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Substance Name: o-Acetotoluidide, 6'-chloro-2-(p-chlorobenzyl(2-(diethylamino)ethyl)amino)-, dihydrochloride
RN: 77966-38-2
InChIKey: XGOCQYAXNACGKF-UHFFFAOYSA-N

Classification Codes

  • Drug / Therapeutic Agent
  • Skin / Eye Irritant

Molecular Formula

  • C22-H29-Cl2-N3-O.2Cl-H

Molecular Weight

  • 495.319
 
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Names and Synonyms

Synonyms

  • 6'-Chloro-2-(p-chlorobenzyl(2-(diethylamino)ethyl)amino)-o-acetototuidide dihydrochloride
  • C 5364

Systematic Name

  • o-Acetotoluidide, 6'-chloro-2-(p-chlorobenzyl(2-(diethylamino)ethyl)amino)-, dihydrochloride

Registry Numbers

CAS Registry Number

  • 77966-38-2

System Generated Number

  • 0077966382

Molecular Formulas

Molecular Formula

  • C22-H29-Cl2-N3-O.2Cl-H

Molecular Formula Fragments

  • C22-H29-Cl2-N3-O
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C22H29Cl2N3O.2ClH/c1-4-26(5-2)13-14-27(15-18-9-11-19(23)12-10-18)16-21(28)25-22-17(3)7-6-8-20(22)24;;/h6-12H,4-5,13-16H2,1-3H3,(H,25,28);2*1H

InChIKey

XGOCQYAXNACGKF-UHFFFAOYSA-N

Smiles

c1(NC(C[N@@H+](Cc2ccc(Cl)cc2)CC[NH+](CC)CC)=O)c(cccc1Cl)C.[ClH-].[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous 240mg/kg (240mg/kg)   Arzneimittel-Forschung. Drug Research. Vol. 9, Pg. 167, 1959.
rat LD50 intraperitoneal 103mg/kg (103mg/kg)   Arzneimittel-Forschung. Drug Research. Vol. 9, Pg. 167, 1959.