Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Acetic acid, (4-chlorophenoxy)-, 2-(hexahydro-1H-azepin-1-yl)ethyl ester, hydrochloride
RN: 71783-90-9
InChIKey: HZOXOFGNIWMWQZ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H22-Cl-N-O3.Cl-H

Molecular Weight

  • 348.268
 
* 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

Synonym

  • (4-Chlorophenoxy)acetic acid 2-(hexahydro-1H-azepin-1-yl)ethyl ester hydrochloride

Systematic Name

  • Acetic acid, (4-chlorophenoxy)-, 2-(hexahydro-1H-azepin-1-yl)ethyl ester, hydrochloride

Registry Numbers

CAS Registry Number

  • 71783-90-9

System Generated Number

  • 0071783909

Molecular Formulas

Molecular Formula

  • C16-H22-Cl-N-O3.Cl-H

Molecular Formula Fragments

  • C16-H22-Cl-N-O3
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C16H22ClNO3.ClH/c17-14-5-7-15(8-6-14)21-13-16(19)20-12-11-18-9-3-1-2-4-10-18;/h5-8H,1-4,9-13H2;1H

InChIKey

HZOXOFGNIWMWQZ-UHFFFAOYSA-N

Smiles

c1(ccc(Cl)cc1)OCC(OCC[NH+]1CCCCCC1)=O.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 320mg/kg (320mg/kg) BEHAVIORAL: EXCITEMENT Acta Poloniae Pharmaceutica. For English translation, see APPFAR. Vol. 39, Pg. 361, 1982.