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Substance Name: 1-Propanone, 3-(bis(2-chloroethyl)amino)-1-phenyl-, hydrochloride
RN: 25223-87-4
InChIKey: ZZXCEJDMVQLVCN-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H17-Cl2-N-O.Cl-H

Molecular Weight

  • 310.65
 
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Names and Synonyms

Synonyms

  • 3-(Bis(2-chloroethyl)amino)-1-phenyl-1-propanone hydrochloride
  • beta-(Bis(2-chloraethyl)amino)propiophenon-hydrochlorid
  • beta-(Bis(2-chloraethyl)amino)propiophenon-hydrochlorid [German]

Systematic Name

  • 1-Propanone, 3-(bis(2-chloroethyl)amino)-1-phenyl-, hydrochloride

Registry Numbers

CAS Registry Number

  • 25223-87-4

System Generated Number

  • 0025223874

Molecular Formulas

Molecular Formula

  • C13-H17-Cl2-N-O.Cl-H

Molecular Formula Fragments

  • C13-H17-Cl2-N-O
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C13H17Cl2NO.ClH/c14-7-10-16(11-8-15)9-6-13(17)12-4-2-1-3-5-12;/h1-5H,6-11H2;1H

InChIKey

ZZXCEJDMVQLVCN-UHFFFAOYSA-N

Smiles

C(CCN(CCCl)CCCl)(=O)c1ccccc1.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intramuscular 34mg/kg (34mg/kg)   Archiv der Pharmazie Vol. 306, Pg. 64, 1973.
rat LD50 intramuscular 13mg/kg (13mg/kg)   Archiv der Pharmazie Vol. 306, Pg. 64, 1973.