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Substance Name: 1,3-Cyclohexanedione, 2-(2-chloro-4-(methylsulfonyl)-3-((2,2,2-trifluoroethoxy)methyl)benzoyl)-, ion(1-), potassium (1:1)
RN: 1121649-70-4
InChIKey: LUBCTOAHXYIDLB-UHFFFAOYSA-N

Classification Codes

  • TSCA Flag PMN (a Commenced PMN (Premanufacture Notice) Substance)
  • TSCA Flag S (Substance is Identified in a Final Significant New Use Rule)

Molecular Formula

  • C17-H15-Cl-F3-O6-S.K

Molecular Weight

  • 478.9105
 
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Names and Synonyms

  • 1,3-Cyclohexanedione, 2-(2-chloro-4-(methylsulfonyl)-3-((2,2,2-trifluoroethoxy)methyl)benzoyl)-, ion(1-), potassium (1:1)

Registry Numbers

CAS Registry Number

  • 1121649-70-4

System Generated Number

  • 1121649704

Structure Descriptors

InChI

1S/C17H15ClF3O6S.K/c1-28(25,26)13-6-5-9(15(18)10(13)7-27-8-17(19,20)21)16(24)14-11(22)3-2-4-12(14)23;/h5-6H,2-4,7-8H2,1H3;/q-1;+1

InChIKey

LUBCTOAHXYIDLB-UHFFFAOYSA-N

Smiles

[K+].CS(=O)(=O)c1ccc(C(=O)[C-]2C(=O)CCCC2=O)c(Cl)c1COCC(F)(F)F