Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: beta-Alanine, N-(2,3-dihydrophenalen-2-yl)-N-methyl-, methyl ester, hydrochloride
RN: 33448-28-1
InChIKey: ZGPHSADVJZKNJH-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H21-N-O2.Cl-H

Molecular Weight

  • 319.83
 
* 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

  • Chlorhydrate beta-N-methyl-N-(dihydro-2,3 phenalene)-2 amino propionate de methyl
  • Chlorhydrate beta-N-methyl-N-(dihydro-2,3 phenalene)-2 amino propionate de methyl [French]
  • N-(2,3-Dihydrophenalen-2-yl)-N-methyl-beta-alanine methyl ester hydrochloride

Systematic Name

  • beta-Alanine, N-(2,3-dihydrophenalen-2-yl)-N-methyl-, methyl ester, hydrochloride

Registry Numbers

CAS Registry Number

  • 33448-28-1

System Generated Number

  • 0033448281

Molecular Formulas

Molecular Formula

  • C18-H21-N-O2.Cl-H

Molecular Formula Fragments

  • C18-H21-N-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C18H21NO2.ClH/c1-19(10-9-17(20)21-2)16-11-14-7-3-5-13-6-4-8-15(12-16)18(13)14;/h3-8,16H,9-12H2,1-2H3;1H

InChIKey

ZGPHSADVJZKNJH-UHFFFAOYSA-N

Smiles

c12c3CC([N@@H+](CCC(OC)=O)C)Cc1cccc2ccc3.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous 141mg/kg (141mg/kg)   Chimica Therapeutica. Vol. 6, Pg. 196, 1971.