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Substance Name: Barbituric acid, 5-(2-butenyl)-5-(1-methylbutyl)-, sodium salt
RN: 67050-09-3
InChIKey: RVBOLRYYVSQULC-CVDVRWGVSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H20-N2-O3.Na

Molecular Weight

  • 274.294
 
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Names and Synonyms

Synonyms

  • 5-(2-Butenyl)-5-(1-methylbutyl)barbituric acid sodium salt
  • 5-Crotyl-5-(1-methylbutyl)barbituric acid sodium salt

Systematic Name

  • Barbituric acid, 5-(2-butenyl)-5-(1-methylbutyl)-, sodium salt

Registry Numbers

CAS Registry Number

  • 67050-09-3

System Generated Number

  • 0067050093

Molecular Formulas

Molecular Formula

  • C13-H20-N2-O3.Na

Molecular Formula Fragments

  • C13-H20-N2-O3
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C13H20N2O3.Na/c1-4-6-8-13(9(3)7-5-2)10(16)14-12(18)15-11(13)17;/h4,6,9H,5,7-8H2,1-3H3,(H2,14,15,16,17,18);/q;+1/p-1/b6-4+;

InChIKey

RVBOLRYYVSQULC-CVDVRWGVSA-M

Smiles

C1([C@@](C(N=C(N1)[O-])=O)([C@@H](CCC)C)C\C=C\C)=O.[Na+]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 intraperitoneal 189mg/kg (189mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

BEHAVIORAL: TREMOR
Journal of the American Pharmaceutical Association, Scientific Edition. Vol. 34, Pg. 183, 1945.