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Substance Name: N,N-Bis(2-chloroethyl)-3-chloropropionamidine oxalate
RN: 102999-09-7
InChIKey: PMWJYHRMRAFGFB-UHFFFAOYSA-N

Molecular Formula

  • C7-H13-Cl3-N2.C2-H2-O4

Molecular Weight

  • 321.5865
 
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Names and Synonyms

Results Name

  • N,N-Bis(2-chloroethyl)-3-chloropropionamidine oxalate

Synonyms

  • 3-Chloro-N,N-bis(2-chloroethyl)propanimidamide ethanedioate (1:1)
  • N,N-Bis(2-chloroethyl)-3-chloropropionamidine oxalate

Systematic Name

  • Propanimidamide, 3-chloro-N,N-bis(2-chloroethyl)-, ethanedioate (1:1)

Registry Numbers

CAS Registry Number

  • 102999-09-7

Related Registry Number

  • 89353-72-0 (Parent)

System Generated Number

  • 0102999097

Molecular Formulas

Molecular Formula

  • C7-H13-Cl3-N2.C2-H2-O4

Molecular Formula Fragments

  • C2-H2-O4
  • C7-H13-Cl3-N2
  • COMPONENT

Structure Descriptors

InChI

1S/C7H13Cl3N2.C2H2O4/c8-2-1-7(11)12(5-3-9)6-4-10;3-1(4)2(5)6/h11H,1-6H2;(H,3,4)(H,5,6)

InChIKey

PMWJYHRMRAFGFB-UHFFFAOYSA-N

Smiles

C(CCl)C(=N)N(CCCl)CCCl.C(=O)(C(=O)O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 64mg/kg (64mg/kg)   Khimiko-Farmatsevticheskii Zhurnal. Chemical Pharmaceutical Journal. For English translation, see PCJOAU. Vol. 20, Pg. 420, 1986.