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Substance Name: Barbituric acid, 5-allyl-5-butyl-, sodium salt
RN: 66941-51-3
InChIKey: NANMAFDKQDPUHA-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C11-H16-N2-O3.Na

Molecular Weight

  • 246.24
 
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Names and Synonyms

Synonym

  • 5-Allyl-5-butylbarbituric acid sodium salt

Systematic Name

  • Barbituric acid, 5-allyl-5-butyl-, sodium salt

Registry Numbers

CAS Registry Number

  • 66941-51-3

System Generated Number

  • 0066941513

Molecular Formulas

Molecular Formula

  • C11-H16-N2-O3.Na

Molecular Formula Fragments

  • C11-H16-N2-O3
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C11H16N2O3.Na/c1-3-5-7-11(6-4-2)8(14)12-10(16)13-9(11)15;/h4H,2-3,5-7H2,1H3,(H2,12,13,14,15,16);/q;+1/p-1

InChIKey

NANMAFDKQDPUHA-UHFFFAOYSA-M

Smiles

C1([C@@](C(N=C(N1)[O-])=O)(CCCC)CC=C)=O.[Na+]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LDLo subcutaneous 270mg/kg (270mg/kg)   Journal of the American Chemical Society. Vol. 47, Pg. 2236, 1925.