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Substance Name: Ethylenediamine, N-allyl-N',N'-bis(2-chloroethyl)-N-methyl-, dipicrate
RN: 101468-24-0
InChIKey: DWJTUPOOCOKQAR-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C10-H20-Cl2-N2.2C6-H3-N3-O7

Molecular Weight

  • 697.395
 
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Names and Synonyms

Synonym

  • N-Allyl-N',N'-bis(2-chloroethyl)-N-methylethylenediamine dipicrate

Systematic Name

  • Ethylenediamine, N-allyl-N',N'-bis(2-chloroethyl)-N-methyl-, dipicrate

Registry Numbers

CAS Registry Number

  • 101468-24-0

System Generated Number

  • 0101468240

Molecular Formulas

Molecular Formula

  • C10-H20-Cl2-N2.2C6-H3-N3-O7

Molecular Formula Fragments

  • C10-H20-Cl2-N2
  • C6-H3-N3-O7
  • COMPONENT

Structure Descriptors

InChI

1S/C10H20Cl2N2.2C6H3N3O7/c1-3-6-13(2)9-10-14(7-4-11)8-5-12;2*10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h3H,1,4-10H2,2H3;2*1-2,10H

InChIKey

DWJTUPOOCOKQAR-UHFFFAOYSA-N

Smiles

c1(c(c(cc(c1)[N+](=O)[O-])[N+](=O)[O-])[O-])[N+](=O)[O-].c1(c(c(cc(c1)[N+](=O)[O-])[N+](=O)[O-])[O-])[N+](=O)[O-].[NH+](CC[N@@H+](CC=C)C)(CCCl)CCCl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 intraperitoneal 38mg/kg (38mg/kg)   Chemical and Pharmaceutical Bulletin. Vol. 9, Pg. 343, 1961.