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Substance Name: Acrylophenone, 3-(5-nitro-2-furyl)-
RN: 4332-88-1
InChIKey: ZLDNVNUDRJJGII-VURMDHGXSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H9-N-O4

Molecular Weight

  • 243.217
 
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Names and Synonyms

Synonyms

  • 3-(5-Nitro-2-furanyl)-1-phenyl-2-propen-1-one
  • 3-(5-Nitro-2-furyl)acrylophenone

Systematic Names

  • 2-Propen-1-one, 3-(5-nitro-2-furanyl)-1-phenyl- (9CI)
  • Acrylophenone, 3-(5-nitro-2-furyl)-

Registry Numbers

CAS Registry Number

  • 4332-88-1

System Generated Number

  • 0004332881

Structure Descriptors

InChI

1S/C13H9NO4/c15-12(10-4-2-1-3-5-10)8-6-11-7-9-13(18-11)14(16)17/h1-9H/b8-6-

InChIKey

ZLDNVNUDRJJGII-VURMDHGXSA-N

Smiles

c1(oc([N+](=O)[O-])cc1)\C=C/C(c1ccccc1)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 80mg/kg (80mg/kg)   Bulletin de la Societe de Pharmacie de Bordeaux. Vol. 117, Pg. 101, 1978.