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Substance Name: Barbituric acid, 5-(2-bromoallyl)-5-(2-methylallyl)-, sodium salt
ID: CQ11500000
InChIKey: JQBNTMUXTOLIMW-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C11-H13-Br-N2-O3.Na

Molecular Weight

  • 323.1208
 
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Names and Synonyms

Synonyms

  • 5-(2-Bromoallyl)-5-(2-methylallyl)barbituric acid sodium salt
  • Sodium 5-(2-bromoallyl)-5-(2-methylallyl)barbiturate

Systematic Name

  • Barbituric acid, 5-(2-bromoallyl)-5-(2-methylallyl)-, sodium salt

Registry Numbers

ID Number

  • NIOSH/CQ1150000

System Generated Number

  • CQ11500000

Molecular Formulas

Molecular Formula

  • C11-H13-Br-N2-O3.Na

Molecular Formula Fragments

  • C11-H13-Br-N2-O3
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C11H13BrN2O3.Na/c1-6(2)4-11(5-7(3)12)8(15)13-10(17)14-9(11)16;/h1,3-5H2,2H3,(H2,13,14,15,16,17);/q;+1/p-1

InChIKey

JQBNTMUXTOLIMW-UHFFFAOYSA-M

Smiles

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