4-(Methylsulfonyl)-PCB 149
CAS Registry Number®
116806-76-9
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CAS Name
4-(Methylsulfonyl)-PCB 149Molecular Formula
C13H6Cl6O2SMolecular Mass
438.97Cite this Page
4-(Methylsulfonyl)-PCB 149. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=116806-76-9 (retrieved ) (CAS RN: 116806-76-9). 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)10-4-9(17)11(13(19)12(10)18)5-2-7(15)8(16)3-6(5)14/h2-4H,1H3
InChIKey
InChIKey=KGAUWQDQUNCYKK-UHFFFAOYSA-N
SMILES
ClC1=C(C(Cl)=CC(S(C)(=O)=O)=C1Cl)C2=C(Cl)C=C(Cl)C(Cl)=C2
Canonical SMILES
O=S(=O)(C1=CC(Cl)=C(C(Cl)=C1Cl)C=2C=C(Cl)C(Cl)=CC2Cl)C
Other Names for this Substance
- 1,1′-Biphenyl, 2,2′,3,4′,5′,6-hexachloro-4-(methylsulfonyl)-
- 2,2′,3,4′,5′,6-Hexachloro-4-(methylsulfonyl)-1,1′-biphenyl
- 4-(Methylsulfonyl)-2,2′,3,4′,5′,6-hexachlorobiphenyl
- 4′-Methylsulfonyl-2,4,5,2′,3′,6′-hexachlorobiphenyl
- 4-(Methylsulfonyl)-PCB 149