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Substance Name: Benzofuran, 2-cyanoacetyl-
RN: 5149-69-9
InChIKey: GCABLKFGYPIVFC-UHFFFAOYSA-N

Molecular Formula

  • C11-H7-N-O2

Molecular Weight

  • 185.181
 
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Names and Synonyms

Synonyms

  • 2-Benzo-furanacetonitrile
  • 2-Benzofuranpropanenitrile, beta-oxo-
  • 2-Benzofuranpropionitrile, beta-oxo-
  • 2-Cyanoacetylcoumarone
  • 4-18-00-05598 (Beilstein Handbook Reference)
  • BRN 0146419
  • USAF KF-4

Systematic Name

  • Benzofuran, 2-cyanoacetyl-

Registry Numbers

CAS Registry Number

  • 5149-69-9

System Generated Number

  • 0005149699

Structure Descriptors

InChI

1S/C11H7NO2/c12-6-5-9(13)11-7-8-3-1-2-4-10(8)14-11/h1-4,7H,5H2

InChIKey

GCABLKFGYPIVFC-UHFFFAOYSA-N

Smiles

c12c(oc(c1)C(CC#N)=O)cccc2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
guinea pig LD50 skin > 20mL/kg (20mL/kg)   Kodak Company Reports. Vol. 21MAY1971,
mouse LD50 intraperitoneal 100mg/kg (100mg/kg)   National Technical Information Service. Vol. AD277-689,
rat LDLo intraperitoneal 800mg/kg (800mg/kg)   Kodak Company Reports. Vol. 21MAY1971,
rat LDLo oral 3200mg/kg (3200mg/kg)   Kodak Company Reports. Vol. 21MAY1971,