1,4:5,8-Dimethanotriphenylene-10-sulfonic acid, 1,2,3,4,5,6,7,8,13,13,14,14-dodecachloro-1,4,4a,4b,5,8,8a,12b-octahydro-, magnesium salt

CAS Registry Number®

83878-02-8
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CAS Name

1,4:5,8-Dimethanotriphenylene-10-sulfonic acid, 1,2,3,4,5,6,7,8,13,13,14,14-dodecachloro-1,4,4a,4b,5,8,8a,12b-octahydro-, magnesium salt

Molecular Formula

C20H8Cl12O3S.1/2Mg

Cite this Page

1,4:5,8-Dimethanotriphenylene-10-sulfonic acid, 1,2,3,4,5,6,7,8,13,13,14,14-dodecachloro-1,4,4a,4b,5,8,8a,12b-octahydro-, magnesium salt.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=83878-02-8 (retrieved 2021-10-17) (CAS RN: 83878-02-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C20H8Cl12O3S.Mg/c21-11-13(23)17(27)9-7(15(11,25)19(17,29)30)5-2-1-4(36(33,34)35)3-6(5)8-10(9)18(28)14(24)12(22)16(8,26)20(18,31)32;/h1-3,7-10H,(H,33,34,35);

InChIKey

InChIKey=DQPVUMQJZGJFKY-UHFFFAOYSA-N

SMILES

ClC12C3C4C(C=5C(C3C(Cl)(C1(Cl)Cl)C(Cl)=C2Cl)=CC(S(=O)(=O)O)=CC5)C6(Cl)C(Cl)(Cl)C4(Cl)C(Cl)=C6Cl.[Mg]

Canonical SMILES

[Mg].O=S(=O)(O)C1=CC=C2C(=C1)C3C(C4C2C5(Cl)C(Cl)=C(Cl)C4(Cl)C5(Cl)Cl)C6(Cl)C(Cl)=C(Cl)C3(Cl)C6(Cl)Cl

Other Names for this Substance

  • 1,4:5,8-Dimethanotriphenylene-10-sulfonic acid, 1,2,3,4,5,6,7,8,13,13,14,14-dodecachloro-1,4,4a,4b,5,8,8a,12b-octahydro-, magnesium salt