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Substance Name: Barbituric acid, 5-allyl-5-(1-ethylpropyl)-, sodium salt
RN: 66941-67-1
InChIKey: RATUQZWWQVVSFO-UHFFFAOYSA-M

Molecular Formula

  • C12-H18-N2-O3.Na

Molecular Weight

  • 260.267
 
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Names and Synonyms

Synonym

  • Diethylcarbinylallylbarbituric acid sodium salt

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 66941-67-1

System Generated Number

  • 0066941671

Molecular Formulas

Molecular Formula

  • C12-H18-N2-O3.Na

Molecular Formula Fragments

  • C12-H18-N2-O3
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C12H18N2O3.Na/c1-4-7-12(8(5-2)6-3)9(15)13-11(17)14-10(12)16;/h4,8H,1,5-7H2,2-3H3,(H2,13,14,15,16,17);/q;+1/p-1

InChIKey

RATUQZWWQVVSFO-UHFFFAOYSA-M

Smiles

C([C@@]1(C(NC([O-])=NC1=O)=O)CC=C)(CC)CC.[Na+]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rabbit LDLo intraperitoneal 60mg/kg (60mg/kg)   Journal of the American Chemical Society. Vol. 56, Pg. 1139, 1934.
rat LDLo intraperitoneal 110mg/kg (110mg/kg)   Journal of the American Chemical Society. Vol. 56, Pg. 2490, 1934.