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Substance Name: Barbituric acid, 5-allyl-5-phenethyl-, sodium salt
RN: 66941-85-3
InChIKey: HBZCBDNKNMSRQB-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H16-N2-O3.Na

Molecular Weight

  • 294.284
 
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Names and Synonyms

Synonym

  • 5-Allyl-5-phenethylbarbituric acid sodium salt

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 66941-85-3

System Generated Number

  • 0066941853

Molecular Formulas

Molecular Formula

  • C15-H16-N2-O3.Na

Molecular Formula Fragments

  • C15-H16-N2-O3
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C15H16N2O3.Na/c1-2-9-15(10-8-11-6-4-3-5-7-11)12(18)16-14(20)17-13(15)19;/h2-7H,1,8-10H2,(H2,16,17,18,19,20);/q;+1/p-1

InChIKey

HBZCBDNKNMSRQB-UHFFFAOYSA-M

Smiles

C1([C@@](C(N=C(N1)[O-])=O)(CCc1ccccc1)CC=C)=O.[Na+]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LDLo intraperitoneal 250mg/kg (250mg/kg)   Journal of the American Chemical Society. Vol. 63, Pg. 2991, 1941.