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Substance Name: 1,3-Butanedione, 2-methylene-1-(2-phenyl-1H-indol-3-yl)-
RN: 62367-92-4
InChIKey: KEGUISXYUKAPBR-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H15-N-O2

Molecular Weight

  • 289.3325
 
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Names and Synonyms

Synonyms

  • 2-Methylene-1-(2-phenyl-1H-indol-3-yl)-1,3-butanedione
  • 5-21-11-00473 (Beilstein Handbook Reference)
  • BRN 1476246
  • Phenyl-2 (methylene-2' acetoacetyl)-3 indole
  • Phenyl-2 (methylene-2' acetoacetyl)-3 indole [French]

Systematic Name

  • 1,3-Butanedione, 2-methylene-1-(2-phenyl-1H-indol-3-yl)-

Registry Numbers

CAS Registry Number

  • 62367-92-4

System Generated Number

  • 0062367924

Structure Descriptors

InChI

1S/C19H15NO2/c1-12(13(2)21)19(22)17-15-10-6-7-11-16(15)20-18(17)14-8-4-3-5-9-14/h3-11,20H,1H2,2H3

InChIKey

KEGUISXYUKAPBR-UHFFFAOYSA-N

Smiles

CC(=O)C(=C)C(=O)c1c2ccccc2[nH]c1c3ccccc3

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD oral > 500mg/kg (500mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 11, Pg. 471, 1976.