Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Ethanamine, 2-((1-(4-chlorophenyl)-4-phenyl-1H-pyrazol-3-yl)oxy)-N,N-dimethyl-, monomethanesulfonate
RN: 62833-13-0
InChIKey: PKBCTTYSDWKYTD-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H20-Cl-N3-O.C-H4-O3-S

Molecular Weight

  • 437.9456
 
* 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

  • Ethanamine, 2-((1-(4-chlorophenyl)-4-phenyl-1H-pyrazol-3-yl)oxy)-N,N-dimethyl-, monomethanesulfonate

Registry Numbers

CAS Registry Number

  • 62833-13-0

System Generated Number

  • 0062833130

Molecular Formulas

Molecular Formula

  • C19-H20-Cl-N3-O.C-H4-O3-S

Molecular Formula Fragments

  • C-H4-O3-S
  • C19-H20-Cl-N3-O
  • COMPONENT

Structure Descriptors

InChI

1S/C19H20ClN3O.CH4O3S/c1-22(2)12-13-24-19-18(15-6-4-3-5-7-15)14-23(21-19)17-10-8-16(20)9-11-17;1-5(2,3)4/h3-11,14H,12-13H2,1-2H3;1H3,(H,2,3,4)

InChIKey

PKBCTTYSDWKYTD-UHFFFAOYSA-N

Smiles

CN(C)CCOc1c(cn(n1)c2ccc(cc2)Cl)c3ccccc3.CS(=O)(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 150mg/kg (150mg/kg)   French Demande Patent Document. Vol. #2301250,
mouse LD50 intravenous 35mg/kg (35mg/kg)   French Demande Patent Document. Vol. #2301250,
mouse LD50 oral 700mg/kg (700mg/kg)   French Demande Patent Document. Vol. #2301250,