10-Bromo-1,2,3,4,5,6,7,8,13,13,14,14-dodecachloro-1,4,4a,4b,5,8,8a,12b-octahydro-11-nitro-1,4:5,8-dimethanotriphenylene

CAS Registry Number®

84605-00-5
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CAS Name

10-Bromo-1,2,3,4,5,6,7,8,13,13,14,14-dodecachloro-1,4,4a,4b,5,8,8a,12b-octahydro-11-nitro-1,4:5,8-dimethanotriphenylene

Molecular Formula

C20H6BrCl12NO2

Molecular Mass

797.61

Cite this Page

10-Bromo-1,2,3,4,5,6,7,8,13,13,14,14-dodecachloro-1,4,4a,4b,5,8,8a,12b-octahydro-11-nitro-1,4:5,8-dimethanotriphenylene.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=84605-00-5 (retrieved 2024-04-28) (CAS RN: 84605-00-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C20H6BrCl12NO2/c21-5-1-3-4(2-6(5)34(35)36)8-10(18(29)14(25)12(23)16(8,27)20(18,32)33)9-7(3)15(26)11(22)13(24)17(9,28)19(15,30)31/h1-2,7-10H

InChIKey

InChIKey=PQCIWCLZNVPWIH-UHFFFAOYSA-N

SMILES

ClC12C3C4C(C=5C(C3C(Cl)(C1(Cl)Cl)C(Cl)=C2Cl)=CC(Br)=C(N(=O)=O)C5)C6(Cl)C(Cl)(Cl)C4(Cl)C(Cl)=C6Cl

Canonical SMILES

O=N(=O)C=1C=C2C(=CC1Br)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-bromo-1,2,3,4,5,6,7,8,13,13,14,14-dodecachloro-1,4,4a,4b,5,8,8a,12b-octahydro-11-nitro-
  • 10-Bromo-1,2,3,4,5,6,7,8,13,13,14,14-dodecachloro-1,4,4a,4b,5,8,8a,12b-octahydro-11-nitro-1,4:5,8-dimethanotriphenylene
  • NSC 270727

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