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Substance Name: Butalbital sodium
RN: 23554-70-3
UNII: BBH31P2ABJ
InChIKey: LIZXGILRVOONMO-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C11-H16-N2-O3.Na

Molecular Weight

  • 246.2405
 
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Names and Synonyms

Results Name

  • Butalbital sodium

Name of Substance

  • Butalbital sodium

Synonyms

  • 5-Allyl-5-isobutylbarbituric acid sodium salt
  • Butalbital sodium
  • EINECS 245-732-3
  • Sodium sandoptal
  • UNII-BBH31P2ABJ

Systematic Names

  • 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-(2-methylpropyl)-5-(2-propenyl)-, monosodium salt (9CI)
  • Barbituric acid, 5-allyl-5-isobutyl-, sodium deriv. (7CI)
  • Barbituric acid, 5-allyl-5-isobutyl-, sodium salt
  • Sodium 5-allyl-5-isobutylbarbiturate

Registry Numbers

CAS Registry Number

  • 23554-70-3

FDA UNII

  • BBH31P2ABJ

Related Registry Number

  • 77-26-9 (Parent)

System Generated Number

  • 0023554703

Molecular Formulas

Molecular Formula

  • C11-H16-N2-O3.Na

Molecular Formula Fragments

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

Structure Descriptors

InChI

1S/C11H16N2O3.Na/c1-4-5-11(6-7(2)3)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

LIZXGILRVOONMO-UHFFFAOYSA-M

Smiles

CC(C)CC1(C(=O)NC(=NC1=O)[O-])CC=C.[Na+]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LDLo subcutaneous 175mg/kg (175mg/kg)   Journal of the American Chemical Society. Vol. 47, Pg. 2236, 1925.