Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 1-Phthalancarbonitrile, 1-(3-aminopropyl)-3,3-dimethyl-, hydrochloride
RN: 22169-32-0
InChIKey: YGCHEARNLBUROO-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H18-N2-O.Cl-H

Molecular Weight

  • 266.77
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonyms

  • 1-(3-Aminopropyl)-3,3-dimethyl-1-phthalancarbonitrile hydrochloride
  • LU 4-050 hydrochloride

Systematic Name

  • 1-Phthalancarbonitrile, 1-(3-aminopropyl)-3,3-dimethyl-, hydrochloride

Registry Numbers

CAS Registry Number

  • 22169-32-0

System Generated Number

  • 0022169320

Molecular Formulas

Molecular Formula

  • C14-H18-N2-O.Cl-H

Molecular Formula Fragments

  • C14-H18-N2-O
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C14H18N2O.ClH/c1-13(2)11-6-3-4-7-12(11)14(10-16,17-13)8-5-9-15;/h3-4,6-7H,5,8-9,15H2,1-2H3;1H

InChIKey

YGCHEARNLBUROO-UHFFFAOYSA-N

Smiles

O1[C@@](c2ccccc2C1(C)C)(C#N)CCCN.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 71mg/kg (71mg/kg)   Acta Pharmacologica et Toxicologica. Vol. 28, Pg. 241, 1970.