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Substance Name: 1,4-Benzenedicarbonitrile, 2-fluoro-
RN: 1897-53-6
InChIKey: DULBJBXBNLVFBI-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C8-H3-F-N2

Molecular Weight

  • 146.124
 
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Names and Synonyms

Synonyms

  • 2-Fluoro-1,4-benzenedicarbonitrile
  • 2-Fluoroterephthalonitrile
  • Terephthalonitrile, fluoro-

Systematic Name

  • 1,4-Benzenedicarbonitrile, 2-fluoro-

Registry Numbers

CAS Registry Number

  • 1897-53-6

System Generated Number

  • 0001897536

Structure Descriptors

InChI

1S/C8H3FN2/c9-8-3-6(4-10)1-2-7(8)5-11/h1-3H

InChIKey

DULBJBXBNLVFBI-UHFFFAOYSA-N

Smiles

c1(cc(C#N)ccc1C#N)F

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.