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Substance Name: 2,5-Cyclohexadiene-1,4-diimine, N,N',2-trichloro-
RN: 3029-59-2
InChIKey: IIGYYCVYWIGCPW-MCIRJAFSSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C6-H3-Cl3-N2

Molecular Weight

  • 209.463
 
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Names and Synonyms

Synonyms

  • 0-07-00-00631 (Beilstein Handbook Reference)
  • BRN 3254239
  • N,N',2-Trichloro-2,5-cyclohexadiene-1,4-diimine
  • NSC 344550

Systematic Name

  • 2,5-Cyclohexadiene-1,4-diimine, N,N',2-trichloro-

Registry Numbers

CAS Registry Number

  • 3029-59-2

System Generated Number

  • 0003029592

Structure Descriptors

InChI

1S/C6H3Cl3N2/c7-5-3-4(10-8)1-2-6(5)11-9/h1-3H/b10-4+,11-6+

InChIKey

IIGYYCVYWIGCPW-MCIRJAFSSA-N

Smiles

C\1(=C\C(=N\Cl)C=CC1=N\Cl)Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 47mg/kg (47mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 19, Pg. 101, 1984.