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Substance Name: Barbituric acid, 5-(1-methyl-1-butenyl)-5-propyl-, sodium salt
RN: 66842-96-4
InChIKey: AWXPPOZMNZTQRJ-WVLIHFOGSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H18-N2-O3.Na

Molecular Weight

  • 260.2673
 
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Names and Synonyms

Synonym

  • 5-(1-Methyl-1-butenyl)-5-propylbarbituric acid sodium salt

Systematic Name

  • Barbituric acid, 5-(1-methyl-1-butenyl)-5-propyl-, sodium salt

Registry Numbers

CAS Registry Number

  • 66842-96-4

System Generated Number

  • 0066842964

Molecular Formulas

Molecular Formula

  • C12-H18-N2-O3.Na

Molecular Formula Fragments

  • C12-H18-N2-O3
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C12H18N2O3.Na/c1-4-6-8(3)12(7-5-2)9(15)13-11(17)14-10(12)16;/h6H,4-5,7H2,1-3H3,(H2,13,14,15,16,17);/q;+1/p-1/b8-6+;

InChIKey

AWXPPOZMNZTQRJ-WVLIHFOGSA-M

Smiles

[Na+].CCCC1(\C(=C\CC)\C)C(=O)NC(=O)[N-]C1=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
dog LD50 oral 104mg/kg (104mg/kg)   Journal of Pharmacology and Experimental Therapeutics. Vol. 68, Pg. 22, 1940.
rat LD50 oral 245mg/kg (245mg/kg)   Journal of Pharmacology and Experimental Therapeutics. Vol. 68, Pg. 22, 1940.