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Substance Name: 1,4-Benzenedicarbonitrile, 2-(diethylamino)-3,5,6-trifluoro-
RN: 67205-69-0
InChIKey: BDQIFSKVJYMSJT-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H10-F3-N3

Molecular Weight

  • 253.226
 
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Names and Synonyms

Synonyms

  • 2-(Diethylamino)-3,5,6-trifluoro-1,4-benzenedicarbonitrile
  • BRN 2869228

Systematic Name

  • 1,4-Benzenedicarbonitrile, 2-(diethylamino)-3,5,6-trifluoro-

Registry Numbers

CAS Registry Number

  • 67205-69-0

System Generated Number

  • 0067205690

Structure Descriptors

InChI

1S/C12H10F3N3/c1-3-18(4-2)12-8(6-17)10(14)9(13)7(5-16)11(12)15/h3-4H2,1-2H3

InChIKey

BDQIFSKVJYMSJT-UHFFFAOYSA-N

Smiles

CCN(CC)c1c(c(c(c(c1F)C#N)F)F)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.