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Substance Name: 1,3-Benzenedicarbonitrile, 4-(butylamino)-2,5,6-trichloro-
RN: 67205-46-3
InChIKey: DBTOVRABLPDBDR-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H10-Cl3-N3

Molecular Weight

  • 302.591
 
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Names and Synonyms

Synonyms

  • 4-(Butylamino)-2,5,6-trichloro-1,3-benzenedicarbonitrile
  • BRN 2875470

Systematic Name

  • 1,3-Benzenedicarbonitrile, 4-(butylamino)-2,5,6-trichloro-

Registry Numbers

CAS Registry Number

  • 67205-46-3

System Generated Number

  • 0067205463

Structure Descriptors

InChI

1S/C12H10Cl3N3/c1-2-3-4-18-12-8(6-17)9(13)7(5-16)10(14)11(12)15/h18H,2-4H2,1H3

InChIKey

DBTOVRABLPDBDR-UHFFFAOYSA-N

Smiles

CCCCNc1c(c(c(c(c1Cl)Cl)C#N)Cl)C#N

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 300mg/kg (300mg/kg)   Journal of Medicinal Chemistry. Vol. 21, Pg. 906, 1978.