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Substance Name: Tritox
RN: 8068-36-8
InChIKey: RWMJZZIENLZZJH-PMSOZOQUSA-N

Molecular Formula

  • C16-H15-Cl3-O2.C14-H9-Cl5.C6-H6-Cl6

Molecular Weight

  • 990.973
 
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Names and Synonyms

Results Name

  • Tritox

Synonym

  • Tritox 50

Systematic Name

  • Benzene, 1,1'-(2,2,2-trichloroethylidene)bis(4-chloro-, mixt. with (1alpha,2alpha,3beta,4aalpha,5alpha,6beta)-1,2,3,4,5,6-hexachlorocyclohexane and 1,1'-(2,2,2-trichloroethylidene)bis(4-methoxybenzene)

Registry Numbers

CAS Registry Number

  • 8068-36-8

System Generated Number

  • 0008068368

Molecular Formulas

Molecular Formula

  • C16-H15-Cl3-O2.C14-H9-Cl5.C6-H6-Cl6

Molecular Formula Fragments

  • C14-H9-Cl5
  • C16-H15-Cl3-O2
  • C6-H6-Cl6
  • COMPONENT

Structure Descriptors

InChI

1S/C16H15Cl3O2.C14H9Cl5.C6H6Cl6/c1-20-13-7-3-11(4-8-13)15(16(17,18)19)12-5-9-14(21-2)10-6-12;15-11-5-1-9(2-6-11)13(14(17,18)19)10-3-7-12(16)8-4-10;7-1-2(8)4(10)6(12)5(11)3(1)9/h3-10,15H,1-2H3;1-8,13H;1-6H/t;;1-,2-,3-,4+,5+,6+

InChIKey

RWMJZZIENLZZJH-PMSOZOQUSA-N

Smiles

c1c(ccc(C(c2ccc(cc2)OC)C(Cl)(Cl)Cl)c1)OC.Cl[C@H]1[C@H](Cl)[C@@H]([C@H]([C@@H]([C@@H]1Cl)Cl)Cl)Cl.c1c(ccc(c1)C(c1ccc(cc1)Cl)C(Cl)(Cl)Cl)Cl