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Substance Name: Barbituric acid, 5-isobutyl-5-isopropyl-, sodium salt
ID: CQ70726850
InChIKey: MCSAYXWBUMMGJS-UHFFFAOYSA-M

Molecular Formula

  • C11-H17-N2-O3.Na

Molecular Weight

  • 248.2563
 
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Names and Synonyms

Synonyms

  • 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-(1-methylethyl)-5-(2-methylpropyl)-, sodium salt
  • Sodium 5-isobutyl-5-isopropylbarbiturate

Systematic Name

  • Barbituric acid, 5-isobutyl-5-isopropyl-, sodium salt

Registry Numbers

ID Number

  • NIOSH/CQ7072685

System Generated Number

  • CQ70726850

Molecular Formulas

Molecular Formula

  • C11-H17-N2-O3.Na

Molecular Formula Fragments

  • C11-H17-N2-O3
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C11H18N2O3.Na/c1-6(2)5-11(7(3)4)8(14)12-10(16)13-9(11)15;/h6-7H,5H2,1-4H3,(H2,12,13,14,15,16);/q;+1/p-1

InChIKey

MCSAYXWBUMMGJS-UHFFFAOYSA-M

Smiles

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