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Substance Name: Chloropent
RN: 39373-60-9
InChIKey: FKHVEXUWEQFKCJ-UHFFFAOYSA-L

Molecular Formula

  • C11-H18-N2-O3.C2-H3-Cl3-O2.H2-O4-S.Mg.Na

Molecular Weight

  • 535.034
 
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Names and Synonyms

Name of Substance

  • Chloropent

Synonyms

  • Chloropent
  • Equithesin

Systematic Name

  • Sulfuric acid magnesium salt (1:1), mixt. with 5-ethyl-5-(1-methylbutyl)-2,4,6(1H,3H,5H)-pyrimidinetrione monosodium salt and 2,2,2-trichloro-1,1-ethanediol

Registry Numbers

CAS Registry Number

  • 39373-60-9

System Generated Number

  • 0039373609

Molecular Formulas

Molecular Formula

  • C11-H18-N2-O3.C2-H3-Cl3-O2.H2-O4-S.Mg.Na

Molecular Formula Fragments

  • C11-H18-N2-O3
  • C2-H3-Cl3-O2
  • COMPONENT
  • H2-O4-S
  • Mg
  • Na

Structure Descriptors

InChI

1S/C11H18N2O3.C2H3Cl3O2.Mg.Na.H2O4S/c1-4-6-7(3)11(5-2)8(14)12-10(16)13-9(11)15;3-2(4,5)1(6)7;;;1-5(2,3)4/h7H,4-6H2,1-3H3,(H2,12,13,14,15,16);1,6-7H;;;(H2,1,2,3,4)/q;;+2;+1;/p-2

InChIKey

FKHVEXUWEQFKCJ-UHFFFAOYSA-L

Smiles

C(C(Cl)(Cl)Cl)(O)O.[Na+].C1(NC(C(C(N1)=O)([C@@H](CCC)C)CC)=O)=O.[Mg+2].S(=O)(=O)([O-])[O-]