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Substance Name: 1H-Benzotriazole, 1-(2-(N-(2-chloroethyl)-N-ethylamino)ethyl)-, hydrochloride
RN: 69766-31-0
InChIKey: CKXKLAMYUCKSQG-UHFFFAOYSA-N

Molecular Formula

  • C12-H17-Cl-N4.Cl-H

Molecular Weight

  • 289.208
 
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Names and Synonyms

Synonyms

  • 1-(2-(N-(2-Chloroethyl)-N-ethylamino)ethyl)-1H-benzotriazole hydrochloride
  • Triethylamine, 2-(1H-benzotriazol-1-yl)-2'-chloro-, hydrochloride

Systematic Name

  • 1H-Benzotriazole, 1-(2-(N-(2-chloroethyl)-N-ethylamino)ethyl)-, hydrochloride

Registry Numbers

CAS Registry Number

  • 69766-31-0

System Generated Number

  • 0069766310

Molecular Formulas

Molecular Formula

  • C12-H17-Cl-N4.Cl-H

Molecular Formula Fragments

  • C12-H17-Cl-N4
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C12H17ClN4.ClH/c1-2-16(8-7-13)9-10-17-12-6-4-3-5-11(12)14-15-17;/h3-6H,2,7-10H2,1H3;1H

InChIKey

CKXKLAMYUCKSQG-UHFFFAOYSA-N

Smiles

c12n(nnc1cccc2)CC[N@@H+](CCCl)CC.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous 500mg/kg (500mg/kg)   Journal of Pharmacology and Experimental Therapeutics. Vol. 97, Pg. 25, 1949.