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Substance Name: Barbituric acid, 5-allyl-5-sec-butyl-, sodium salt
RN: 24396-96-1
InChIKey: RBZZNXPMQIRASI-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-sec-butylbarbituric acid sodium salt

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 24396-96-1

System Generated Number

  • 0024396961

Molecular Formulas

Molecular Formula

  • C11-H16-N2-O3.Na

Molecular Formula Fragments

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

Structure Descriptors

InChI

1S/C11H16N2O3.Na/c1-4-6-11(7(3)5-2)8(14)12-10(16)13-9(11)15;/h4,7H,1,5-6H2,2-3H3,(H2,12,13,14,15,16);/q;+1/p-1

InChIKey

RBZZNXPMQIRASI-UHFFFAOYSA-M

Smiles

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

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LDLo intraperitoneal 110mg/kg (110mg/kg)   Journal of the American Chemical Society. Vol. 55, Pg. 4649, 1933.
rat LDLo subcutaneous 90mg/kg (90mg/kg)   Journal of the American Chemical Society. Vol. 47, Pg. 2236, 1925.