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Substance Name: 1,3-Benzodioxole-5-methanamine, alpha-(2-phenylethyl)-, hydrochloride
RN: 126520-99-8
InChIKey: GLNPUEAVQHWDML-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H17-N-O2.Cl-H

Molecular Weight

  • 291.7762
 
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Names and Synonyms

Synonym

  • alpha-(2-Phenylethyl)-1,3-benzodioxole-5-methanamine hydrochloride

Systematic Names

  • 1,3-Benzodioxole-5-methanamine, alpha-(2-phenylethyl)-, hydrochloride
  • 1,3-Benzodioxole-5-propanamine, beta-phenyl-, hydrochloride

Registry Numbers

CAS Registry Number

  • 126520-99-8

System Generated Number

  • 0126520998

Molecular Formulas

Molecular Formula

  • C16-H17-N-O2.Cl-H

Molecular Formula Fragments

  • C16-H17-N-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C16H17NO2.ClH/c17-10-14(13-4-2-1-3-5-13)8-12-6-7-15-16(9-12)19-11-18-15;/h1-7,9,14H,8,10-11,17H2;1H

InChIKey

GLNPUEAVQHWDML-UHFFFAOYSA-N

Smiles

c1ccc(cc1)C(Cc2ccc3c(c2)OCO3)CN.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous 118mg/kg (118mg/kg)   Pharmaceutical Chemistry Journal Vol. 23, Pg. 660, 1989.