Vol. #4386090,