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Substance Name: Barbituric acid, 5-allyl-5-(1-methylallyl)-, sodium salt
RN: 66941-75-1
InChIKey: QBYVWFWLROQVTF-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C11-H14-N2-O3.Na

Molecular Weight

  • 244.225
 
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Names and Synonyms

Synonym

  • 5-Allyl-5-(1-methylallyl)barbituric acid sodium salt

Systematic Name

  • Barbituric acid, 5-allyl-5-(1-methylallyl)-, sodium salt

Registry Numbers

CAS Registry Number

  • 66941-75-1

System Generated Number

  • 0066941751

Molecular Formulas

Molecular Formula

  • C11-H14-N2-O3.Na

Molecular Formula Fragments

  • C11-H14-N2-O3
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C11H14N2O3.Na/c1-4-6-11(7(3)5-2)8(14)12-10(16)13-9(11)15;/h4-5,7H,1-2,6H2,3H3,(H2,12,13,14,15,16);/q;+1/p-1

InChIKey

QBYVWFWLROQVTF-UHFFFAOYSA-M

Smiles

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

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 intraperitoneal 136mg/kg (136mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

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