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Substance Name: Sulfone, 2-chlorocyclohexyl 2,4-dinitrophenyl
RN: 73927-13-6
InChIKey: GQLQCMKDSNJDKL-UHFFFAOYSA-N

Molecular Formula

  • C12-H13-Cl-N2-O6-S

Molecular Weight

  • 348.762
 
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Names and Synonyms

Synonyms

  • 1-(2-Chlorocyclohexylsulfonyl)-2,4-dinitrobenzene
  • 2-Chlorocyclohexyl 2,4-dinitrophenyl sulfone
  • 4-06-00-01742 (Beilstein Handbook Reference)
  • BRN 3223929
  • NSC 405645
  • Sulfone, 2-chlorocyclohexyl 2,4-dinitrophenyl

Systematic Names

  • Benzene, 1-((2-chlorocyclohexyl)sulfonyl)-2,4-dinitro- (9CI)
  • Sulfone, 2-chlorocyclohexyl 2,4-dinitrophenyl

Registry Numbers

CAS Registry Number

  • 73927-13-6

System Generated Number

  • 0073927136

Structure Descriptors

InChI

1S/C12H13ClN2O6S/c13-9-3-1-2-4-11(9)22(20,21)12-6-5-8(14(16)17)7-10(12)15(18)19/h5-7,9,11H,1-4H2

InChIKey

GQLQCMKDSNJDKL-UHFFFAOYSA-N

Smiles

S(c1c([N+]([O-])=O)cc([N+]([O-])=O)cc1)([C@@H]1[C@@H](Cl)CCCC1)(=O)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 180mg/kg (180mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#01902,