3-Methylsulfonyl-2,2′,3′,4′,5,5′-hexachlorobiphenyl

CAS Registry Number®

104086-18-2
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CAS Name

3-Methylsulfonyl-2,2′,3′,4′,5,5′-hexachlorobiphenyl

Molecular Formula

C13H6Cl6O2S

Molecular Mass

438.97

Cite this Page

3-Methylsulfonyl-2,2′,3′,4′,5,5′-hexachlorobiphenyl.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=104086-18-2 (retrieved 2024-09-03) (CAS RN: 104086-18-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C13H6Cl6O2S/c1-22(20,21)9-3-5(14)2-6(10(9)16)7-4-8(15)12(18)13(19)11(7)17/h2-4H,1H3

InChIKey

InChIKey=NHJGVSCWGWTJEF-UHFFFAOYSA-N

SMILES

ClC1=C(C=C(Cl)C=C1S(C)(=O)=O)C2=C(Cl)C(Cl)=C(Cl)C(Cl)=C2

Canonical SMILES

O=S(=O)(C=1C=C(Cl)C=C(C1Cl)C=2C=C(Cl)C(Cl)=C(Cl)C2Cl)C

Other Names for this Substance

  • 1,1′-Biphenyl, 2,2′,3,4,5,5′-hexachloro-3′-(methylsulfonyl)-
  • 2,2′,3,4,5,5′-Hexachloro-3′-(methylsulfonyl)-1,1′-biphenyl
  • 3-Methylsulfonyl-2,2′,3′,4′,5,5′-hexachlorobiphenyl
  • 3′-Methylsulfonyl-2,3,4,5,2′,5′-hexachlorobiphenyl