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Substance Name: 1H-Indole-3-acetonitrile, 2,3-dihydro-2-oxo-
RN: 54744-66-0
InChIKey: HGYKSFCCBATMSI-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C10-H8-N2-O

Molecular Weight

  • 172.186
 
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Names and Synonyms

Synonyms

  • 2,3-Dihydro-2-oxo-1H-indole-3-acetonitrile
  • 4-22-00-03046 (Beilstein Handbook Reference)
  • BRN 0151303

Systematic Name

  • 1H-Indole-3-acetonitrile, 2,3-dihydro-2-oxo-

Registry Numbers

CAS Registry Number

  • 54744-66-0

System Generated Number

  • 0054744660

Structure Descriptors

InChI

1S/C10H8N2O/c11-6-5-8-7-3-1-2-4-9(7)12-10(8)13/h1-4,8H,5H2,(H,12,13)

InChIKey

HGYKSFCCBATMSI-UHFFFAOYSA-N

Smiles

C1(Nc2ccccc2[C@@H]1CC#N)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 1378mg/kg (1378mg/kg)   Yakugaku Zasshi. Journal of Pharmacy. Vol. 94, Pg. 1620, 1974.