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Substance Name: 3-Buten-2-one, 4-(5-nitro-2-furanyl)- (9CI)
RN: 3455-61-6
InChIKey: AYSGEAZAKMPTSE-NSCUHMNNSA-N

Molecular Formula

  • C8-H7-N-O4

Molecular Weight

  • 181.146
 
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Names and Synonyms

Synonyms

  • 3-Buten-2-one, 4-(5-nitro-2-furyl)-
  • 4-(5-Nitro-2-furyl)-3-butene-2-one
  • AI3-23619
  • NF 150
  • NSC 58181

Systematic Names

  • 3-Buten-2-one, 4-(5-nitro-2-furanyl)- (9CI)
  • 3-Buten-2-one, 4-(5-nitro-2-furyl)-

Registry Numbers

CAS Registry Number

  • 3455-61-6

System Generated Number

  • 0003455616

Structure Descriptors

InChI

1S/C8H7NO4/c1-6(10)2-3-7-4-5-8(13-7)9(11)12/h2-5H,1H3/b3-2+

InChIKey

AYSGEAZAKMPTSE-NSCUHMNNSA-N

Smiles

c1(oc([N+](=O)[O-])cc1)\C=C\C(C)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 56mg/kg (56mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#05855,