Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 1,3-Propanediol, 2-((2-anthracenylmethyl)amino)-2-methyl-, hydrochloride, hydrate (2:2:1)
RN: 96403-65-5
InChIKey: ZFRXGGKOZFPCEY-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H21-N-O2.Cl-H.1/2H2-O

Molecular Weight

  • 331.841
 
* 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

  • 2-((2-Anthracenylmethyl)amino)-2-methyl-1,3-propanediol hydrochloride
  • 2-((2-Anthracenylmethyl)amino)-2-methyl-1,3-propanediol hydrochloride hydrate (2:2:1)

Systematic Name

  • 1,3-Propanediol, 2-((2-anthracenylmethyl)amino)-2-methyl-, hydrochloride, hydrate (2:2:1)

Registry Numbers

CAS Registry Number

  • 96403-65-5

System Generated Number

  • 0096403655

Molecular Formulas

Molecular Formula

  • C19-H21-N-O2.Cl-H.1/2H2-O

Molecular Formula Fragments

  • C19-H21-N-O2
  • Cl-H
  • COMPONENT
  • H2-O

Structure Descriptors

InChI

1S/C19H21NO2.ClH/c1-19(12-21,13-22)20-11-14-6-7-17-9-15-4-2-3-5-16(15)10-18(17)8-14;/h2-10,20-22H,11-13H2,1H3;1H

InChIKey

ZFRXGGKOZFPCEY-UHFFFAOYSA-N

Smiles

CC(CO)(CO)NCc1ccc2c(cc3c(c2)cccc3)c1.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mammal (species unspecified) LD unreported > 250mg/kg (250mg/kg)   Journal of Medicinal Chemistry. Vol. 34, Pg. 1983, 1991.