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Substance Name: Butylamine, N,N-bis(2-chloroethyl)-3-chloro-, hydrochloride
RN: 64058-51-1
InChIKey: AJLQXEQUKXLZMN-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C8-H16-Cl3-N.Cl-H

Molecular Weight

  • 269.041
 
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Names and Synonyms

Synonym

  • 3-Chlorobutyl-bis(2-chloroethyl)amine hydrochloride

Systematic Name

  • Butylamine, N,N-bis(2-chloroethyl)-3-chloro-, hydrochloride

Registry Numbers

CAS Registry Number

  • 64058-51-1

System Generated Number

  • 0064058511

Molecular Formulas

Molecular Formula

  • C8-H16-Cl3-N.Cl-H

Molecular Formula Fragments

  • C8-H16-Cl3-N
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C8H16Cl3N.ClH/c1-8(11)2-5-12(6-3-9)7-4-10;/h8H,2-7H2,1H3;1H

InChIKey

AJLQXEQUKXLZMN-UHFFFAOYSA-N

Smiles

C(CN(CCCl)CCCl)[C@@H](Cl)C.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 8130ug/kg (8.13mg/kg)   Cancer Vol. 2, Pg. 1075, 1949.