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Substance Name: 2-Propen-1-one, 3-(5-nitro-2-furanyl)-1-(4-nitrophenyl)-
RN: 4544-82-5
InChIKey: WSBHCZOAVRMSAS-FNORWQNLSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H8-N2-O6

Molecular Weight

  • 288.214
 
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Names and Synonyms

Synonym

  • 3-(5-Nitro-2-furanyl)-1-(4-nitrophenyl)-2-propen-1-one

Systematic Name

  • 2-Propen-1-one, 3-(5-nitro-2-furanyl)-1-(4-nitrophenyl)-

Registry Numbers

CAS Registry Number

  • 4544-82-5

System Generated Number

  • 0004544825

Structure Descriptors

InChI

1S/C13H8N2O6/c16-12(9-1-3-10(4-2-9)14(17)18)7-5-11-6-8-13(21-11)15(19)20/h1-8H/b7-5+

InChIKey

WSBHCZOAVRMSAS-FNORWQNLSA-N

Smiles

C(\C=C\c1oc(cc1)[N+](=O)[O-])(=O)c1ccc(cc1)[N+](=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 1500mg/kg (1500mg/kg)   Bulletin de la Societe de Pharmacie de Bordeaux. Vol. 117, Pg. 101, 1978.