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Substance Name: 7H-Adenine, N-(p-fluorophenyl)-
RN: 73663-95-3
InChIKey: SCRHVVOELSYCSO-UHFFFAOYSA-N

Molecular Formula

  • C11-H8-F-N5

Molecular Weight

  • 229.217
 
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Names and Synonyms

Synonyms

  • 7H-Adenine, N-(p-fluorophenyl)-
  • N-(p-Fluorophenyl)adenine
  • NSC 21554

Systematic Names

  • 1H-Purin-6-amine, N-(4-fluorophenyl)- (9CI)
  • 7H-Adenine, N-(p-fluorophenyl)-

Registry Numbers

CAS Registry Number

  • 73663-95-3

System Generated Number

  • 0073663953

Structure Descriptors

InChI

1S/C11H8FN5/c12-7-1-3-8(4-2-7)17-11-9-10(14-5-13-9)15-6-16-11/h1-6H,(H2,13,14,15,16,17)

InChIKey

SCRHVVOELSYCSO-UHFFFAOYSA-N

Smiles

c12c(Nc3ccc(F)cc3)ncnc1nc[nH]2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 180mg/kg (180mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#03050,